diff --git a/.github/workflows/check-node.yml b/.github/workflows/check-node.yml
new file mode 100644
index 0000000..8baea94
--- /dev/null
+++ b/.github/workflows/check-node.yml
@@ -0,0 +1,119 @@
+name: Check Node packages
+
+on:
+  workflow_call:
+
+permissions:
+  contents: read
+
+jobs:
+  version:
+    runs-on: ubuntu-latest
+    steps:
+      - uses: actions/checkout@v7
+      - uses: actions/setup-python@v7
+        with:
+          python-version: "3.12"
+      - run: python tests/check_release_version.py
+
+  build:
+    needs: version
+    runs-on: ${{ matrix.host }}
+    strategy:
+      fail-fast: false
+      matrix:
+        include:
+          - host: windows-latest
+            target: x86_64-pc-windows-msvc
+            flags: ""
+          - host: windows-11-arm
+            target: aarch64-pc-windows-msvc
+            flags: ""
+          - host: macos-15-intel
+            target: x86_64-apple-darwin
+            flags: ""
+          - host: macos-latest
+            target: aarch64-apple-darwin
+            flags: ""
+          - host: ubuntu-latest
+            target: x86_64-unknown-linux-gnu
+            flags: --use-napi-cross
+          - host: ubuntu-latest
+            target: aarch64-unknown-linux-gnu
+            flags: --use-napi-cross
+    steps:
+      - uses: actions/checkout@v7
+      - uses: actions/setup-node@v7
+        with:
+          node-version: "24"
+          cache: npm
+          cache-dependency-path: node/package-lock.json
+      - uses: dtolnay/rust-toolchain@stable
+        with:
+          targets: ${{ matrix.target }}
+      - run: npm ci
+        working-directory: node
+      - name: Build native binding and loader
+        working-directory: node
+        run: npm run build -- --target ${{ matrix.target }} ${{ matrix.flags }} -- --locked
+      - uses: actions/upload-artifact@v7
+        with:
+          name: bindings-${{ matrix.target }}
+          path: |
+            node/geddes.*.node
+            node/index.js
+            node/index.d.ts
+          if-no-files-found: error
+
+  pack:
+    needs: build
+    runs-on: ubuntu-latest
+    steps:
+      - uses: actions/checkout@v7
+      - uses: actions/setup-node@v7
+        with:
+          node-version: "24"
+          cache: npm
+          cache-dependency-path: node/package-lock.json
+      - run: npm ci
+        working-directory: node
+      - uses: actions/download-artifact@v8
+        with:
+          pattern: bindings-*
+          path: node/artifacts
+      - name: Pack the JS package and all native packages
+        working-directory: node
+        run: npm run pack:release -- artifacts packages
+      - uses: actions/upload-artifact@v7
+        with:
+          name: node-packages
+          path: node/packages/*
+          if-no-files-found: error
+
+  install-test:
+    needs: pack
+    runs-on: ${{ matrix.host }}
+    strategy:
+      fail-fast: false
+      matrix:
+        host: [ubuntu-latest, ubuntu-24.04-arm, macos-15-intel, macos-latest, windows-latest, windows-11-arm]
+        node-version: ["16", "24"]
+        exclude:
+          - host: windows-11-arm
+            node-version: "16"
+        include:
+          # Node 16 has no Windows ARM64 distribution.
+          - host: windows-11-arm
+            node-version: "20"
+    steps:
+      - uses: actions/checkout@v7
+      - uses: actions/setup-node@v7
+        with:
+          node-version: ${{ matrix.node-version }}
+      - uses: actions/download-artifact@v8
+        with:
+          name: node-packages
+          path: node/packages
+      - name: Install tarballs and test the public loader
+        working-directory: node
+        run: npm run check:package -- packages
diff --git a/.github/workflows/check-packages.yml b/.github/workflows/check-packages.yml
new file mode 100644
index 0000000..4b0ae20
--- /dev/null
+++ b/.github/workflows/check-packages.yml
@@ -0,0 +1,23 @@
+name: Check packages
+
+on:
+  push:
+    branches: [main, dev]
+  pull_request:
+    branches: [main, dev]
+  workflow_dispatch:
+  workflow_call:
+
+permissions:
+  contents: read
+
+jobs:
+  rust:
+    name: Check Rust distribution
+    uses: ./.github/workflows/check-rust.yml
+  python:
+    name: Check Python distributions
+    uses: ./.github/workflows/check-python.yml
+  node:
+    name: Check Node distributions
+    uses: ./.github/workflows/check-node.yml
diff --git a/.github/workflows/check-python.yml b/.github/workflows/check-python.yml
new file mode 100644
index 0000000..b514660
--- /dev/null
+++ b/.github/workflows/check-python.yml
@@ -0,0 +1,82 @@
+name: check Python packages
+
+on:
+  workflow_call:
+
+permissions:
+  contents: read
+
+jobs:
+  version:
+    name: Package version agreement
+    runs-on: ubuntu-latest
+    steps:
+      - uses: actions/checkout@v7
+      - uses: actions/setup-python@v7
+        with:
+          python-version: "3.12"
+      - name: Check package and tag versions
+        run: python tests/check_release_version.py
+
+  wheels:
+    name: Wheel / ${{ matrix.os }} / Python ${{ matrix.python-version }}
+    runs-on: ${{ matrix.os }}
+    needs: version
+    strategy:
+      fail-fast: false
+      matrix:
+        os: [ubuntu-latest, macos-latest, windows-latest]
+        python-version: ["3.10", "3.11", "3.12", "3.13", "3.14"]
+    steps:
+      - name: Checkout code
+        uses: actions/checkout@v7
+      - name: Set up Python
+        uses: actions/setup-python@v7
+        with:
+          python-version: ${{ matrix.python-version }}
+      - name: Build manylinux wheel
+        if: matrix.os == 'ubuntu-latest'
+        uses: PyO3/maturin-action@v1
+        with:
+          command: build
+          args: --release --locked --out dist -i python${{ matrix.python-version }}
+          manylinux: auto
+      - name: Build wheel
+        if: matrix.os != 'ubuntu-latest'
+        uses: PyO3/maturin-action@v1
+        with:
+          command: build
+          args: --release --locked --out dist -i python
+      - name: Install and test the built wheel
+        run: python tests/check_python_package.py --dist-dir dist --kind wheel
+      - name: Upload checked wheel
+        uses: actions/upload-artifact@v7
+        with:
+          name: checked-python-wheel-${{ matrix.os }}-${{ matrix.python-version }}
+          path: dist/*.whl
+          if-no-files-found: error
+
+  sdist:
+    name: Source distribution / Python 3.12
+    runs-on: ubuntu-latest
+    needs: version
+    steps:
+      - name: Checkout code
+        uses: actions/checkout@v7
+      - name: Set up Python
+        uses: actions/setup-python@v7
+        with:
+          python-version: "3.12"
+      - name: Build source distribution
+        uses: PyO3/maturin-action@v1
+        with:
+          command: sdist
+          args: --out dist
+      - name: Build, install, and test the source distribution
+        run: python tests/check_python_package.py --dist-dir dist --kind sdist
+      - name: Upload checked source distribution
+        uses: actions/upload-artifact@v7
+        with:
+          name: checked-python-sdist
+          path: dist/*.tar.gz
+          if-no-files-found: error
diff --git a/.github/workflows/check-rust.yml b/.github/workflows/check-rust.yml
new file mode 100644
index 0000000..f19f36d
--- /dev/null
+++ b/.github/workflows/check-rust.yml
@@ -0,0 +1,42 @@
+name: Check Rust package
+
+on:
+  workflow_dispatch:
+  workflow_call:
+
+permissions:
+  contents: read
+
+jobs:
+  checked-crate:
+    name: Rust crate (${{ matrix.os }})
+    runs-on: ${{ matrix.os }}
+    strategy:
+      fail-fast: false
+      matrix:
+        os: [ubuntu-latest, macos-latest, windows-latest]
+    steps:
+      - uses: actions/checkout@v7
+      - uses: actions/setup-python@v6
+        with:
+          python-version: "3.12"
+      - uses: dtolnay/rust-toolchain@stable
+      - name: Check package versions and tag
+        id: version
+        run: python tests/check_release_version.py
+      - name: Test release version validation
+        run: python -m unittest discover -s tests -p release_version_cases.py
+      - name: Test repository sources
+        run: cargo test --locked
+      - name: Package and verify the distributable crate
+        run: cargo package --locked
+      - name: Test the unpacked distributable crate
+        working-directory: target/package/geddes-${{ steps.version.outputs.version }}
+        run: cargo test --locked
+      - name: Retain the checked crate
+        uses: actions/upload-artifact@v7
+        with:
+          name: checked-rust-crate-${{ matrix.os }}
+          path: target/package/*.crate
+          if-no-files-found: error
+          retention-days: 7
diff --git a/.github/workflows/docs.yml b/.github/workflows/docs.yml
new file mode 100644
index 0000000..ee2ee86
--- /dev/null
+++ b/.github/workflows/docs.yml
@@ -0,0 +1,62 @@
+name: Documentation
+
+on:
+  push:
+    branches: [main]
+    paths:
+      - "docs/**"
+      - "overrides/**"
+      - "zensical.toml"
+      - "requirements-docs.txt"
+      - ".github/workflows/docs.yml"
+  pull_request:
+    branches: [main]
+    paths:
+      - "docs/**"
+      - "overrides/**"
+      - "zensical.toml"
+      - "requirements-docs.txt"
+      - ".github/workflows/docs.yml"
+  workflow_dispatch:
+
+permissions:
+  contents: read
+
+jobs:
+  build:
+    runs-on: ubuntu-latest
+    steps:
+      - uses: actions/checkout@v7
+      - uses: actions/setup-python@v6
+        with:
+          python-version: "3.12"
+          cache: pip
+          cache-dependency-path: requirements-docs.txt
+      - name: Install documentation dependencies
+        run: python -m pip install -r requirements-docs.txt
+      - name: Build documentation
+        run: zensical build --clean --strict
+      - name: Upload generated site
+        uses: actions/upload-pages-artifact@v5
+        with:
+          path: site/
+
+  deploy:
+    if: github.ref == 'refs/heads/main' && github.event_name != 'pull_request'
+    needs: build
+    runs-on: ubuntu-latest
+    permissions:
+      pages: write
+      id-token: write
+    environment:
+      name: github-pages
+      url: ${{ steps.deployment.outputs.page_url }}
+    concurrency:
+      group: github-pages
+      cancel-in-progress: false
+    steps:
+      - name: Configure GitHub Pages
+        uses: actions/configure-pages@v6
+      - name: Deploy documentation
+        id: deployment
+        uses: actions/deploy-pages@v5
diff --git a/.github/workflows/publish-npm.yml b/.github/workflows/publish-npm.yml
index 64d274c..951fd53 100644
--- a/.github/workflows/publish-npm.yml
+++ b/.github/workflows/publish-npm.yml
@@ -12,136 +12,31 @@ on:
         default: "no"
 
 permissions:
-  contents: write
-  id-token: write
+  contents: read
 
 jobs:
-  build-bindings:
-    runs-on: ${{ matrix.host }}
-    strategy:
-      fail-fast: false
-      matrix:
-        include:
-          - host: windows-latest
-            target: x86_64-pc-windows-msvc
-            build: npm run build -- --target x86_64-pc-windows-msvc
-          - host: windows-latest
-            target: aarch64-pc-windows-msvc
-            build: npm run build -- --target aarch64-pc-windows-msvc
-          - host: macos-latest
-            target: x86_64-apple-darwin
-            build: npm run build -- --target x86_64-apple-darwin
-          - host: macos-latest
-            target: aarch64-apple-darwin
-            build: npm run build -- --target aarch64-apple-darwin
-          - host: ubuntu-latest
-            target: x86_64-unknown-linux-gnu
-            build: npm run build -- --target x86_64-unknown-linux-gnu --use-napi-cross
-          - host: ubuntu-latest
-            target: aarch64-unknown-linux-gnu
-            build: npm run build -- --target aarch64-unknown-linux-gnu --use-napi-cross
-
-    steps:
-      - name: Checkout code
-        uses: actions/checkout@v7
-
-      - name: Setup Node
-        uses: actions/setup-node@v7
-        with:
-          node-version: "24"
-          cache: "npm"
-          cache-dependency-path: node/package-lock.json
-
-      - name: Setup Rust toolchain
-        uses: dtolnay/rust-toolchain@stable
-        with:
-          targets: ${{ matrix.target }}
-
-      - name: Install Node dependencies
-        working-directory: node
-        run: npm ci
-
-      - name: Build native binding
-        working-directory: node
-        run: ${{ matrix.build }}
-
-      - name: Upload artifact
-        uses: actions/upload-artifact@v7
-        with:
-          name: bindings-${{ matrix.target }}
-          path: node/geddes.*.node
-          if-no-files-found: error
+  check:
+    uses: ./.github/workflows/check-node.yml
 
   publish:
     runs-on: ubuntu-latest
-    needs: build-bindings
+    needs: check
     if: github.event_name == 'push' || inputs.publishToNPM == 'yes'
     permissions:
-      contents: write
+      contents: read
       id-token: write
     steps:
-      - name: Checkout code
-        uses: actions/checkout@v7
-
-      - name: Setup Node
-        uses: actions/setup-node@v7
+      - uses: actions/checkout@v7
+      - uses: actions/setup-node@v7
         with:
           node-version: "24"
-          cache: "npm"
-          cache-dependency-path: node/package-lock.json
           registry-url: "https://registry.npmjs.org"
-
       - name: Upgrade npm for trusted publishing
         run: npm install -g npm@^11.10.0
-
-      - name: Install Node dependencies
-        working-directory: node
-        run: npm ci
-
-      - name: Sync Node package version from Cargo.toml
-        working-directory: node
-        run: npm run sync:version
-
-      - name: Determine npm dist-tag
-        id: dist_tag
-        working-directory: node
-        run: |
-          VERSION="$(node -p "require('./package.json').version")"
-          if [[ "$VERSION" == *-* ]]; then
-            TAG="next"
-          else
-            TAG="latest"
-          fi
-          echo "tag=$TAG" >> "$GITHUB_OUTPUT"
-          echo "Using npm dist-tag '$TAG' for version '$VERSION'"
-
-      - name: Create npm target directories
-        working-directory: node
-        run: npx napi create-npm-dirs
-
-      - name: Download all native artifacts
-        uses: actions/download-artifact@v8
+      - uses: actions/download-artifact@v8
         with:
-          pattern: bindings-*
-          path: node/artifacts
-          merge-multiple: true
-
-      - name: Move artifacts into npm package dirs
-        working-directory: node
-        run: npx napi artifacts --output-dir artifacts
-
-      - name: Dry-run prepublish
-        working-directory: node
-        run: npx napi prepublish -t npm --dry-run
-
-      - name: Prepublish native packages
-        working-directory: node
-        run: npx napi prepublish -t npm
-        env:
-          GITHUB_TOKEN: ${{ github.token }}
-          GH_TOKEN: ${{ github.token }}
-          NPM_CONFIG_TAG: ${{ steps.dist_tag.outputs.tag }}
-
-      - name: Publish JS package
+          name: node-packages
+          path: node/packages
+      - name: Publish the tested tarballs
         working-directory: node
-        run: npm publish --ignore-scripts --provenance --access public --tag "${{ steps.dist_tag.outputs.tag }}"
+        run: npm run publish:packages -- packages
diff --git a/.github/workflows/publish-pypi.yml b/.github/workflows/publish-pypi.yml
index 0df48ff..bc0929c 100644
--- a/.github/workflows/publish-pypi.yml
+++ b/.github/workflows/publish-pypi.yml
@@ -10,68 +10,25 @@ on:
         required: true
         default: 'no'
 permissions:
-  contents: write
-  pull-requests: write
+  contents: read
 jobs:
-  build-wheels:
-    runs-on: ${{ matrix.os }}
-    strategy:
-      matrix:
-        os: [ubuntu-latest, macos-latest, windows-latest]
-        python-version: ["3.10", "3.11", "3.12", "3.13", "3.14"]
-    steps:
-      - name: Checkout code
-        uses: actions/checkout@v7
-      - name: Set up Python
-        uses: actions/setup-python@v7
-        with:
-          python-version: ${{ matrix.python-version }}
-      - name: Build wheels with maturin (manylinux)
-        if: matrix.os == 'ubuntu-latest'
-        uses: PyO3/maturin-action@v1
-        with:
-          command: build
-          args: --release --out dist -i python${{ matrix.python-version }}
-          manylinux: auto
-      - name: Build wheels with maturin
-        if: matrix.os != 'ubuntu-latest'
-        uses: PyO3/maturin-action@v1
-        with:
-          command: build
-          args: --release --out dist -i python${{ matrix.python-version }}
-      - name: Upload wheel artifact
-        uses: actions/upload-artifact@v7
-        with:
-          name: wheels-${{ matrix.os }}-${{ matrix.python-version }}
-          path: dist/*.whl
-          if-no-files-found: error
+  check:
+    uses: ./.github/workflows/check-python.yml
   publish:
     runs-on: ubuntu-latest
-    needs: build-wheels
+    needs: check
     if: github.event_name == 'push' || inputs.publishToPyPI == 'yes'
     environment:
       name: pypi
       url: https://pypi.org/project/geddes/
     permissions:
-      contents: write
-      pull-requests: write
+      contents: read
       id-token: write
     steps:
-      - name: Checkout code
-        uses: actions/checkout@v7
-      - name: Set up Python
-        uses: actions/setup-python@v7
-        with:
-          python-version: "3.12"
-      - name: Build sdist with maturin
-        uses: PyO3/maturin-action@v1
-        with:
-          command: sdist
-          args: --out dist
-      - name: Download wheel artifacts
+      - name: Download checked distributions
         uses: actions/download-artifact@v8
         with:
-          pattern: wheels-*
+          pattern: checked-python-*
           path: dist
           merge-multiple: true
       - name: Publish package to PyPI
diff --git a/.github/workflows/publish-rust.yml b/.github/workflows/publish-rust.yml
index 1df4780..c3ca0df 100644
--- a/.github/workflows/publish-rust.yml
+++ b/.github/workflows/publish-rust.yml
@@ -15,7 +15,11 @@ permissions:
   contents: read
 
 jobs:
+  checked-crate:
+    uses: ./.github/workflows/check-rust.yml
+
   publish:
+    needs: checked-crate
     runs-on: ubuntu-latest
     if: github.event_name == 'push' || inputs.publishToCrates == 'yes'
     steps:
@@ -25,15 +29,11 @@ jobs:
       - name: Setup Rust toolchain
         uses: dtolnay/rust-toolchain@stable
 
-      - name: Validate tag matches Cargo.toml version
-        if: github.event_name == 'push'
-        run: |
-          TAG_VERSION="${GITHUB_REF_NAME#v}"
-          CARGO_VERSION="$(grep -m1 '^version = ' Cargo.toml | sed -E 's/version = "([^"]+)"/\1/')"
-          if [ "$TAG_VERSION" != "$CARGO_VERSION" ]; then
-            echo "Tag version ($TAG_VERSION) does not match Cargo.toml version ($CARGO_VERSION)"
-            exit 1
-          fi
+      - uses: actions/setup-python@v6
+        with:
+          python-version: "3.12"
+      - name: Validate package versions and tag
+        run: python tests/check_release_version.py
 
       - name: Publish crate to crates.io
         run: cargo publish --locked
diff --git a/.github/workflows/release.yml b/.github/workflows/release.yml
index 457af39..dbfb807 100644
--- a/.github/workflows/release.yml
+++ b/.github/workflows/release.yml
@@ -12,12 +12,14 @@ permissions:
   contents: read
 
 jobs:
-  create-tag:
+  preflight:
     runs-on: ubuntu-latest
-    env:
-      RELEASE_TRIGGER_TOKEN: ${{ secrets.RELEASE_TRIGGER_TOKEN }}
+    outputs:
+      release_tag: ${{ steps.version.outputs.tag }}
     steps:
       - name: Ensure release trigger token is configured
+        env:
+          RELEASE_TRIGGER_TOKEN: ${{ secrets.RELEASE_TRIGGER_TOKEN }}
         run: |
           if [ -z "$RELEASE_TRIGGER_TOKEN" ]; then
             echo "Missing secret RELEASE_TRIGGER_TOKEN."
@@ -30,36 +32,47 @@ jobs:
         uses: actions/checkout@v7
         with:
           fetch-depth: 0
-          token: ${{ secrets.RELEASE_TRIGGER_TOKEN }}
-
-      - name: Validate input version matches Cargo.toml
-        id: validate
-        run: |
-          INPUT_VERSION="${{ inputs.version }}"
-          RELEASE_VERSION="${INPUT_VERSION#v}"
-          CARGO_VERSION="$(grep -m1 '^version = ' Cargo.toml | sed -E 's/version = "([^"]+)"/\1/')"
-
-          if [ "$RELEASE_VERSION" != "$CARGO_VERSION" ]; then
-            echo "Input version ($RELEASE_VERSION) does not match Cargo.toml version ($CARGO_VERSION)."
-            exit 1
-          fi
+      - uses: actions/setup-python@v6
+        with:
+          python-version: "3.12"
 
-          echo "release_version=$RELEASE_VERSION" >> "$GITHUB_OUTPUT"
-          echo "release_tag=v$RELEASE_VERSION" >> "$GITHUB_OUTPUT"
+      - name: Validate all package versions and the requested release
+        id: version
+        env:
+          REQUESTED_RELEASE_VERSION: ${{ inputs.version }}
+        run: python tests/check_release_version.py --version "$REQUESTED_RELEASE_VERSION"
 
       - name: Ensure tag does not already exist
+        env:
+          RELEASE_TAG: ${{ steps.version.outputs.tag }}
         run: |
-          TAG="${{ steps.validate.outputs.release_tag }}"
           git fetch --tags origin
-          if git ls-remote --tags origin "refs/tags/$TAG" | grep -q "$TAG"; then
-            echo "Tag $TAG already exists on origin."
+          EXISTING_RELEASE_TAG="$(git ls-remote --tags origin "refs/tags/$RELEASE_TAG")"
+          if [ -n "$EXISTING_RELEASE_TAG" ]; then
+            echo "Tag $RELEASE_TAG already exists on origin."
             exit 1
           fi
 
+  check-packages:
+    needs: preflight
+    uses: ./.github/workflows/check-packages.yml
+
+  create-tag:
+    needs: [preflight, check-packages]
+    runs-on: ubuntu-latest
+    steps:
+      - name: Checkout the checked commit
+        uses: actions/checkout@v7
+        with:
+          ref: ${{ github.sha }}
+          fetch-depth: 0
+          token: ${{ secrets.RELEASE_TRIGGER_TOKEN }}
       - name: Create and push release tag
+        env:
+          RELEASE_TAG: ${{ needs.preflight.outputs.release_tag }}
+          CHECKED_COMMIT: ${{ github.sha }}
         run: |
-          TAG="${{ steps.validate.outputs.release_tag }}"
           git config user.name "github-actions[bot]"
           git config user.email "github-actions[bot]@users.noreply.github.com"
-          git tag -a "$TAG" -m "release $TAG"
-          git push origin "$TAG"
+          git tag -a "$RELEASE_TAG" "$CHECKED_COMMIT" -m "release $RELEASE_TAG"
+          git push origin "$RELEASE_TAG"
diff --git a/.gitignore b/.gitignore
index e41dd89..ec31cb8 100644
--- a/.gitignore
+++ b/.gitignore
@@ -15,4 +15,10 @@ __pycache__/
 node/node_modules/
 node/npm/
 node/artifacts/
+node/packages/
 node/*.node
+
+# Documentation environment and generated site
+.venv-docs/
+/site/
+/.cache/
diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 6c27c31..d97495a 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -6,4 +6,7 @@ repos:
       - id: check-toml
       - id: check-yaml
       - id: end-of-file-fixer
+        # Preserve imported bytes and their recorded provenance hashes.
+        exclude: ^tests/data/formats/(real|licenses)/
       - id: trailing-whitespace
+        exclude: ^tests/data/formats/(real|licenses)/
diff --git a/CONTRIBUTING.md b/CONTRIBUTING.md
new file mode 100644
index 0000000..fa5bbfd
--- /dev/null
+++ b/CONTRIBUTING.md
@@ -0,0 +1,143 @@
+# Contributing to Geddes
+
+Run development commands from the Geddes repository root. The test suite checks
+file and byte loading, selections, format variants, malformed inputs, and the
+x/y-only API.
+
+## Run the tests
+
+### Python
+
+Rebuild the local extension in an activated Python environment, then run its tests:
+
+```sh
+python -m pip install -e ".[test]"
+python -m pytest tests/test_python.py -q
+```
+
+### Rust
+
+```sh
+cargo test
+```
+
+### Node.js
+
+```sh
+npm --prefix node install
+npm --prefix node run build
+node node/test.cjs
+```
+
+To test a separately built binding, set
+`GEDDES_BINDING=/absolute/path/to/geddes.node` before the Node command.
+
+See the [repository test guide](https://github.com/jcwang587/geddes/blob/main/tests/README.md)
+for more focused checks.
+
+## Fixture corpus
+
+The [fixture manifest](https://github.com/jcwang587/geddes/blob/main/tests/data/formats/manifest.json)
+records each file, scan or CIF block, expected point count, complete reference
+arrays, tolerances, and SHA-256 hashes. Tests compare every x and y value.
+Synthetic cases have explicitly specified arrays; experimental files exercise
+larger patterns and instrument-specific layouts.
+
+The [provenance record](https://github.com/jcwang587/geddes/blob/main/tests/data/formats/README.md)
+identifies original sources and licenses. Experimental fixtures were collected
+through [Rietx's pinned test corpus](https://github.com/yue-here/rietx/tree/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data),
+with source credit to APS/GSAS-II tutorials, NIST, NIMS, and FAIRmat. Geddes's
+authored fixtures are MIT licensed; imported files retain their source terms.
+
+The corpus preserves measured x/y rows even when a file has a zero uncertainty.
+For example, `11BM_NAC.fxye` contains 59,498 explicit rows despite its header's
+59,497 channel count. Its reference retains all 59,498 rows. Scrambled RAW4
+intensities test byte decoding and throughput, not physical-profile correctness.
+
+## Regenerate references
+
+[build_fixture_corpus.py](https://github.com/jcwang587/geddes/blob/main/tests/build_fixture_corpus.py)
+is a development tool requiring NumPy and gemmi:
+
+```sh
+python -m pip install numpy gemmi
+python tests/build_fixture_corpus.py
+```
+
+It uses literal synthetic arrays and independent, fixture-specific extraction
+with NumPy, Python XML/ZIP/`struct`, and gemmi's CIF grammar. It imports neither
+Geddes nor Rietx. Review regenerated array changes before accepting them; the
+reference needs to remain independent of the implementation being tested.
+
+To refresh the experimental inputs as well, supply a Rietx checkout at commit
+`88d2353f446d98632ef233437000cbe7bc4e1142`:
+
+```sh
+python tests/build_fixture_corpus.py --rietx-source /path/to/rietx
+```
+
+This copies the listed files and rebuilds references. It does not fetch or check
+the checkout's Git revision. Preserve provenance and license notices when
+updating the corpus.
+
+## Measure loading performance
+
+The separate `geddes-test` repository consumes the same manifest. Its README
+describes environment setup and report reproduction. Build Geddes in release
+mode before timing it.
+
+The benchmark validates full arrays before timing each reader. Unsupported
+inputs, wrong selections, and differing numerical results are reported
+separately and excluded from speed ratios. It does not interpolate, drop rows,
+or substitute a scan to make results agree.
+
+| Measurement | Timed work |
+|---|---|
+| Native API | Open, read, decompress when needed, parse, and return the native result |
+| NumPy x/y | The same call plus extracting x/y and creating NumPy float64 arrays |
+| Bytes only | Open and read the file without parsing |
+
+### What the timing measures
+
+Repeated calls measure warm OS-cache performance, including language binding
+overhead. They do not measure cold disk access. Imports, reference loading,
+correctness checks, plotting, and harness logging are outside the timer.
+Richer reader APIs may also calculate metadata or uncertainties, so timing
+comparisons describe each tool's public loading workload.
+
+Small synthetic profiles primarily expose fixed overhead; larger experimental
+files exercise parsing and decompression. Interpret ratios per file and format,
+and inspect exclusions before comparing timings.
+
+## Preview the documentation
+
+The documentation site uses Zensical. Create a dedicated environment and install
+the pinned documentation dependencies:
+
+### macOS / Linux
+
+```sh
+python -m venv .venv-docs
+.venv-docs/bin/python -m pip install -r requirements-docs.txt
+.venv-docs/bin/zensical serve
+```
+
+```sh
+.venv-docs/bin/zensical build --strict
+```
+
+### Windows (PowerShell)
+
+```powershell
+python -m venv .venv-docs
+.venv-docs\Scripts\python.exe -m pip install -r requirements-docs.txt
+.venv-docs\Scripts\zensical.exe serve
+```
+
+```powershell
+.venv-docs\Scripts\zensical.exe build --strict
+```
+
+The generated site is written to `site/`. The documentation workflow runs the
+same strict build and uploads the site as an artifact. Keep generated output
+and the documentation environment out of version control.
diff --git a/Cargo.lock b/Cargo.lock
index a2c1cd6..bff5db4 100644
--- a/Cargo.lock
+++ b/Cargo.lock
@@ -47,11 +47,12 @@ dependencies = [
 
 [[package]]
 name = "geddes"
-version = "0.5.0"
+version = "1.0.0"
 dependencies = [
  "pyo3",
  "quick-xml",
  "serde",
+ "serde_json",
  "thiserror",
  "zip",
 ]
@@ -78,6 +79,12 @@ dependencies = [
  "hashbrown",
 ]
 
+[[package]]
+name = "itoa"
+version = "1.0.18"
+source = "registry+https://github.com/rust-lang/crates.io-index"
+checksum = "8f42a60cbdf9a97f5d2305f08a87dc4e09308d1276d28c869c684d7777685682"
+
 [[package]]
 name = "libc"
 version = "0.2.186"
@@ -232,6 +239,19 @@ dependencies = [
  "syn 2.0.117",
 ]
 
+[[package]]
+name = "serde_json"
+version = "1.0.151"
+source = "registry+https://github.com/rust-lang/crates.io-index"
+checksum = "c841b55ecdae098c80dcae9cf767f6f8a0c2cdb3416bbef72181df4d0fe73f14"
+dependencies = [
+ "itoa",
+ "memchr",
+ "serde",
+ "serde_core",
+ "zmij",
+]
+
 [[package]]
 name = "simd-adler32"
 version = "0.3.9"
@@ -318,6 +338,12 @@ version = "0.6.3"
 source = "registry+https://github.com/rust-lang/crates.io-index"
 checksum = "3be3d40e40a133f9c916ee3f9f4fa2d9d63435b5fbe1bfc6d9dae0aa0ada1513"
 
+[[package]]
+name = "zmij"
+version = "1.0.23"
+source = "registry+https://github.com/rust-lang/crates.io-index"
+checksum = "29666d0abbfad1e3dc4dcf6144730dd3a3ab225bbbdac83319345b1b44ccfc1b"
+
 [[package]]
 name = "zopfli"
 version = "0.8.3"
diff --git a/Cargo.toml b/Cargo.toml
index 4127d37..a459ffc 100644
--- a/Cargo.toml
+++ b/Cargo.toml
@@ -1,10 +1,11 @@
 [package]
 name = "geddes"
-version = "0.5.0"
+version = "1.0.0"
 edition = "2021"
 description = "A Rust library for parsing XRD pattern files"
 license = "MIT"
 repository = "https://github.com/jcwang587/geddes"
+documentation = "https://jcwang587.github.io/geddes/"
 readme = "README.md"
 keywords = ["python", "rust", "parser", "reader", "xrd"]
 categories = ["science", "parsing"]
@@ -22,3 +23,6 @@ quick-xml = "0.41.0"
 [features]
 default = []
 python = ["pyo3"]
+
+[dev-dependencies]
+serde_json = "1"
diff --git a/LICENSE b/LICENSE
new file mode 100644
index 0000000..6a0e5a5
--- /dev/null
+++ b/LICENSE
@@ -0,0 +1,21 @@
+MIT License
+
+Copyright (c) 2026 Jiacheng Wang
+
+Permission is hereby granted, free of charge, to any person obtaining a copy
+of this software and associated documentation files (the "Software"), to deal
+in the Software without restriction, including without limitation the rights
+to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
+copies of the Software, and to permit persons to whom the Software is
+furnished to do so, subject to the following conditions:
+
+The above copyright notice and this permission notice shall be included in all
+copies or substantial portions of the Software.
+
+THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
+IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
+FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
+AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
+LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
+OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
+SOFTWARE.
diff --git a/README.md b/README.md
index ab79362..71c45a4 100644
--- a/README.md
+++ b/README.md
@@ -1,89 +1,50 @@
 # Geddes
 
-[![Crates.io](https://img.shields.io/crates/v/geddes)](https://crates.io/crates/geddes)
-[![PyPI](https://img.shields.io/pypi/v/geddes)](https://pypi.org/project/geddes/)
-[![npm](https://img.shields.io/npm/v/%40jcwang587%2Fgeddes)](https://www.npmjs.com/package/@jcwang587/geddes)
+Geddes reads XRD files into two arrays: `x` (2θ in degrees) and `y` (intensity).
+It is written in Rust, with Python and Node.js bindings.
 
+## Quick start
 
-A Rust XRD pattern parser with Python and Node.js bindings. Supports:
-- `.raw` (GSAS text or Bruker binary)
-- `.rasx` (Rigaku Zip archive)
-- `.xrdml` (Panalytical XML)
-- `.xy` / `.xye` (Space-separated ASCII)
-- `.csv` (Comma-separated values)
-
-## Rust Usage
-
-Load from a file path:
-
-```rust
-use geddes::read;
-
-fn main() {
-    let pattern = read("tests/data/xy/sample.xy").unwrap();
-    println!("{} {}", pattern.x.len(), pattern.y.len());
-}
-```
-
-Load from in-memory bytes (filename is used to infer the format):
-
-```rust
-use std::fs;
-
-use geddes::read_bytes;
-
-fn main() {
-    let data = fs::read("tests/data/xy/sample.xy").unwrap();
-    let pattern = read_bytes(&data, "sample.xy").unwrap();
-    println!("{} {}", pattern.x.len(), pattern.y.len());
-}
-```
-
-## Python Usage
-
-Load from a file path:
-
-```python
-import geddes
-
-pattern = geddes.read("tests/data/xy/sample.xy")
-print(len(pattern.x), len(pattern.y))
-```
-
-Load from in-memory bytes (filename is used to infer the format):
+### Python
 
 ```python
 import geddes
 
-with open("tests/data/xy/sample.xy", "rb") as f:
-    data = f.read()
-
-pattern = geddes.read_bytes(data, "sample.xy")
-print(len(pattern.x), len(pattern.y))
+pattern = geddes.read("sample.xy")
+x, y = pattern.x, pattern.y
 ```
 
-## Node.js Usage
+### Rust
 
-Load from a file path:
-
-```javascript
-const geddes = require('@jcwang587/geddes')
-
-const pattern = geddes.read('tests/data/xy/sample.xy')
-console.log(pattern.x.length, pattern.y.length)
+```rust
+fn main() -> Result<(), geddes::Error> {
+    let pattern = geddes::read("sample.xy")?;
+    let (x, y) = (pattern.x, pattern.y);
+    Ok(())
+}
 ```
 
-Load from in-memory bytes (filename is used to infer the format):
+### Node.js
 
 ```javascript
-const fs = require('node:fs')
 const geddes = require('@jcwang587/geddes')
 
-const bytes = fs.readFileSync('tests/data/xy/sample.xy')
-const pattern = geddes.readBytes(bytes, 'sample.xy')
-console.log(pattern.x.length, pattern.y.length)
+const { x, y } = geddes.read('sample.xy')
 ```
 
-## License
-
-MIT
+## Supported formats
+
+| Format | Extensions |
+|---|---|
+| Text | `.xy`, `.xye`, `.csv`, `.dat`, `.prn`, `.txt` |
+| GSAS | `.gsas`, `.gsa`, `.fxye`, `.gda`, `.xra`, `.raw` |
+| Bruker RAW | `.raw` |
+| RAS | `.ras` |
+| RASX | `.rasx` |
+| UXD | `.uxd` |
+| BRML | `.brml` |
+| XRDML | `.xrdml` |
+| CHI | `.chi` |
+| Powder CIF | `.cif` |
+
+See the [documentation](https://jcwang587.github.io/geddes/) for installation, usage, and format limits.
diff --git a/docs/api.md b/docs/api.md
new file mode 100644
index 0000000..2759e7a
--- /dev/null
+++ b/docs/api.md
@@ -0,0 +1,80 @@
+# API reference
+
+Read functions return one `Pattern` with nonempty, equally sized `x` and `y`
+arrays. Positions are 2theta in degrees; intensities follow the
+[file's conventions](reading-patterns.md#intensity-values).
+
+`index` defaults to `0` and selects a scan, range, or bank by its zero-based
+position in file order.
+`block` selects a powder CIF block by a case-sensitive name substring; the
+default is the first block containing a profile. CIF and single-pattern formats
+require `index=0`. Byte loaders use `filename` as a format hint without opening it.
+
+## Python
+
+```python
+geddes.read(path, *, index=0, block=None)
+geddes.read_bytes(data, filename, *, index=0, block=None)
+geddes.Pattern(x, y)
+```
+
+`path` and `filename` are strings; `data` is `bytes`. Pass `str(path)` for a path
+object. `index` is a nonnegative integer and `block` is a string or `None`.
+The returned pattern exposes `x` and `y` as Python lists. The constructor accepts
+two numeric sequences and requires finite values with strictly increasing x.
+
+File I/O failures raise `OSError`; format, parsing, and validation failures raise
+`ValueError`. Invalid argument types can raise `TypeError`.
+`geddes.__version__` gives the installed version.
+
+## Rust
+
+```rust
+pub struct Pattern {
+    pub x: Vec<f64>,
+    pub y: Vec<f64>,
+}
+
+pub struct ReadOptions {
+    pub index: usize,
+    pub block: Option<String>,
+}
+```
+
+| Function | Input |
+|---|---|
+| `read(path)` | File path |
+| `read_with_options(path, options)` | File path and selection |
+| `read_bytes(bytes, filename)` | Complete file bytes |
+| `read_bytes_with_options(bytes, filename, options)` | Bytes and selection |
+| `from_reader(reader, filename)` | Readable stream |
+| `from_reader_with_options(reader, filename, options)` | Stream and selection |
+| `Pattern::new(x, y)` | Two `Vec<f64>` arrays |
+
+Paths accept `impl AsRef<Path>`, bytes accept `impl AsRef<[u8]>`, and streams
+require `Read + Seek`. `filename` is `&str`; `options` is `&ReadOptions`.
+`ReadOptions::default()` selects index `0` with no block filter.
+
+All functions above return `Result<Pattern, geddes::Error>`. The non-exhaustive
+error enum covers I/O, ZIP, format, and parsing failures. `Pattern::new` requires
+finite values with strictly increasing x. Direct field mutation and Serde
+deserialization do not run its validation.
+
+## Node.js
+
+```typescript
+interface Pattern { x: number[]; y: number[] }
+interface ReadOptions { index?: number; block?: string }
+
+function read(path: string, options?: ReadOptions): Pattern
+function readBytes(
+  data: Buffer, filename: string, options?: ReadOptions
+): Pattern
+```
+
+Both functions are synchronous and throw on loading or parsing failures. Use a
+nonnegative integer representable as an unsigned 32-bit value for `index`.
+The result is a plain object; there is no Node.js `Pattern` constructor.
+
+For migration from the uncertainty API, remove `e` access and the third
+constructor argument. Patterns and serialized results contain only `x` and `y`.
diff --git a/docs/assets/samples/profile.xy b/docs/assets/samples/profile.xy
new file mode 100644
index 0000000..376adc5
--- /dev/null
+++ b/docs/assets/samples/profile.xy
@@ -0,0 +1,3 @@
+10 4
+11 9
+12 16
diff --git a/docs/formats.md b/docs/formats.md
new file mode 100644
index 0000000..8a9a47e
--- /dev/null
+++ b/docs/formats.md
@@ -0,0 +1,39 @@
+# Supported formats
+
+Geddes loads one profile at a time. Use `index` for a scan, range, or bank's
+zero-based position and `block` for powder CIF selection; the default is the
+first pattern. See [usage](reading-patterns.md#pattern-selection) for examples.
+
+| Format | Common extensions | Selection | Supported variants |
+|---|---|---|---|
+| Text | `.xy`, `.xye`, `.csv`, `.dat`, `.prn`, `.txt` | Single pattern | Whitespace or comma-separated x/y; extra columns ignored |
+| GSAS | `.gsas`, `.gsa`, `.fxye`, `.gda`, `.xra`, `.raw` | Bank (`index`) | `CONS`/`CONST` with STD, ESD, or FXYE records; centidegrees converted to degrees |
+| Bruker RAW | `.raw` | Scan (`index`) | Binary 2theta scans |
+| RAS | `.ras` | Scan (`index`) | Text diffraction profiles |
+| RASX | `.rasx` | Scan (`index`) | Diffraction profiles, selected in the file's scan order |
+| UXD | `.uxd` | Scan (`index`) | `_COUNTS`, `_CPS`, `_2THETACOUNTS`, `_2THETACPS`; explicit positions or start/step values |
+| BRML | `.brml` | Scan (`index`) | Integrated 1D profiles; uniquely identified measured data or the sole dataset within the selected scan |
+| XRDML | `.xrdml` | Scan (`index`) | Counts or intensities with a 2theta range or position list |
+| CHI | `.chi` | Single pattern | Four-line header and x/y rows matching the declared point count |
+| Powder CIF | `.cif` | Data block (`block`) | Measured powder profiles; corrected 2theta and processed total intensity take precedence when present |
+
+Geddes checks content before using the filename as a hint, distinguishing GSAS
+text from Bruker binary files that both use `.raw`. Text inputs support UTF-8
+with or without a byte-order mark and UTF-16 with one. ASCII files can include
+common comment lines and prose headers.
+
+<a id="limits"></a>
+
+Bruker RAW support is limited to versions 3 and 4.
+
+Positions must represent 2theta in degrees. Geddes does not infer a wavelength
+or convert Q, d-spacing, or time-of-flight axes. A successful read cannot verify
+units absent from the file. Unsupported inputs include detector frames, DIF
+peak lists, structural CIFs without a profile, and non-2theta scans.
+GSAS `RALF`, `SLOG`, `TIME_MAP`, `COND`, and `CONQ` binnings, ALT/FXY records,
+and compressed STD records are unsupported.
+
+Intensities retain their stored units, including cps. Geddes multiplies XRDML
+raw counts by supplied attenuation factors; reported XRDML intensities and BRML
+values remain unchanged. See [intensity handling](reading-patterns.md#intensity-values)
+for Rigaku attenuators and other conventions.
diff --git a/docs/index.md b/docs/index.md
new file mode 100644
index 0000000..b36aa12
--- /dev/null
+++ b/docs/index.md
@@ -0,0 +1,56 @@
+# Geddes
+
+Geddes reads XRD files into `x` (2θ in degrees) and `y` (intensity).
+It is available for Python, Rust, and Node.js.
+
+## Installation and usage
+
+Save the [toy pattern](assets/samples/profile.xy) in your working directory,
+or use the path to your own file.
+
+=== "Python"
+
+    Python 3.10 or later:
+
+    ```sh
+    pip install geddes
+    ```
+
+    ```python
+    import geddes
+
+    pattern = geddes.read("profile.xy")
+    x, y = pattern.x, pattern.y
+    ```
+
+=== "Rust"
+
+    ```sh
+    cargo add geddes
+    ```
+
+    ```rust
+    fn main() -> Result<(), geddes::Error> {
+        let pattern = geddes::read("profile.xy")?;
+        println!("{:?}\n{:?}", pattern.x, pattern.y);
+        Ok(())
+    }
+    ```
+
+=== "Node.js"
+
+    Node.js 16 or later:
+
+    ```sh
+    npm install @jcwang587/geddes
+    ```
+
+    ```javascript
+    const geddes = require('@jcwang587/geddes')
+
+    const { x, y } = geddes.read('profile.xy')
+    ```
+
+The sample returns `x = [10, 11, 12]` and `y = [4, 9, 16]`.
+Each call reads one pattern. See [usage](reading-patterns.md) for pattern selection
+and [formats](formats.md) for supported files.
diff --git a/docs/reading-patterns.md b/docs/reading-patterns.md
new file mode 100644
index 0000000..2e70230
--- /dev/null
+++ b/docs/reading-patterns.md
@@ -0,0 +1,132 @@
+# Usage
+
+## Pattern selection
+
+| Option | Meaning | Default |
+|---|---|---|
+| `index` | Zero-based position of a scan, range, or GSAS bank | `0` (first pattern) |
+| `block` | Case-sensitive substring of a powder CIF block name | First block containing a profile |
+
+Select the second scan or a measured CIF block:
+
+=== "Python"
+
+    ```python
+    import geddes
+
+    pattern = geddes.read("measurement.rasx", index=1)
+    pattern = geddes.read("standard.cif", block="_meas")
+    ```
+
+=== "Rust"
+
+    ```rust
+    fn main() -> Result<(), geddes::Error> {
+        let options = geddes::ReadOptions { index: 1, block: None };
+        let pattern = geddes::read_with_options("measurement.rasx", &options)?;
+
+        let options = geddes::ReadOptions {
+            block: Some("_meas".into()), ..Default::default()
+        };
+        let pattern = geddes::read_with_options("standard.cif", &options)?;
+        Ok(())
+    }
+    ```
+
+=== "Node.js"
+
+    ```javascript
+    const geddes = require('@jcwang587/geddes')
+
+    const pattern = geddes.read('measurement.rasx', { index: 1 })
+    const measured = geddes.read('standard.cif', { block: '_meas' })
+    ```
+
+Indices follow file order. An out-of-range index or unmatched block raises an error. CIF and
+single-pattern formats require `index=0`; a CIF substring selects the first
+matching profile block.
+
+## Reading bytes
+
+Pass the file contents and a filename hint. The filename does not open a file.
+
+=== "Python"
+
+    ```python
+    import geddes
+
+    pattern = geddes.read_bytes(b"10 4\n11 9\n12 16\n", "sample.xy")
+    ```
+
+=== "Rust"
+
+    ```rust
+    fn main() -> Result<(), geddes::Error> {
+        let pattern = geddes::read_bytes(b"10 4\n11 9\n12 16\n", "sample.xy")?;
+        Ok(())
+    }
+    ```
+
+=== "Node.js"
+
+    ```javascript
+    const geddes = require('@jcwang587/geddes')
+
+    const data = Buffer.from('10 4\n11 9\n12 16\n')
+    const pattern = geddes.readBytes(data, 'sample.xy')
+    ```
+
+Byte readers accept the same selection options. Rust also supports
+`Read + Seek` streams through [`from_reader`](api.md#rust).
+
+## Intensity values
+
+Intensities retain their stored units. Counts per second are not converted to
+counts. XRDML raw `<counts>` are multiplied by supplied attenuation factors;
+processed XRDML `<intensities>` and BRML intensities are returned as stored.
+Rigaku's additional attenuator column is ignored.
+
+Geddes returns x/y only. It does not smooth, resample, subtract backgrounds,
+calculate uncertainties, or remove points with zero uncertainty or weight.
+
+## Ordering and validation
+
+Returned arrays are finite, nonempty, and equally sized. Strictly descending
+scans are reversed as paired x/y arrays. Duplicate positions and axes that
+change direction are errors. Direct `Pattern` constructors require increasing x.
+
+Geddes does not convert Q, d-spacing, or time-of-flight axes. See the
+[format limits](formats.md#limits) for inputs without a reliable axis declaration.
+
+## Using the arrays
+
+These Python examples use the [toy pattern](assets/samples/profile.xy).
+Install Matplotlib and NumPy for plotting and CSV export:
+
+```sh
+pip install matplotlib numpy
+```
+
+Plot x and y:
+
+```python
+import geddes
+import matplotlib.pyplot as plt
+
+pattern = geddes.read("profile.xy")
+plt.plot(pattern.x, pattern.y, "o-")
+plt.xlabel("2θ (degrees)")
+plt.ylabel("Intensity")
+plt.show()
+```
+
+Save a two-column CSV:
+
+```python
+import geddes
+import numpy as np
+
+pattern = geddes.read("profile.xy")
+xy = np.column_stack((pattern.x, pattern.y))
+np.savetxt("profile.csv", xy, delimiter=",", header="2theta,intensity", comments="")
+```
diff --git a/node/Cargo.lock b/node/Cargo.lock
index 8dfc4f5..e11b3d8 100644
--- a/node/Cargo.lock
+++ b/node/Cargo.lock
@@ -122,7 +122,7 @@ checksum = "e835b70203e41293343137df5c0664546da5745f82ec9b84d40be8336958447b"
 dependencies = [
  "proc-macro2",
  "quote",
- "syn",
+ "syn 2.0.117",
 ]
 
 [[package]]
@@ -156,7 +156,7 @@ dependencies = [
 
 [[package]]
 name = "geddes"
-version = "0.5.0"
+version = "1.0.0"
 dependencies = [
  "quick-xml",
  "serde",
@@ -166,7 +166,7 @@ dependencies = [
 
 [[package]]
 name = "geddes-node"
-version = "0.5.0"
+version = "1.0.0"
 dependencies = [
  "geddes",
  "napi",
@@ -254,7 +254,7 @@ dependencies = [
  "napi-derive-backend",
  "proc-macro2",
  "quote",
- "syn",
+ "syn 2.0.117",
 ]
 
 [[package]]
@@ -267,7 +267,7 @@ dependencies = [
  "proc-macro2",
  "quote",
  "semver",
- "syn",
+ "syn 2.0.117",
 ]
 
 [[package]]
@@ -357,7 +357,7 @@ checksum = "d540f220d3187173da220f885ab66608367b6574e925011a9353e4badda91d79"
 dependencies = [
  "proc-macro2",
  "quote",
- "syn",
+ "syn 2.0.117",
 ]
 
 [[package]]
@@ -383,24 +383,35 @@ dependencies = [
  "unicode-ident",
 ]
 
+[[package]]
+name = "syn"
+version = "3.0.3"
+source = "registry+https://github.com/rust-lang/crates.io-index"
+checksum = "53e9bae58849f64dfa4f5d5ae372c8341f7305f82a3868709269343628b659a3"
+dependencies = [
+ "proc-macro2",
+ "quote",
+ "unicode-ident",
+]
+
 [[package]]
 name = "thiserror"
-version = "2.0.18"
+version = "2.0.19"
 source = "registry+https://github.com/rust-lang/crates.io-index"
-checksum = "4288b5bcbc7920c07a1149a35cf9590a2aa808e0bc1eafaade0b80947865fbc4"
+checksum = "09a43598840e33d5b0331f38c5e30d13bb11c11210a4b58f0d9b18a5a5eefcd9"
 dependencies = [
  "thiserror-impl",
 ]
 
 [[package]]
 name = "thiserror-impl"
-version = "2.0.18"
+version = "2.0.19"
 source = "registry+https://github.com/rust-lang/crates.io-index"
-checksum = "ebc4ee7f67670e9b64d05fa4253e753e016c6c95ff35b89b7941d6b856dec1d5"
+checksum = "43cbfe0cf76104d42a574802844187e84a305e531ed54455f11fbde0f10541cd"
 dependencies = [
  "proc-macro2",
  "quote",
- "syn",
+ "syn 3.0.3",
 ]
 
 [[package]]
diff --git a/node/Cargo.toml b/node/Cargo.toml
index 1fb9e5e..a501915 100644
--- a/node/Cargo.toml
+++ b/node/Cargo.toml
@@ -1,6 +1,6 @@
 [package]
 name = "geddes-node"
-version = "0.5.0"
+version = "1.0.0"
 edition = "2021"
 license = "MIT"
 publish = false
diff --git a/node/index.d.ts b/node/index.d.ts
index 953e437..b7d8ec1 100644
--- a/node/index.d.ts
+++ b/node/index.d.ts
@@ -3,9 +3,13 @@
 export interface Pattern {
   x: Array<number>
   y: Array<number>
-  e?: Array<number>
 }
 
-export declare function read(path: string): Pattern
+export declare function read(path: string, options?: ReadOptions | undefined | null): Pattern
 
-export declare function readBytes(data: Buffer, filename: string): Pattern
+export declare function readBytes(data: Buffer, filename: string, options?: ReadOptions | undefined | null): Pattern
+
+export interface ReadOptions {
+  index?: number
+  block?: string
+}
diff --git a/node/index.js b/node/index.js
index 3b87ef6..38bdad6 100644
--- a/node/index.js
+++ b/node/index.js
@@ -77,8 +77,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-android-arm64')
         const bindingPackageVersion = require('@jcwang587/geddes-android-arm64/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -93,8 +93,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-android-arm-eabi')
         const bindingPackageVersion = require('@jcwang587/geddes-android-arm-eabi/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -114,8 +114,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-win32-x64-gnu')
         const bindingPackageVersion = require('@jcwang587/geddes-win32-x64-gnu/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -130,8 +130,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-win32-x64-msvc')
         const bindingPackageVersion = require('@jcwang587/geddes-win32-x64-msvc/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -147,8 +147,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-win32-ia32-msvc')
         const bindingPackageVersion = require('@jcwang587/geddes-win32-ia32-msvc/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -163,8 +163,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-win32-arm64-msvc')
         const bindingPackageVersion = require('@jcwang587/geddes-win32-arm64-msvc/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -182,8 +182,8 @@ function requireNative() {
     try {
       const binding = require('@jcwang587/geddes-darwin-universal')
       const bindingPackageVersion = require('@jcwang587/geddes-darwin-universal/package.json').version
-      if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-        throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+      if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+        throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
       }
       return binding
     } catch (e) {
@@ -198,8 +198,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-darwin-x64')
         const bindingPackageVersion = require('@jcwang587/geddes-darwin-x64/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -214,8 +214,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-darwin-arm64')
         const bindingPackageVersion = require('@jcwang587/geddes-darwin-arm64/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -234,8 +234,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-freebsd-x64')
         const bindingPackageVersion = require('@jcwang587/geddes-freebsd-x64/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -250,8 +250,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-freebsd-arm64')
         const bindingPackageVersion = require('@jcwang587/geddes-freebsd-arm64/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -271,8 +271,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-x64-musl')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-x64-musl/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -287,8 +287,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-x64-gnu')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-x64-gnu/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -305,8 +305,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-arm64-musl')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-arm64-musl/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -321,8 +321,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-arm64-gnu')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-arm64-gnu/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -339,8 +339,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-arm-musleabihf')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-arm-musleabihf/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -355,8 +355,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-arm-gnueabihf')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-arm-gnueabihf/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -373,8 +373,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-loong64-musl')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-loong64-musl/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -389,8 +389,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-loong64-gnu')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-loong64-gnu/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -407,8 +407,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-riscv64-musl')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-riscv64-musl/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -423,8 +423,8 @@ function requireNative() {
         try {
           const binding = require('@jcwang587/geddes-linux-riscv64-gnu')
           const bindingPackageVersion = require('@jcwang587/geddes-linux-riscv64-gnu/package.json').version
-          if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-            throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+          if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+            throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
           }
           return binding
         } catch (e) {
@@ -440,8 +440,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-linux-ppc64-gnu')
         const bindingPackageVersion = require('@jcwang587/geddes-linux-ppc64-gnu/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -456,8 +456,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-linux-s390x-gnu')
         const bindingPackageVersion = require('@jcwang587/geddes-linux-s390x-gnu/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -476,8 +476,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-openharmony-arm64')
         const bindingPackageVersion = require('@jcwang587/geddes-openharmony-arm64/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -492,8 +492,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-openharmony-x64')
         const bindingPackageVersion = require('@jcwang587/geddes-openharmony-x64/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
@@ -508,8 +508,8 @@ function requireNative() {
       try {
         const binding = require('@jcwang587/geddes-openharmony-arm')
         const bindingPackageVersion = require('@jcwang587/geddes-openharmony-arm/package.json').version
-        if (bindingPackageVersion !== '0.5.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
-          throw new Error(`Native binding package version mismatch, expected 0.5.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
+        if (bindingPackageVersion !== '1.0.0' && process.env.NAPI_RS_ENFORCE_VERSION_CHECK && process.env.NAPI_RS_ENFORCE_VERSION_CHECK !== '0') {
+          throw new Error(`Native binding package version mismatch, expected 1.0.0 but got ${bindingPackageVersion}. You can reinstall dependencies to fix this issue.`)
         }
         return binding
       } catch (e) {
diff --git a/node/package-lock.json b/node/package-lock.json
index 02c40b5..c334801 100644
--- a/node/package-lock.json
+++ b/node/package-lock.json
@@ -1,12 +1,12 @@
 {
   "name": "@jcwang587/geddes",
-  "version": "0.5.0",
+  "version": "1.0.0",
   "lockfileVersion": 3,
   "requires": true,
   "packages": {
     "": {
       "name": "@jcwang587/geddes",
-      "version": "0.5.0",
+      "version": "1.0.0",
       "license": "MIT",
       "devDependencies": {
         "@napi-rs/cli": "^3.5.1"
@@ -1735,10 +1735,20 @@
       }
     },
     "node_modules/js-yaml": {
-      "version": "4.1.1",
-      "resolved": "https://registry.npmjs.org/js-yaml/-/js-yaml-4.1.1.tgz",
-      "integrity": "sha512-qQKT4zQxXl8lLwBtHMWwaTcGfFOZviOJet3Oy/xmGk2gZH677CJM9EvtfdSkgWcATZhj/55JZ0rmy3myCT5lsA==",
+      "version": "4.3.2",
+      "resolved": "https://registry.npmjs.org/js-yaml/-/js-yaml-4.3.2.tgz",
+      "integrity": "sha512-SFNOvSJ+Dgf/9An904Yx+CgSlIPCkIpao4qo51lpee25TIRejdH3rhR4EZMGoNx3/TP3O+wzWuiTFl4sqbltzA==",
       "dev": true,
+      "funding": [
+        {
+          "type": "github",
+          "url": "https://github.com/sponsors/puzrin"
+        },
+        {
+          "type": "github",
+          "url": "https://github.com/sponsors/nodeca"
+        }
+      ],
       "license": "MIT",
       "dependencies": {
         "argparse": "^2.0.1"
diff --git a/node/package.json b/node/package.json
index 399ddc2..792a49b 100644
--- a/node/package.json
+++ b/node/package.json
@@ -1,9 +1,10 @@
 {
   "name": "@jcwang587/geddes",
-  "version": "0.5.0",
+  "version": "1.0.0",
   "description": "Node.js bindings for geddes (Rust XRD parser)",
   "main": "index.js",
   "types": "index.d.ts",
+  "homepage": "https://jcwang587.github.io/geddes/",
   "repository": {
     "type": "git",
     "url": "git+https://github.com/jcwang587/geddes.git"
@@ -31,6 +32,9 @@
     "access": "public"
   },
   "scripts": {
+    "pack:release": "node ./scripts/pack-release.mjs",
+    "check:package": "node ./scripts/check-package.cjs",
+    "publish:packages": "node ./scripts/publish-packages.mjs",
     "sync:version": "node ./scripts/sync-version.mjs",
     "prepare:release": "cargo check --manifest-path ../Cargo.toml && cargo check --manifest-path ./Cargo.toml && npm run sync:version",
     "artifacts": "napi create-npm-dirs && napi artifacts --output-dir .",
diff --git a/node/scripts/check-package.cjs b/node/scripts/check-package.cjs
new file mode 100644
index 0000000..86b7162
--- /dev/null
+++ b/node/scripts/check-package.cjs
@@ -0,0 +1,48 @@
+const assert = require('node:assert/strict')
+const { execFileSync } = require('node:child_process')
+const fs = require('node:fs')
+const os = require('node:os')
+const path = require('node:path')
+
+assert(process.argv[2], 'Usage: npm run check:package -- PACKAGE_DIR')
+assert(process.env.npm_execpath, 'Run this script through npm run check:package')
+const packageDir = path.resolve(process.argv[2])
+const packages = JSON.parse(fs.readFileSync(path.join(packageDir, 'packages.json'), 'utf8'))
+const abi = `${process.platform}-${process.arch}${process.platform === 'win32' ? '-msvc' : process.platform === 'linux' ? '-gnu' : ''}`
+const main = packages.find(pkg => pkg.target === null)
+const native = packages.find(pkg => main && pkg.name === `${main.name}-${abi}`)
+assert(main && native, `Missing release package for ${abi}`)
+assert.equal(native.version, main.version)
+const consumer = fs.mkdtempSync(path.join(os.tmpdir(), 'geddes-consumer-'))
+
+try {
+  fs.writeFileSync(path.join(consumer, 'package.json'), JSON.stringify({ private: true }))
+  const env = { ...process.env, npm_config_cache: path.join(consumer, 'cache') }
+  delete env.NODE_PATH
+  delete env.NAPI_RS_NATIVE_LIBRARY_PATH
+  delete env.GEDDES_BINDING
+  execFileSync(process.execPath, [process.env.npm_execpath, 'install',
+    '--offline', '--ignore-scripts', '--no-audit', '--no-fund', '--package-lock=false',
+    path.join(packageDir, main.filename), path.join(packageDir, native.filename),
+  ], { cwd: consumer, env, stdio: 'inherit' })
+
+  const installed = path.join(consumer, 'node_modules', ...main.name.split('/'))
+  const installedNative = path.join(consumer, 'node_modules', ...native.name.split('/'))
+  const installedManifest = JSON.parse(fs.readFileSync(path.join(installed, 'package.json'), 'utf8'))
+  assert.equal(installedManifest.version, main.version)
+  assert.equal(installedManifest.optionalDependencies[native.name], native.version)
+  assert(fs.existsSync(path.join(installed, installedManifest.types)), 'Missing TypeScript declarations')
+  assert(fs.existsSync(path.join(installed, 'LICENSE')), 'Missing main package license')
+  assert(fs.existsSync(path.join(installedNative, 'LICENSE')), 'Missing native package license')
+  assert(!fs.readdirSync(installed).some(file => file.endsWith('.node')),
+    'Test must load the installed platform package through the JS loader')
+
+  execFileSync(process.execPath, [path.resolve(__dirname, '..', 'test.cjs')], {
+    cwd: consumer,
+    env: { ...env, GEDDES_BINDING: installed, NAPI_RS_ENFORCE_VERSION_CHECK: '1' },
+    stdio: 'inherit',
+  })
+  console.log(`Installed package passed on ${abi}, Node ${process.version}`)
+} finally {
+  fs.rmSync(consumer, { recursive: true, force: true })
+}
diff --git a/node/scripts/pack-release.mjs b/node/scripts/pack-release.mjs
new file mode 100644
index 0000000..aa9cd93
--- /dev/null
+++ b/node/scripts/pack-release.mjs
@@ -0,0 +1,66 @@
+import assert from 'node:assert/strict'
+import { execFileSync } from 'node:child_process'
+import { copyFileSync, mkdtempSync, mkdirSync, readFileSync, rmSync, writeFileSync } from 'node:fs'
+import { tmpdir } from 'node:os'
+import { dirname, join, resolve } from 'node:path'
+import { fileURLToPath } from 'node:url'
+import { NapiCli, parseTriple } from '@napi-rs/cli'
+
+const nodeDir = resolve(dirname(fileURLToPath(import.meta.url)), '..')
+const [artifactArg, outputArg, localTarget] = process.argv.slice(2)
+assert(artifactArg && outputArg, 'Usage: npm run pack:release -- ARTIFACT_DIR OUTPUT_DIR [LOCAL_TARGET]')
+assert(process.env.npm_execpath, 'Run this script through npm run pack:release')
+const artifactDir = resolve(artifactArg)
+const outputDir = resolve(outputArg)
+const pkg = JSON.parse(readFileSync(join(nodeDir, 'package.json'), 'utf8'))
+const targets = localTarget ? [localTarget] : pkg.napi.targets
+assert(targets.every(target => pkg.napi.targets.includes(target)), 'Unknown native target')
+const staging = mkdtempSync(join(tmpdir(), 'geddes-pack-'))
+mkdirSync(outputDir, { recursive: true })
+
+try {
+  pkg.optionalDependencies = Object.fromEntries(pkg.napi.targets.map(target => [
+    `${pkg.name}-${parseTriple(target).platformArchABI}`, pkg.version,
+  ]))
+  writeFileSync(join(staging, 'package.json'), JSON.stringify(pkg, null, 2) + '\n')
+  copyFileSync(join(nodeDir, '..', 'README.md'), join(staging, 'README.md'))
+  copyFileSync(join(nodeDir, '..', 'LICENSE'), join(staging, 'LICENSE'))
+  await new NapiCli().createNpmDirs({ cwd: staging })
+
+  const packages = []
+  let wrapper
+  let types
+  function pack(directory, target) {
+    const result = JSON.parse(execFileSync(process.execPath, [process.env.npm_execpath,
+      'pack', '--json', '--ignore-scripts', '--pack-destination', outputDir,
+    ], { cwd: directory, encoding: 'utf8' }))[0]
+    assert(result.files.some(file => file.path === 'LICENSE'), 'Package is missing LICENSE')
+    packages.push({ target, name: result.name, version: result.version, filename: result.filename })
+  }
+
+  for (const target of targets) {
+    const abi = parseTriple(target).platformArchABI
+    const built = join(artifactDir, `bindings-${target}`)
+    const generatedWrapper = readFileSync(join(built, 'index.js'), 'utf8')
+    const generatedTypes = readFileSync(join(built, 'index.d.ts'), 'utf8')
+    if (wrapper !== undefined) {
+      assert.equal(generatedWrapper, wrapper, `Generated loader differs for ${target}`)
+      assert.equal(generatedTypes, types, `Generated types differ for ${target}`)
+    }
+    wrapper = generatedWrapper
+    types = generatedTypes
+    const nativeDir = join(staging, 'npm', abi)
+    const binary = `${pkg.napi.binaryName}.${abi}.node`
+    copyFileSync(join(built, binary), join(nativeDir, binary))
+    copyFileSync(join(staging, 'LICENSE'), join(nativeDir, 'LICENSE'))
+    pack(nativeDir, target)
+  }
+
+  writeFileSync(join(staging, 'index.js'), wrapper)
+  writeFileSync(join(staging, 'index.d.ts'), types)
+  pack(staging, null)
+  writeFileSync(join(outputDir, 'packages.json'), JSON.stringify(packages, null, 2) + '\n')
+  console.log(`Packed ${packages.length} release packages in ${outputDir}`)
+} finally {
+  rmSync(staging, { recursive: true, force: true })
+}
diff --git a/node/scripts/publish-packages.mjs b/node/scripts/publish-packages.mjs
new file mode 100644
index 0000000..64bebf5
--- /dev/null
+++ b/node/scripts/publish-packages.mjs
@@ -0,0 +1,17 @@
+import assert from 'node:assert/strict'
+import { execFileSync } from 'node:child_process'
+import { readFileSync } from 'node:fs'
+import { join, resolve } from 'node:path'
+
+assert(process.argv[2], 'Usage: npm run publish:packages -- PACKAGE_DIR')
+assert(process.env.npm_execpath, 'Run this script through npm run publish:packages')
+const directory = resolve(process.argv[2])
+const packages = JSON.parse(readFileSync(join(directory, 'packages.json'), 'utf8'))
+assert(packages.length === 7 && packages.at(-1).target === null,
+  'Expected six native packages followed by the JS package')
+for (const pkg of packages) {
+  execFileSync(process.execPath, [process.env.npm_execpath, 'publish', join(directory, pkg.filename),
+    '--ignore-scripts', '--provenance', '--access', 'public',
+    '--tag', pkg.version.includes('-') ? 'next' : 'latest',
+  ], { stdio: 'inherit' })
+}
diff --git a/node/scripts/sync-version.mjs b/node/scripts/sync-version.mjs
index 96774d3..aa16d4e 100644
--- a/node/scripts/sync-version.mjs
+++ b/node/scripts/sync-version.mjs
@@ -60,7 +60,7 @@ function updatePackageVersionInCargoToml(content, nextVersion) {
     throw new Error("Could not update [package].version in node/Cargo.toml");
   }
 
-  return `${lines.join("\n")}\n`;
+  return `${lines.join("\n").trimEnd()}\n`;
 }
 
 const rootCargoToml = readFileSync(rootCargoTomlPath, "utf8");
diff --git a/node/src/lib.rs b/node/src/lib.rs
index 5fe660e..a61fa60 100644
--- a/node/src/lib.rs
+++ b/node/src/lib.rs
@@ -1,5 +1,4 @@
 #![deny(clippy::all)]
-
 use napi::bindgen_prelude::Buffer;
 use napi_derive::napi;
 
@@ -7,13 +6,30 @@ use napi_derive::napi;
 pub struct Pattern {
     pub x: Vec<f64>,
     pub y: Vec<f64>,
-    pub e: Option<Vec<f64>>,
+}
+
+#[napi(object)]
+#[derive(Default)]
+pub struct ReadOptions {
+    pub index: Option<u32>,
+    pub block: Option<String>,
 }
 
 impl From<geddes::Pattern> for Pattern {
     fn from(value: geddes::Pattern) -> Self {
-        let geddes::Pattern { x, y, e } = value;
-        Self { x, y, e }
+        Self {
+            x: value.x,
+            y: value.y,
+        }
+    }
+}
+
+impl From<ReadOptions> for geddes::ReadOptions {
+    fn from(value: ReadOptions) -> Self {
+        Self {
+            index: value.index.unwrap_or(0) as usize,
+            block: value.block,
+        }
     }
 }
 
@@ -22,13 +38,23 @@ fn to_napi_error(err: geddes::Error) -> napi::Error {
 }
 
 #[napi]
-pub fn read(path: String) -> napi::Result<Pattern> {
-    geddes::read(path).map(Into::into).map_err(to_napi_error)
+pub fn read(path: String, options: Option<ReadOptions>) -> napi::Result<Pattern> {
+    geddes::read_with_options(path, &options.unwrap_or_default().into())
+        .map(Into::into)
+        .map_err(to_napi_error)
 }
 
 #[napi]
-pub fn read_bytes(data: Buffer, filename: String) -> napi::Result<Pattern> {
-    geddes::read_bytes(data.as_ref(), &filename)
-        .map(Into::into)
-        .map_err(to_napi_error)
+pub fn read_bytes(
+    data: Buffer,
+    filename: String,
+    options: Option<ReadOptions>,
+) -> napi::Result<Pattern> {
+    geddes::read_bytes_with_options(
+        data.as_ref(),
+        &filename,
+        &options.unwrap_or_default().into(),
+    )
+    .map(Into::into)
+    .map_err(to_napi_error)
 }
diff --git a/node/test.cjs b/node/test.cjs
new file mode 100644
index 0000000..884fd32
--- /dev/null
+++ b/node/test.cjs
@@ -0,0 +1,95 @@
+// GEDDES_BINDING can point to an installed package entry point or a compiled .node file.
+const assert = require('node:assert/strict')
+const fs = require('node:fs')
+const os = require('node:os')
+const path = require('node:path')
+const geddes = require(process.env.GEDDES_BINDING || './index.js')
+const corpus = path.resolve(__dirname, '../tests/data/formats')
+const manifest = JSON.parse(fs.readFileSync(path.join(corpus, 'manifest.json'), 'utf8'))
+
+for (const fixture of manifest.fixtures) {
+  const source = path.resolve(corpus, fixture.path)
+  const rows = fs.readFileSync(path.resolve(corpus, fixture.reference), 'utf8')
+    .trim().split('\n').slice(1).map(line => line.split(',').map(Number))
+  const options = { index: fixture.scan, block: fixture.block || undefined }
+  for (const pattern of [geddes.read(source, options), geddes.readBytes(fs.readFileSync(source), source, options)]) {
+    assert.deepEqual(Object.keys(pattern).sort(), ['x', 'y'])
+    assert.equal(pattern.x.length, rows.length, fixture.id)
+    assert.equal(pattern.y.length, rows.length, fixture.id)
+    for (let i = 0; i < rows.length; i++) {
+      for (const [column, expected] of [['x', rows[i][0]], ['y', rows[i][1]]]) {
+        assert.ok(Math.abs(pattern[column][i] - expected) <= fixture.atol + fixture.rtol * Math.abs(expected),
+          `${fixture.id}: ${column}[${i}]`)
+      }
+    }
+  }
+}
+
+// Defaults and normalization must work through the installed package's exports.
+assert.equal(typeof geddes.read, 'function')
+assert.equal(typeof geddes.readBytes, 'function')
+const xy = Buffer.from('10 4\n10.5 81\n')
+const expected = { x: [10, 10.5], y: [4, 81] }
+assert.deepEqual(geddes.readBytes(xy, 'example.xy'), expected)
+assert.deepEqual(geddes.readBytes(xy, 'example.xy', {}), expected)
+assert.deepEqual(geddes.readBytes(xy, 'example.xy', { index: 0 }), expected)
+assert.deepEqual(geddes.readBytes(Buffer.from('10.5 81\n10 4\n'), 'descending.xy'), expected)
+const firstSource = path.resolve(corpus, manifest.fixtures[0].path)
+assert.deepEqual(geddes.read(firstSource), geddes.read(firstSource, {}))
+assert.deepEqual(geddes.read(firstSource), geddes.read(firstSource, { index: 0 }))
+
+// Distinct ranges detect lost or ignored selection arguments.
+const ranges = Buffer.from([
+  '_FILEVERSION=3', "_DRIVE='COUPLED'", '_START=10', '_STEPSIZE=0.5',
+  '_COUNTS', '4 81', '_START=20', '_COUNTS', '144 9 1', ''
+].join('\n'))
+assert.deepEqual(geddes.readBytes(ranges, 'ranges.uxd'), expected)
+const secondRange = {
+  x: [20, 20.5, 21], y: [144, 9, 1]
+}
+assert.deepEqual(geddes.readBytes(ranges, 'ranges.uxd', { index: 1 }), secondRange)
+assert.throws(() => geddes.readBytes(ranges, 'ranges.uxd', { index: 2 }), /out of range/)
+assert.throws(() => geddes.readBytes(xy, 'example.xy', { index: 1 }), /index must be 0/)
+const selectionDir = fs.mkdtempSync(path.join(os.tmpdir(), 'geddes-node-selection-'))
+try {
+  const rangesPath = path.join(selectionDir, 'ranges.uxd')
+  fs.writeFileSync(rangesPath, ranges)
+  assert.deepEqual(geddes.read(rangesPath), expected)
+  assert.deepEqual(geddes.read(rangesPath, { index: 0 }), expected)
+  assert.deepEqual(geddes.read(rangesPath, { index: 1 }), secondRange)
+  assert.throws(() => geddes.read(rangesPath, { index: 2 }), /out of range/)
+  assert.throws(() => geddes.read(rangesPath, { index: 'one' }), Error)
+} finally {
+  fs.rmSync(selectionDir, { recursive: true, force: true })
+}
+
+const blocks = Buffer.from([
+  'data_sample_A', 'loop_', '_pd_meas_2theta_scan', '_pd_meas_intensity_total',
+  '10 4', '10.5 81', 'data_sample_B', 'loop_',
+  '_pd_meas_2theta_scan', '_pd_meas_intensity_total', '20 144', '20.5 9', ''
+].join('\n'))
+assert.deepEqual(geddes.readBytes(blocks, 'blocks.cif'), expected)
+assert.deepEqual(geddes.readBytes(blocks, 'blocks.cif', { block: '_B' }), {
+  x: [20, 20.5], y: [144, 9]
+})
+assert.throws(() => geddes.readBytes(blocks, 'blocks.cif', { block: '_b' }), /no matching block/)
+
+// Reader failures must reach JavaScript as exceptions, not empty patterns.
+for (const [data, filename, message] of [
+  [Buffer.alloc(0), 'empty.xy', /Parse error:/],
+  [Buffer.from('10 1\n10 2\n'), 'duplicate.xy', /strictly increasing/],
+  [Buffer.from('10 NaN\n11 2\n'), 'nonfinite.xy', /finite/],
+  [Buffer.from([0, 255, 0]), 'unknown.bin', /Unknown format/],
+  [Buffer.from('PK\x03\x04'), 'truncated.rasx', /Zip error:/],
+  [Buffer.from('RAW2\0\0\0\0'), 'old.raw', /unsupported/]
+]) {
+  assert.throws(() => geddes.readBytes(data, filename), message, filename)
+}
+const missing = path.join(corpus, 'missing-node-api-file.xy')
+assert.equal(fs.existsSync(missing), false, 'missing-file test requires an absent path')
+assert.throws(() => geddes.read(missing), /IO error:/)
+assert.throws(() => geddes.read(123), Error)
+assert.throws(() => geddes.readBytes('10 1\n11 2\n', 'wrong-type.xy'), Error)
+assert.throws(() => geddes.readBytes(xy, 'wrong-option.xy', { index: 'one' }), Error)
+
+console.log(`Node: ${manifest.fixtures.length} fixtures match every x/y value from paths and bytes; API selection and error checks passed`)
diff --git a/overrides/404.html b/overrides/404.html
new file mode 100644
index 0000000..b2ce529
--- /dev/null
+++ b/overrides/404.html
@@ -0,0 +1,6 @@
+{% extends "main.html" %}
+{% block content %}
+  <h1 id="__skip">Page not found</h1>
+  <p>Use the navigation or search to find the guide you need.</p>
+  <p><a href="{{ nav.homepage.url | url }}">Return to the Geddes overview</a></p>
+{% endblock %}
diff --git a/pyproject.toml b/pyproject.toml
index f88c034..f3f7473 100644
--- a/pyproject.toml
+++ b/pyproject.toml
@@ -17,6 +17,10 @@ classifiers = [
 ]
 dynamic = ["version"]
 
+[project.urls]
+Documentation = "https://jcwang587.github.io/geddes/"
+Repository = "https://github.com/jcwang587/geddes"
+
 [project.optional-dependencies]
 test = ["pytest>=7"]
 
diff --git a/requirements-docs.txt b/requirements-docs.txt
new file mode 100644
index 0000000..eb1a1c0
--- /dev/null
+++ b/requirements-docs.txt
@@ -0,0 +1 @@
+zensical==0.0.61
diff --git a/src/bruker.rs b/src/bruker.rs
new file mode 100644
index 0000000..7a5bfcd
--- /dev/null
+++ b/src/bruker.rs
@@ -0,0 +1,297 @@
+//! Bruker RAW3 and RAW4: decode the declared range headers and data strides.
+//!
+//! Field offsets are format facts cross-checked against the Rietx format notes
+//! and its independently packed examples. In both versions the first float32
+//! of a data record is intensity; RAW3 can additionally record measured 2θ.
+
+use crate::parser::ParsedPattern;
+use crate::Error;
+
+const MAX_RANGES: usize = 4096;
+const MAX_HEADER: usize = 1 << 20;
+
+struct Range {
+    start: f64,
+    step: f64,
+    points: usize,
+    stride: usize,
+    data: usize,
+    end: usize,
+    measured_two_theta: bool,
+    axis: Result<(), String>,
+}
+
+fn fail(message: impl Into<String>) -> Error {
+    Error::Parse(format!("Bruker RAW: {}", message.into()))
+}
+
+fn bytes(buf: &[u8], at: usize, length: usize) -> Result<&[u8], Error> {
+    let end = at
+        .checked_add(length)
+        .ok_or_else(|| fail("offset overflow"))?;
+    buf.get(at..end).ok_or_else(|| {
+        fail(format!(
+            "truncated record at offset {at}: needs {length} bytes, file has {}",
+            buf.len()
+        ))
+    })
+}
+
+fn u32_at(buf: &[u8], at: usize) -> Result<u32, Error> {
+    Ok(u32::from_le_bytes(bytes(buf, at, 4)?.try_into().unwrap()))
+}
+
+fn f64_at(buf: &[u8], at: usize) -> Result<f64, Error> {
+    Ok(f64::from_le_bytes(bytes(buf, at, 8)?.try_into().unwrap()))
+}
+
+fn text_at(buf: &[u8], at: usize, length: usize) -> Result<String, Error> {
+    Ok(bytes(buf, at, length)?
+        .iter()
+        .take_while(|&&b| b != 0)
+        .map(|&b| char::from(b))
+        .collect::<String>()
+        .trim()
+        .to_owned())
+}
+
+fn normalized(name: &str) -> String {
+    name.chars()
+        .filter(|c| !c.is_whitespace() && *c != '-' && *c != '_')
+        .flat_map(char::to_lowercase)
+        .collect()
+}
+
+fn scan_type_axis(name: &str) -> Result<(), String> {
+    match normalized(name).as_str() {
+        "lockedcoupled" | "unlockedcoupled" | "unlockedcoupledhrxrd" | "detectorscan" => Ok(()),
+        _ => Err(format!(
+            "scan type {name:?} does not establish a 2theta axis; export a coupled 2theta scan"
+        )),
+    }
+}
+
+fn segment(buf: &[u8], at: usize, end: usize) -> Result<(u32, usize), Error> {
+    if end.saturating_sub(at) < 8 {
+        return Err(fail("truncated segment header"));
+    }
+    let kind = u32_at(buf, at)?;
+    let length = u32_at(buf, at + 4)? as usize;
+    if length < 8 || length > end - at {
+        return Err(fail(format!(
+            "segment type {kind} at offset {at} declares invalid length {length}"
+        )));
+    }
+    Ok((kind, length))
+}
+
+fn range_end(buf: &[u8], data: usize, points: usize, stride: usize) -> Result<usize, Error> {
+    if points == 0 {
+        return Err(fail("range has no points"));
+    }
+    let size = points
+        .checked_mul(stride)
+        .ok_or_else(|| fail("data size overflow"))?;
+    bytes(buf, data, size)?;
+    Ok(data + size)
+}
+
+fn check_axis_numbers(start: f64, step: f64) -> Result<(), Error> {
+    if !start.is_finite() || !step.is_finite() || step == 0.0 {
+        return Err(fail("range start and nonzero step must be finite"));
+    }
+    Ok(())
+}
+
+fn range_v4(buf: &[u8], marker: usize) -> Result<Range, Error> {
+    bytes(buf, marker, 160)?;
+    let scan_type = text_at(buf, marker + 32, 24)?;
+    let start = f64_at(buf, marker + 72)?;
+    let step = f64_at(buf, marker + 80)?;
+    check_axis_numbers(start, step)?;
+    let points = u32_at(buf, marker + 88)? as usize;
+    let stride = u32_at(buf, marker + 136)? as usize;
+    let header_size = u32_at(buf, marker + 140)? as usize;
+    if stride < 4 || !stride.is_multiple_of(4) {
+        return Err(fail(format!("invalid RAW4 data-record size {stride}")));
+    }
+    if header_size > MAX_HEADER {
+        return Err(fail("RAW4 drive header exceeds 1 MiB"));
+    }
+    let header = marker + 160;
+    bytes(buf, header, header_size)?;
+    let data = header + header_size;
+    let end = range_end(buf, data, points, stride)?;
+
+    // Two independent header statements identify a scanned drive: its flag
+    // must be set and its position must agree with the range start.
+    let mut cursor = header;
+    let mut candidates = Vec::new();
+    while cursor < data {
+        let (kind, length) = segment(buf, cursor, data)?;
+        if kind == 50 {
+            if length < 64 {
+                return Err(fail("RAW4 drive record is shorter than 64 bytes"));
+            }
+            let flag = u32_at(buf, cursor + 8)?;
+            let position = f64_at(buf, cursor + 56)?;
+            if flag != 0 && (position - start).abs() <= 1e-6 + 1e-5 * start.abs() {
+                candidates.push(text_at(buf, cursor + 12, 24)?);
+            }
+        }
+        cursor += length;
+    }
+    let axis = if candidates.len() == 1 {
+        let name = &candidates[0];
+        match normalized(name).as_str() {
+            "2theta" | "twotheta" => Ok(()),
+            _ => Err(format!(
+                "scanned drive {name:?} is not a recognized 2theta axis"
+            )),
+        }
+    } else {
+        scan_type_axis(&scan_type)
+    };
+
+    Ok(Range {
+        start,
+        step,
+        points,
+        stride,
+        data,
+        end,
+        measured_two_theta: false,
+        axis,
+    })
+}
+
+fn ranges_v4(buf: &[u8]) -> Result<Vec<Range>, Error> {
+    bytes(buf, 0, 61)?;
+    let mut cursor = 61;
+    let mut ranges = Vec::new();
+    while cursor < buf.len() {
+        let kind = u32_at(buf, cursor)?;
+        if kind == 0 || kind == 160 {
+            if ranges.len() >= MAX_RANGES {
+                return Err(fail("too many RAW4 ranges"));
+            }
+            let found = range_v4(buf, cursor)?;
+            cursor = found.end;
+            ranges.push(found);
+        } else {
+            let (_, length) = segment(buf, cursor, buf.len())?;
+            cursor += length;
+        }
+    }
+    if ranges.is_empty() {
+        return Err(fail("RAW4 file has no measurement ranges"));
+    }
+    Ok(ranges)
+}
+
+fn ranges_v3(buf: &[u8]) -> Result<Vec<Range>, Error> {
+    bytes(buf, 0, 712)?;
+    let count = u32_at(buf, 12)? as usize;
+    if !(1..=MAX_RANGES).contains(&count) {
+        return Err(fail(format!("invalid RAW3 range count {count}")));
+    }
+    let mut cursor = 712;
+    let mut ranges = Vec::with_capacity(count);
+    for _ in 0..count {
+        let header_size = u32_at(buf, cursor)? as usize;
+        if !(260..=MAX_HEADER).contains(&header_size) {
+            return Err(fail(format!(
+                "invalid RAW3 range-header size {header_size}"
+            )));
+        }
+        bytes(buf, cursor, header_size)?;
+        let points = u32_at(buf, cursor + 4)? as usize;
+        let start = f64_at(buf, cursor + 16)?;
+        let step = f64_at(buf, cursor + 176)?;
+        check_axis_numbers(start, step)?;
+        let scan_type = u32_at(buf, cursor + 196)?;
+        let varying = u32_at(buf, cursor + 248)?;
+        let stride = u32_at(buf, cursor + 252)? as usize;
+        let extra = u32_at(buf, cursor + 256)? as usize;
+        let expected_stride = 4 + 8 * varying.count_ones() as usize;
+        if varying > i32::MAX as u32 || stride != expected_stride {
+            return Err(fail(format!(
+                "RAW3 data-record size {stride} disagrees with varying-parameter bits {varying:#x} (expected {expected_stride})"
+            )));
+        }
+        if extra > MAX_HEADER {
+            return Err(fail("invalid RAW3 extra-record length"));
+        }
+        let data = (cursor + header_size)
+            .checked_add(extra)
+            .ok_or_else(|| fail("RAW3 data offset overflow"))?;
+        let end = range_end(buf, data, points, stride)?;
+        let axis = match scan_type {
+            0 | 1 | 2 | 20 => Ok(()),
+            _ => Err(format!(
+                "RAW3 scan type {scan_type} does not establish a 2theta axis"
+            )),
+        };
+        ranges.push(Range {
+            start,
+            step,
+            points,
+            stride,
+            data,
+            end,
+            measured_two_theta: varying & 1 != 0,
+            axis,
+        });
+        cursor = end;
+    }
+    // Real RAW3 series can end with zero-filled alignment padding. Nonzero
+    // bytes after the declared ranges indicate a wrong layout or truncation.
+    if buf[cursor..].iter().any(|&b| b != 0) {
+        return Err(fail(
+            "unaccounted nonzero bytes after the declared RAW3 ranges",
+        ));
+    }
+    Ok(ranges)
+}
+
+pub(crate) fn parse_bruker_raw(buf: &[u8], scan: usize) -> Result<ParsedPattern, Error> {
+    let ranges = if buf.starts_with(b"RAW1.01") {
+        ranges_v3(buf)?
+    } else if buf.starts_with(b"RAW4.00") {
+        ranges_v4(buf)?
+    } else if buf.starts_with(b"RAW2") || buf.starts_with(b"RAW ") {
+        return Err(fail(
+            "versions 1 and 2 are unsupported; export RAW3, RAW4, UXD, or XY",
+        ));
+    } else {
+        return Err(fail("unrecognized binary signature"));
+    };
+    let found = ranges.get(scan).ok_or_else(|| {
+        fail(format!(
+            "scan {scan} is out of range; file has {} scans",
+            ranges.len()
+        ))
+    })?;
+    if let Err(message) = &found.axis {
+        return Err(fail(message.clone()));
+    }
+    let mut x = Vec::with_capacity(found.points);
+    let mut y = Vec::with_capacity(found.points);
+    for (i, record) in buf[found.data..found.end]
+        .chunks_exact(found.stride)
+        .enumerate()
+    {
+        let intensity = f32::from_le_bytes(record[..4].try_into().unwrap()) as f64;
+        let angle = if found.measured_two_theta {
+            f64::from_le_bytes(record[4..12].try_into().unwrap())
+        } else {
+            found.start + found.step * i as f64
+        };
+        if !intensity.is_finite() || !angle.is_finite() {
+            return Err(fail(format!("nonfinite angle or intensity in point {i}")));
+        }
+        x.push(angle);
+        y.push(intensity);
+    }
+    Ok(ParsedPattern { x, y })
+}
diff --git a/src/lib.rs b/src/lib.rs
index 2f4ac36..65a155d 100644
--- a/src/lib.rs
+++ b/src/lib.rs
@@ -1,170 +1,118 @@
-//! # Geddes
+//! Load XRD patterns as two arrays: 2θ in degrees (`x`) and intensity (`y`).
 //!
-//! `geddes` is a library for loading and parsing various diffraction pattern file formats.
-//! It supports common formats like `.raw`, `.rasx`, `.xrdml`, `.xy` / `.xye`, and `.csv`.
+//! Supports ASCII columns, GSAS, Rigaku RAS/RASX, Bruker RAW/UXD/BRML,
+//! PANalytical XRDML, FIT2D CHI and powder CIF. No refinement or metadata API.
 
+mod bruker;
 mod error;
 mod parser;
-
 #[cfg(feature = "python")]
 mod python;
+mod text;
+mod xml;
 
 pub use error::Error;
-use parser::{
-    parse_bruker_raw, parse_csv, parse_gsas_raw, parse_rasx, parse_xrdml, parse_xy, ParsedPattern,
-};
 #[cfg(feature = "python")]
 use pyo3::prelude::*;
 use serde::{Deserialize, Serialize};
-use std::fs::File;
-use std::io::{Cursor, Read, Seek, SeekFrom};
+use std::io::{Read, Seek};
 use std::path::Path;
 
-/// Represents a diffraction pattern with position, intensity, and optional error.
+/// One diffraction pattern. Extra file columns are deliberately not returned.
 #[cfg_attr(feature = "python", pyclass(get_all, skip_from_py_object))]
 #[derive(Serialize, Deserialize, Debug, Clone)]
 pub struct Pattern {
-    /// The x-axis values (e.g., 2-theta or Q).
+    /// Diffraction angle 2θ, in degrees, strictly increasing.
     pub x: Vec<f64>,
-    /// The y-axis values (intensity).
+    /// Intensity in the file's units (counts or counts per second).
     pub y: Vec<f64>,
-    /// The uncertainty/error values, if available.
-    #[serde(skip_serializing_if = "Option::is_none")]
-    pub e: Option<Vec<f64>>,
 }
 
 impl Pattern {
-    /// Creates a new diffraction pattern, returning an error if lengths are inconsistent
-    /// or the x-axis is not strictly increasing.
-    pub fn new(x: Vec<f64>, y: Vec<f64>, e: Option<Vec<f64>>) -> Result<Self, Error> {
-        Self::validate(&x, &y, e.as_deref())?;
-        Ok(Pattern { x, y, e })
-    }
-
-    fn from_parsed(data: ParsedPattern) -> Result<Self, Error> {
-        Self::new(data.x, data.y, data.e)
-    }
-
-    fn validate(x: &[f64], y: &[f64], e: Option<&[f64]>) -> Result<(), Error> {
+    /// Construct a nonempty pattern with equal array lengths, finite values,
+    /// and strictly increasing x. Returns a parse error if validation fails.
+    pub fn new(x: Vec<f64>, y: Vec<f64>) -> Result<Self, Error> {
         if x.len() != y.len() {
+            return Err(Error::Parse("x and y must have the same length".into()));
+        }
+        if x.is_empty() {
+            return Err(Error::Parse("pattern contains no points".into()));
+        }
+        if x.iter().any(|v| !v.is_finite()) || x.windows(2).any(|w| w[0] >= w[1]) {
             return Err(Error::Parse(
-                "x and y must have the same length".into(),
+                "x values must be finite and strictly increasing".into(),
             ));
         }
-        if let Some(e_vec) = e {
-            if e_vec.len() != x.len() {
-                return Err(Error::Parse(
-                    "e must have the same length as x and y".into(),
-                ));
-            }
+        if y.iter().any(|v| !v.is_finite()) {
+            return Err(Error::Parse("y values must be finite".into()));
         }
+        Ok(Self { x, y })
+    }
 
-        // Single pass: rejects NaN (via `!(prev < v)`, since any comparison
-        // with NaN is false) and non-strictly-increasing values together.
-        let mut iter = x.iter().copied();
-        if let Some(mut prev) = iter.next() {
-            if prev.is_nan() {
-                return Err(Error::Parse(
-                    "x values must be strictly increasing".into(),
-                ));
-            }
-            for v in iter {
-                if !(prev < v) {
-                    return Err(Error::Parse(
-                        "x values must be strictly increasing".into(),
-                    ));
-                }
-                prev = v;
-            }
+    fn from_parsed(mut data: parser::ParsedPattern) -> Result<Self, Error> {
+        if data.x.len() > 1 && data.x.windows(2).all(|w| w[0] > w[1]) {
+            data.x.reverse();
+            data.y.reverse();
         }
-
-        Ok(())
+        Self::new(data.x, data.y)
     }
 }
 
-/// Load a pattern from a file path.
-///
-/// Format is determined automatically by the file extension.
-///
-/// # Examples
-///
+/// Choose one pattern without adding metadata to the returned arrays.
+#[derive(Debug, Clone, Default)]
+pub struct ReadOptions {
+    /// Zero-based pattern position (scan, range, or GSAS bank). Defaults to 0.
+    pub index: usize,
+    /// Case-sensitive substring of a powder CIF data block name.
+    /// Selects the first matching profile; no filter by default.
+    pub block: Option<String>,
+}
+
+/// Load the first pattern in a file, detecting its content before its suffix.
 /// ```no_run
-/// use geddes::read;
-///
-/// let pattern = read("tests/data/xy/sample.xy").expect("Failed to load file");
-/// println!("Loaded {} points", pattern.x.len());
+/// let pattern = geddes::read("sample.xrdml")?;
+/// println!("{} points", pattern.x.len());
+/// # Ok::<(), geddes::Error>(())
 /// ```
 pub fn read<P: AsRef<Path>>(path: P) -> Result<Pattern, Error> {
+    read_with_options(path, &ReadOptions::default())
+}
+
+/// Load one selected pattern from a file.
+pub fn read_with_options<P: AsRef<Path>>(path: P, options: &ReadOptions) -> Result<Pattern, Error> {
     let path = path.as_ref();
-    let file = File::open(path)?;
-    let filename = path.file_name().and_then(|s| s.to_str()).unwrap_or("");
-    from_reader(file, filename)
+    let bytes = std::fs::read(path)?;
+    read_bytes_with_options(&bytes, path.to_str().unwrap_or(""), options)
 }
 
-/// Load a pattern from any reader that implements Read + Seek.
-///
-/// This is useful for loading from bytes (using `Cursor<Vec<u8>>`) or other non-file sources,
-/// which is particularly important for WASM environments.
-///
-/// # Arguments
-///
-/// * `reader` - The reader to read from. Must implement `Read` and `Seek`.
-/// * `filename` - The name of the file (used to determine format via extension).
-///
-/// # Examples
-///
-/// ```
-/// use std::io::Cursor;
-/// use geddes::from_reader;
-///
-/// let data = b"10.0 100.0\n10.1 105.0";
-/// let cursor = Cursor::new(data);
-/// let pattern = from_reader(cursor, "data.xy").unwrap();
-/// assert_eq!(pattern.x.len(), 2);
-/// ```
-pub fn from_reader<R: Read + Seek>(
-    reader: R,
+/// Load from a seekable stream. `filename` is a hint when content is ambiguous.
+pub fn from_reader<R: Read + Seek>(reader: R, filename: &str) -> Result<Pattern, Error> {
+    from_reader_with_options(reader, filename, &ReadOptions::default())
+}
+
+/// Load one selected pattern from a stream's current position to its end.
+/// `filename` is a format hint and is not opened.
+pub fn from_reader_with_options<R: Read + Seek>(
+    mut reader: R,
     filename: &str,
+    options: &ReadOptions,
 ) -> Result<Pattern, Error> {
-    let ext = Path::new(filename)
-        .extension()
-        .and_then(|s| s.to_str())
-        .unwrap_or("")
-        .to_lowercase();
-
-    let mut reader = reader;
-    let data = match ext.as_str() {
-        "raw" => {
-            // Check for binary (Bruker) vs Text (GSAS)
-            let mut buffer = [0u8; 1024];
-            let bytes_read = reader.read(&mut buffer)?;
-            reader.seek(SeekFrom::Start(0))?;
-
-            // Simple heuristic: if we find null bytes, assume binary.
-            let chunk = &buffer[..bytes_read];
-            let is_binary = chunk.iter().any(|&b| b == 0);
-
-            // GSAS usually starts with a title line or BANK, and is text.
-            // Bruker binary usually has non-text bytes.
-
-            if is_binary {
-                parse_bruker_raw(reader)?
-            } else {
-                parse_gsas_raw(reader)?
-            }
-        }
-        "rasx" => parse_rasx(reader)?,
-        "xrdml" => parse_xrdml(reader)?,
-        "xy" | "xye" => parse_xy(reader)?,
-        "csv" => parse_csv(reader)?,
-        _ => return Err(Error::UnknownFormat),
-    };
-
-    Pattern::from_parsed(data)
+    let mut bytes = Vec::new();
+    reader.read_to_end(&mut bytes)?;
+    read_bytes_with_options(&bytes, filename, options)
 }
 
-/// Load a pattern from in-memory bytes with a filename hint.
+/// Load bytes without opening a file. Extra columns, including uncertainties, are ignored.
 pub fn read_bytes<B: AsRef<[u8]>>(bytes: B, filename: &str) -> Result<Pattern, Error> {
-    let cursor = Cursor::new(bytes.as_ref());
-    from_reader(cursor, filename)
+    read_bytes_with_options(bytes, filename, &ReadOptions::default())
+}
+
+/// Load one selected pattern from complete file bytes, using `filename` as a
+/// format hint. Strictly descending positions and intensities are reversed together.
+pub fn read_bytes_with_options<B: AsRef<[u8]>>(
+    bytes: B,
+    filename: &str,
+    options: &ReadOptions,
+) -> Result<Pattern, Error> {
+    Pattern::from_parsed(parser::parse(bytes.as_ref(), filename, options)?)
 }
diff --git a/src/parser.rs b/src/parser.rs
index 6d5a769..75bfb54 100644
--- a/src/parser.rs
+++ b/src/parser.rs
@@ -1,726 +1,208 @@
-use crate::error::Error;
-use quick_xml::events::Event;
-use quick_xml::{Reader, XmlVersion};
-use std::collections::HashSet;
-use std::io::{BufRead, BufReader, Read, Seek};
-use zip::ZipArchive;
+use crate::{bruker, text, xml, Error, ReadOptions};
+use quick_xml::{events::Event, Reader};
+use std::borrow::Cow;
+use std::io::Cursor;
+use std::path::Path;
 
-/// Intermediate structure to hold parsed data before converting to the public Pattern struct.
 #[derive(Debug)]
 pub(crate) struct ParsedPattern {
     pub x: Vec<f64>,
     pub y: Vec<f64>,
-    pub e: Option<Vec<f64>>,
 }
 
-/// Helper to parse x, y, and optional e from string parts.
-fn parse_columns(parts: &[&str], x: &mut Vec<f64>, y: &mut Vec<f64>, e: &mut Vec<f64>) {
-    if parts.len() >= 2 {
-        if let (Ok(val_x), Ok(val_y)) = (parts[0].parse::<f64>(), parts[1].parse::<f64>()) {
-            x.push(val_x);
-            y.push(val_y);
-            if parts.len() >= 3 {
-                if let Ok(val_e) = parts[2].parse::<f64>() {
-                    e.push(val_e);
+/// Decode vendor text, including Windows UTF-16 exports identified by a BOM.
+pub(crate) fn decode(bytes: &[u8]) -> Result<Cow<'_, str>, Error> {
+    if bytes.starts_with(b"\xff\xfe") || bytes.starts_with(b"\xfe\xff") {
+        if !bytes.len().is_multiple_of(2) {
+            return Err(Error::Parse("truncated UTF-16 text".into()));
+        }
+        let little = bytes[0] == 0xff;
+        let words: Vec<u16> = bytes[2..]
+            .chunks_exact(2)
+            .map(|v| {
+                if little {
+                    u16::from_le_bytes([v[0], v[1]])
+                } else {
+                    u16::from_be_bytes([v[0], v[1]])
                 }
-            }
-        }
-    }
-}
-
-/// Parses standard XY files (two or three columns: x, y, [e]).
-///
-/// Ignores lines starting with '#' or '!'.
-pub(crate) fn parse_xy<R: Read>(reader: R) -> Result<ParsedPattern, Error> {
-    let reader = BufReader::new(reader);
-    let mut x = Vec::new();
-    let mut y = Vec::new();
-    let mut e = Vec::new();
-
-    for line in reader.lines() {
-        let line = line?;
-        let line = line.trim();
-        if line.is_empty() || line.starts_with('#') || line.starts_with('!') {
-            continue;
-        }
-        let parts: Vec<&str> = line.split_whitespace().collect();
-        parse_columns(&parts, &mut x, &mut y, &mut e);
-    }
-
-    let has_error = !e.is_empty() && e.len() == x.len();
-    Ok(ParsedPattern {
-        x,
-        y,
-        e: if has_error { Some(e) } else { None },
-    })
-}
-
-/// Parses CSV files.
-///
-/// Supports comma or whitespace as delimiters.
-pub(crate) fn parse_csv<R: Read>(reader: R) -> Result<ParsedPattern, Error> {
-    let reader = BufReader::new(reader);
-    let mut x = Vec::new();
-    let mut y = Vec::new();
-    let mut e = Vec::new();
-
-    for line in reader.lines() {
-        let line = line?;
-        let line = line.trim();
-        if line.is_empty() || line.starts_with('#') || line.starts_with('!') {
-            continue;
-        }
-        // Support both comma-separated and whitespace-separated CSV-like files.
-        let parts: Vec<&str> = line
-            .split(|c: char| c == ',' || c.is_whitespace())
-            .map(|p| p.trim())
-            .filter(|p| !p.is_empty())
+            })
             .collect();
-        parse_columns(&parts, &mut x, &mut y, &mut e);
-    }
-
-    let has_error = !e.is_empty() && e.len() == x.len();
-    Ok(ParsedPattern {
-        x,
-        y,
-        e: if has_error { Some(e) } else { None },
-    })
-}
-
-/// Parses Rigaku RASX files (zipped XML/text format).
-///
-/// Looks for a `Profile*.txt` file inside the archive.
-pub(crate) fn parse_rasx<R: Read + Seek>(reader: R) -> Result<ParsedPattern, Error> {
-    let mut archive = ZipArchive::new(reader)?;
-
-    let names: Vec<String> = (0..archive.len())
-        .filter_map(|i| archive.by_index(i).ok().map(|f| f.name().to_string()))
-        .collect();
-
-    // Prioritize Data0/Profile0.txt, or find any Profile*.txt
-    let profile_name = names
-        .iter()
-        .find(|n| n.as_str() == "Data0/Profile0.txt")
-        .or_else(|| {
-            names
-                .iter()
-                .find(|n| n.contains("Profile") && n.ends_with(".txt"))
-        })
-        .ok_or_else(|| Error::FileNotFoundInArchive("Profile*.txt".to_string()))?;
-
-    let file = archive.by_name(profile_name)?;
-    let reader = BufReader::new(file);
-
-    let mut x = Vec::new();
-    let mut y = Vec::new();
-
-    for line in reader.lines() {
-        let line = line?;
-        // Some RASX exports include a UTF-8 BOM at the beginning of Profile0.txt.
-        // Strip it so the first x value parses instead of being silently skipped.
-        let line = line.trim().trim_start_matches('\u{feff}');
-        if line.is_empty() {
-            continue;
-        }
-        let parts: Vec<&str> = line.split_whitespace().collect();
-        if parts.len() >= 2 {
-            if let (Ok(val_x), Ok(val_y)) = (parts[0].parse::<f64>(), parts[1].parse::<f64>()) {
-                x.push(val_x);
-                y.push(val_y);
-            }
-        }
-    }
-    Ok(ParsedPattern { x, y, e: None })
-}
-
-/// Parses Panalytical XRDML files (XML-based).
-///
-/// Extracts the 2Theta start/end positions and the intensities list.
-pub(crate) fn parse_xrdml<R: Read>(reader: R) -> Result<ParsedPattern, Error> {
-    let reader = BufReader::new(reader);
-    let mut xml = Reader::from_reader(reader);
-    xml.config_mut().trim_text(true);
-
-    let mut buf = Vec::new();
-    let mut intensities = Vec::new();
-    let mut in_intensities = false;
-    let mut in_positions_2theta = false;
-    let mut capture_start = false;
-    let mut capture_end = false;
-    let mut start_pos: Option<f64> = None;
-    let mut end_pos: Option<f64> = None;
-
-    loop {
-        match xml.read_event_into(&mut buf) {
-            Ok(Event::Start(e)) => match e.local_name().as_ref() {
-                b"positions" => {
-                    in_positions_2theta = false;
-                    for attr in e.attributes() {
-                        let attr = attr.map_err(|err| {
-                            Error::Parse(format!("XRDML attribute error: {err}"))
-                        })?;
-                        if attr.key.as_ref() == b"axis" {
-                            let axis = attr
-                                .normalized_value(XmlVersion::Implicit1_0)
-                                .map_err(|err| {
-                                    Error::Parse(format!(
-                                        "XRDML attribute decode error: {err}"
-                                    ))
-                                })?
-                                .into_owned();
-                            if axis == "2Theta" {
-                                in_positions_2theta = true;
-                            }
-                        }
-                    }
-                }
-                b"startPosition" => {
-                    if in_positions_2theta {
-                        capture_start = true;
-                    }
-                }
-                b"endPosition" => {
-                    if in_positions_2theta {
-                        capture_end = true;
-                    }
-                }
-                b"intensities" => {
-                    in_intensities = true;
-                }
-                _ => {}
-            },
-            Ok(Event::Text(e)) => {
-                let text = e
-                    .decode()
-                    .map_err(|err| Error::Parse(format!("XRDML text decode error: {err}")))?;
-                let text = text.trim();
-                if text.is_empty() {
-                    // Skip empty text nodes.
-                } else if capture_start {
-                    start_pos = Some(text.parse::<f64>().map_err(|_| {
-                        Error::Parse("XRDML invalid 2Theta start position".into())
-                    })?);
-                } else if capture_end {
-                    end_pos = Some(text.parse::<f64>().map_err(|_| {
-                        Error::Parse("XRDML invalid 2Theta end position".into())
-                    })?);
-                } else if in_intensities {
-                    for part in text.split_whitespace() {
-                        if let Ok(value) = part.parse::<f64>() {
-                            intensities.push(value);
-                        }
-                    }
-                }
-            }
-            Ok(Event::End(e)) => match e.local_name().as_ref() {
-                b"positions" => {
-                    in_positions_2theta = false;
-                }
-                b"startPosition" => {
-                    capture_start = false;
-                }
-                b"endPosition" => {
-                    capture_end = false;
-                }
-                b"intensities" => {
-                    in_intensities = false;
-                    if !intensities.is_empty() && start_pos.is_some() && end_pos.is_some() {
-                        break;
-                    }
-                }
-                _ => {}
-            },
-            Ok(Event::Eof) => break,
-            Err(err) => {
-                return Err(Error::Parse(format!("XRDML parse error: {err}")));
-            }
-            _ => {}
-        }
-        buf.clear();
-    }
-
-    let start = start_pos
-        .ok_or_else(|| Error::Parse("XRDML missing 2Theta start position".into()))?;
-    let end =
-        end_pos.ok_or_else(|| Error::Parse("XRDML missing 2Theta end position".into()))?;
-
-    if intensities.is_empty() {
-        return Err(Error::Parse("XRDML intensities not found".into()));
+        return String::from_utf16(&words)
+            .map(Cow::Owned)
+            .map_err(|_| Error::Parse("invalid UTF-16 text".into()));
     }
-
-    let mut x = Vec::with_capacity(intensities.len());
-    if intensities.len() == 1 {
-        x.push(start);
-    } else {
-        let step = (end - start) / (intensities.len() as f64 - 1.0);
-        for i in 0..intensities.len() {
-            x.push(start + (i as f64) * step);
-        }
-    }
-
-    Ok(ParsedPattern {
-        x,
-        y: intensities,
-        e: None,
-    })
+    let bytes = bytes.strip_prefix(b"\xef\xbb\xbf").unwrap_or(bytes);
+    // Legacy headers may contain non-UTF8 names; numeric data are ASCII.
+    Ok(String::from_utf8_lossy(bytes))
 }
 
-/// Parses GSAS RAW files.
-///
-/// Expects a `BANK` header line to determine start angle and step size.
-pub(crate) fn parse_gsas_raw<R: Read>(reader: R) -> Result<ParsedPattern, Error> {
-    let reader = BufReader::new(reader);
-    let mut lines = reader.lines();
-
-    let mut start = 0.0;
-    let mut step = 0.0;
-
-    let mut header_found = false;
-
-    for line_res in lines.by_ref() {
-        let line = line_res?;
-        if line.starts_with("BANK") {
-            let parts: Vec<&str> = line.split_whitespace().collect();
-            // BANK 1 4941 494 CONST 1600.0 1.7 0.0 0.0 STD
-            if parts.len() >= 7 {
-                let start_raw = parts[5]
-                    .parse::<f64>()
-                    .map_err(|_| Error::Parse("Invalid start".into()))?;
-                let step_raw = parts[6]
-                    .parse::<f64>()
-                    .map_err(|_| Error::Parse("Invalid step".into()))?;
-
-                // GSAS standard: centidegrees
-                start = start_raw / 100.0;
-                step = step_raw / 100.0;
-                header_found = true;
-                break;
-            }
-        }
-    }
-
-    if !header_found {
+fn one_pattern(options: &ReadOptions) -> Result<(), Error> {
+    if options.index != 0 {
         return Err(Error::Parse(
-            "BANK header not found in RAW file".into(),
+            "this format has one pattern; index must be 0".into(),
         ));
     }
-
-    let mut y = Vec::new();
-
-    for line in lines {
-        let line = line?;
-        if line.starts_with("BANK") {
-            break;
-        }
-        let parts = line.split_whitespace();
-        for part in parts {
-            if let Ok(val) = part.parse::<f64>() {
-                y.push(val);
-            }
-        }
-    }
-
-    // Generate x
-    let mut x = Vec::with_capacity(y.len());
-    for i in 0..y.len() {
-        x.push(start + (i as f64) * step);
-    }
-
-    Ok(ParsedPattern { x, y, e: None })
-}
-
-/// Parses Bruker binary RAW files.
-///
-/// Uses heuristics to locate the intensity block and axis metadata.
-///
-/// Bruker RAW4 files are not fully documented and may store intensity points
-/// either as contiguous `f32` values or as interleaved records near the file
-/// tail (e.g. `f32 value` + `u32 status`).
-pub(crate) fn parse_bruker_raw<R: Read>(mut reader: R) -> Result<ParsedPattern, Error> {
-    let mut buf = Vec::new();
-    reader.read_to_end(&mut buf)?;
-
-    if !buf.starts_with(b"RAW") {
-        return Err(Error::Parse(
-            "Unsupported Bruker RAW header".into(),
-        ));
-    }
-
-    let mut candidate_layouts = Vec::new();
-    if let Some(layout) = find_bruker_interleaved_tail_block(&buf) {
-        candidate_layouts.push(layout);
-        candidate_layouts.extend(find_bruker_interleaved_count_marker_blocks(
-            &buf,
-            layout.data_offset,
-        ));
-    }
-    if let Some(layout) = find_bruker_plain_f32_tail_block(&buf) {
-        candidate_layouts.push(layout);
-    }
-
-    let mut seen_layouts = HashSet::new();
-    candidate_layouts.retain(|layout| {
-        seen_layouts.insert((
-            layout.count,
-            layout.data_offset,
-            layout.stride,
-            layout.value_offset,
-        ))
-    });
-
-    let mut selected: Option<(BrukerDataLayout, f64, f64, bool, f64)> = None;
-    for layout in candidate_layouts {
-        if !bruker_layout_data_plausible(&buf, layout) {
-            continue;
-        }
-        let count_offsets = find_bruker_count_offsets(&buf, layout.count, layout.data_offset);
-        if let Some((start, step, has_count_marker)) = find_bruker_start_step(
-            &buf,
-            &count_offsets,
-            layout.count,
-            layout.data_offset,
-        ) {
-            let score = score_bruker_start_step(start, step, layout.count);
-            match selected {
-                Some((_, _, _, best_has_count_marker, best_score))
-                    if (has_count_marker as u8, score)
-                        <= (best_has_count_marker as u8, best_score) => {}
-                _ => selected = Some((layout, start, step, has_count_marker, score)),
-            }
-        }
-    }
-
-    let (layout, start, step, _, _) = selected.ok_or_else(|| {
-        Error::Parse("Failed to locate Bruker RAW start/step metadata".into())
-    })?;
-    let count = layout.count;
-
-    let count_usize = count as usize;
-    let mut y = Vec::with_capacity(count_usize);
-    for i in 0..count_usize {
-        let off = layout.data_offset + i * layout.stride + layout.value_offset;
-        let val = read_f32_le(&buf, off).ok_or_else(|| {
-            Error::Parse("Bruker RAW intensity data truncated".into())
-        })?;
-        y.push(val as f64);
-    }
-
-    let mut x = Vec::with_capacity(count_usize);
-    for i in 0..count_usize {
-        x.push(start + step * (i as f64));
-    }
-
-    Ok(ParsedPattern { x, y, e: None })
-}
-
-#[derive(Debug, Clone, Copy)]
-struct BrukerDataLayout {
-    count: u32,
-    data_offset: usize,
-    stride: usize,
-    value_offset: usize,
-}
-
-fn find_bruker_plain_f32_tail_block(buf: &[u8]) -> Option<BrukerDataLayout> {
-    let len = buf.len();
-    let mut best: Option<BrukerDataLayout> = None;
-
-    for off in 0..len.saturating_sub(4) {
-        let count = read_u32_le(buf, off)?;
-        if count < 10 || count > 5_000_000 {
-            continue;
-        }
-        let data_len = (count as usize) * 4;
-        if data_len > len {
-            continue;
-        }
-        let data_offset = len - data_len;
-        if data_offset <= off {
-            continue;
-        }
-
-        let layout = BrukerDataLayout {
-            count,
-            data_offset,
-            stride: 4,
-            value_offset: 0,
-        };
-
-        match best {
-            Some(best_layout) if count <= best_layout.count => {}
-            _ => best = Some(layout),
-        }
-    }
-
-    best
-}
-
-fn find_bruker_interleaved_tail_block(buf: &[u8]) -> Option<BrukerDataLayout> {
-    const MIN_POINTS: usize = 32;
-    const FLAG_MAX: u32 = 3;
-
-    let len = buf.len();
-    let mut best: Option<BrukerDataLayout> = None;
-
-    for value_offset in [0usize, 4usize] {
-        let companion_offset = if value_offset == 0 { 4usize } else { 0usize };
-        let mut run = 0usize;
-
-        while len >= (run + 1) * 8 {
-            let rec_off = len - (run + 1) * 8;
-            let flag = match read_u32_le(buf, rec_off + companion_offset) {
-                Some(v) => v,
-                None => break,
-            };
-            if flag > FLAG_MAX {
-                break;
-            }
-            let val = match read_f32_le(buf, rec_off + value_offset) {
-                Some(v) => v,
-                None => break,
-            };
-            if !val.is_finite() || val.abs() > 1.0e9 {
-                break;
-            }
-            run += 1;
-        }
-
-        if run < MIN_POINTS {
-            continue;
-        }
-
-        let candidate = BrukerDataLayout {
-            count: run as u32,
-            data_offset: len - run * 8,
-            stride: 8,
-            value_offset,
-        };
-
-        match best {
-            Some(current) if candidate.count <= current.count => {}
-            _ => best = Some(candidate),
-        }
-    }
-
-    best
-}
-
-fn find_bruker_interleaved_count_marker_blocks(
-    buf: &[u8],
-    search_end: usize,
-) -> Vec<BrukerDataLayout> {
-    const MIN_POINTS: u32 = 32;
-    const MAX_POINTS: u32 = 5_000_000;
-    const FLAG_MAX: u32 = 3;
-
-    let len = buf.len();
-    let mut layouts = Vec::new();
-    let mut seen = HashSet::new();
-
-    let end = search_end.min(len.saturating_sub(4));
-    for off in 0..=end {
-        let count = match read_u32_le(buf, off) {
-            Some(value) => value,
-            None => continue,
-        };
-        if !(MIN_POINTS..=MAX_POINTS).contains(&count) {
-            continue;
-        }
-
-        let start_off = match off.checked_sub(16) {
-            Some(value) => value,
-            None => continue,
-        };
-        let (start, step) = match (read_f64_le(buf, start_off), read_f64_le(buf, start_off + 8)) {
-            (Some(start), Some(step)) => (start, step),
-            _ => continue,
-        };
-        if !bruker_start_step_valid(start, step, count) {
-            continue;
-        }
-
-        let data_len = (count as usize) * 8;
-        if data_len > len {
-            continue;
-        }
-        let data_offset = len - data_len;
-        if off >= data_offset {
-            continue;
-        }
-
-        for value_offset in [0usize, 4usize] {
-            let companion_offset = if value_offset == 0 { 4usize } else { 0usize };
-            let count_usize = count as usize;
-            let sample_indices = [0usize, count_usize / 2, count_usize - 1];
-            let mut flags_plausible = true;
-            for idx in sample_indices {
-                let rec_off = data_offset + idx * 8;
-                let flag = match read_u32_le(buf, rec_off + companion_offset) {
-                    Some(v) => v,
-                    None => {
-                        flags_plausible = false;
-                        break;
-                    }
-                };
-                if flag > FLAG_MAX {
-                    flags_plausible = false;
-                    break;
-                }
-            }
-            if !flags_plausible {
-                continue;
-            }
-
-            let key = (count, data_offset, value_offset);
-            if seen.insert(key) {
-                layouts.push(BrukerDataLayout {
-                    count,
-                    data_offset,
-                    stride: 8,
-                    value_offset,
-                });
-            }
-        }
-    }
-
-    layouts
+    Ok(())
 }
 
-fn bruker_layout_data_plausible(buf: &[u8], layout: BrukerDataLayout) -> bool {
-    let count = layout.count as usize;
-    if count == 0 {
+fn has_xrdml_root(content: &str) -> bool {
+    if !content.trim_start().starts_with('<') {
         return false;
     }
-
-    // Sample evenly across the candidate stream. A high fraction of subnormal
-    // values strongly indicates we are reading marker words as floats.
-    let samples = count.min(64);
-    let mut subnormal = 0usize;
-
-    for s in 0..samples {
-        let idx = if samples == 1 {
-            0
-        } else {
-            s * (count - 1) / (samples - 1)
-        };
-        let off = layout.data_offset + idx * layout.stride + layout.value_offset;
-        let val = match read_f32_le(buf, off) {
-            Some(v) => v,
-            None => return false,
-        };
-        if !val.is_finite() {
-            return false;
-        }
-        if val != 0.0 && val.abs() < f32::MIN_POSITIVE {
-            subnormal += 1;
-        }
-    }
-
-    (subnormal as f64) / (samples as f64) <= 0.2
-}
-
-fn find_bruker_count_offsets(buf: &[u8], count: u32, search_end: usize) -> Vec<usize> {
-    if search_end < 4 {
-        return Vec::new();
-    }
-    let end = search_end.min(buf.len().saturating_sub(4));
-    let mut offsets = Vec::new();
-
-    for off in 0..=end {
-        if read_u32_le(buf, off) == Some(count) {
-            offsets.push(off);
-        }
-    }
-    offsets
-}
-
-fn find_bruker_start_step(
-    buf: &[u8],
-    count_offsets: &[usize],
-    count: u32,
-    search_end: usize,
-) -> Option<(f64, f64, bool)> {
-    let mut best: Option<(f64, f64, f64)> = None;
-
-    for &count_offset in count_offsets {
-        if let Some(start_off) = count_offset.checked_sub(16) {
-            if let (Some(start), Some(step)) =
-                (read_f64_le(buf, start_off), read_f64_le(buf, start_off + 8))
-            {
-                if bruker_start_step_valid(start, step, count) {
-                    let score = score_bruker_start_step(start, step, count);
-                    match best {
-                        Some((_, _, best_score)) if score <= best_score => {}
-                        _ => best = Some((start, step, score)),
-                    }
-                }
+    let mut reader = Reader::from_str(content);
+    loop {
+        match reader.read_event() {
+            Ok(Event::Start(root) | Event::Empty(root)) => {
+                return root.local_name().as_ref() == b"xrdMeasurements";
             }
-        }
-    }
-
-    if best.is_some() {
-        return best.map(|(start, step, _)| (start, step, true));
-    }
-
-    // Some Bruker RAW variants do not expose a count marker adjacent to axis
-    // metadata. Fall back to scanning the pre-data region for plausible pairs.
-    let end = search_end.min(buf.len().saturating_sub(16));
-    for off in 0..=end {
-        let (start, step) = match (read_f64_le(buf, off), read_f64_le(buf, off + 8)) {
-            (Some(start), Some(step)) => (start, step),
-            _ => continue,
+            Ok(Event::Decl(_) | Event::PI(_) | Event::Comment(_) | Event::DocType(_)) => {}
+            Ok(Event::Text(text)) if text.iter().all(u8::is_ascii_whitespace) => {}
+            _ => return false,
+        }
+    }
+}
+
+pub(crate) fn parse(
+    bytes: &[u8],
+    filename: &str,
+    options: &ReadOptions,
+) -> Result<ParsedPattern, Error> {
+    let ext = Path::new(filename)
+        .extension()
+        .and_then(|v| v.to_str())
+        .unwrap_or("")
+        .to_ascii_lowercase();
+    if bytes.starts_with(b"RAW1.01")
+        || bytes.starts_with(b"RAW4.00")
+        || bytes.starts_with(b"RAW2")
+        || bytes.starts_with(b"RAW ") && bytes[..bytes.len().min(256)].contains(&0)
+    {
+        return bruker::parse_bruker_raw(bytes, options.index);
+    }
+    if bytes.starts_with(b"PK\x03\x04") || bytes.starts_with(b"PK\x05\x06") {
+        let archive = zip::ZipArchive::new(Cursor::new(bytes))?;
+        if archive
+            .file_names()
+            .any(|n| n.ends_with("DataContainer.xml"))
+        {
+            return xml::parse_brml(bytes, options.index);
+        }
+        if archive
+            .file_names()
+            .any(|n| n == "root.xml" || (n.contains("Profile") && n.ends_with(".txt")))
+        {
+            return xml::parse_rasx(bytes, options.index);
+        }
+        return Err(Error::UnknownFormat);
+    }
+    let content = decode(bytes)?;
+    let mut end = content.len().min(65536);
+    while !content.is_char_boundary(end) {
+        end -= 1;
+    }
+    let head = &content[..end];
+    if head.contains('\0') {
+        return Err(Error::UnknownFormat);
+    }
+    // All strong content recognizers run before extension fallbacks.
+    if has_xrdml_root(&content) {
+        return xml::parse_xrdml(bytes, options.index);
+    }
+    if head.lines().any(|l| {
+        l.trim_start().starts_with("*RAS_DATA_START")
+            || l.trim_start().starts_with("*RAS_HEADER_START")
+    }) {
+        return text::parse_ras(bytes, options.index);
+    }
+    if head.lines().any(|l| l.trim_start().starts_with("data_")) && head.contains("_pd_") {
+        one_pattern(options)?;
+        return text::parse_pdcif(bytes, options.block.as_deref());
+    }
+    if head
+        .lines()
+        .any(|l| l.split_whitespace().next() == Some("BANK"))
+    {
+        return text::parse_gsas(bytes, options.index);
+    }
+    if head
+        .lines()
+        .any(|l| l.trim_start().starts_with("_DRIVE=") || l.trim_start().starts_with("_DRIVE ="))
+    {
+        return text::parse_uxd(bytes, options.index);
+    }
+    let lines: Vec<&str> = head.lines().take(5).collect();
+    let chi_header = lines.len() >= 5
+        && lines[..3].iter().all(|l| {
+            let s = l.trim();
+            !s.is_empty()
+                && !s.starts_with(['#', '!', ';'])
+                && s.split_whitespace()
+                    .take(2)
+                    .any(|v| v.parse::<f64>().is_err())
+        })
+        && {
+            let fields: Vec<_> = lines[3].split_whitespace().collect();
+            !fields.is_empty()
+                && fields.len() <= 2
+                && (fields.len() == 1 || fields[1] == "1")
+                && fields.iter().all(|v| v.parse::<usize>().is_ok())
+                && fields[0].parse::<usize>().ok()
+                    == Some(
+                        content
+                            .lines()
+                            .skip(4)
+                            .filter(|l| !l.trim().is_empty())
+                            .count(),
+                    )
         };
-        if bruker_start_step_valid(start, step, count) {
-            let score = score_bruker_start_step(start, step, count);
-            match best {
-                Some((_, _, best_score)) if score <= best_score => {}
-                _ => best = Some((start, step, score)),
+    if chi_header {
+        one_pattern(options)?;
+        return text::parse_chi(bytes);
+    }
+    match ext.as_str() {
+        "xrdml" => return xml::parse_xrdml(bytes, options.index),
+        "ras" => return text::parse_ras(bytes, options.index),
+        "uxd" => return text::parse_uxd(bytes, options.index),
+        "gsas" | "gsa" | "fxye" | "gda" | "xra" | "raw" => {
+            return text::parse_gsas(bytes, options.index)
+        }
+        "cif" => {
+            one_pattern(options)?;
+            return text::parse_pdcif(bytes, options.block.as_deref());
+        }
+        "chi" => {
+            one_pattern(options)?;
+            return text::parse_chi(bytes);
+        }
+        "rasx" | "brml" => {
+            return Err(Error::Parse(format!("{ext} is not a readable ZIP archive")))
+        }
+        "dif" => {
+            let reflections = head
+                .lines()
+                .filter(|line| {
+                    let p: Vec<_> = line.split_whitespace().collect();
+                    (p.len() == 5 || p.len() == 6)
+                        && p[..2].iter().all(|v| v.parse::<f64>().is_ok())
+                        && p[p.len() - 3..].iter().all(|v| v.parse::<i32>().is_ok())
+                })
+                .count();
+            if reflections >= 3
+                || head.lines().any(|l| {
+                    l.to_lowercase()
+                        .split_whitespace()
+                        .collect::<Vec<_>>()
+                        .windows(3)
+                        .any(|w| w == ["h", "k", "l"])
+                })
+            {
+                return Err(Error::Parse(
+                    "DIF reflection peak lists are not measured XRD profiles".into(),
+                ));
             }
         }
+        _ => {}
     }
-
-    best.map(|(start, step, _)| (start, step, false))
-}
-
-fn bruker_start_step_valid(start: f64, step: f64, count: u32) -> bool {
-    if !start.is_finite() || !step.is_finite() || step <= 1.0e-6 || step > 10.0 {
-        return false;
-    }
-    let n = count as f64;
-    let end = start + step * (n - 1.0);
-    if !end.is_finite() {
-        return false;
-    }
-    let span = step * ((n - 1.0).max(0.0));
-    if !span.is_finite() || !(1.0..=360.0).contains(&span) {
-        return false;
-    }
-    true
-}
-
-fn score_bruker_start_step(start: f64, step: f64, count: u32) -> f64 {
-    let span = step * ((count as f64 - 1.0).max(0.0));
-    let mut score = span.min(360.0);
-    if (0.0..=180.0).contains(&start) {
-        score += 50.0;
-    }
-    if (1.0e-4..=0.5).contains(&step) {
-        score += 25.0;
-    }
-    score
-}
-
-fn read_u32_le(buf: &[u8], offset: usize) -> Option<u32> {
-    let bytes = buf.get(offset..offset + 4)?;
-    Some(u32::from_le_bytes(bytes.try_into().ok()?))
-}
-
-fn read_f32_le(buf: &[u8], offset: usize) -> Option<f32> {
-    let bytes = buf.get(offset..offset + 4)?;
-    Some(f32::from_le_bytes(bytes.try_into().ok()?))
-}
-
-fn read_f64_le(buf: &[u8], offset: usize) -> Option<f64> {
-    let bytes = buf.get(offset..offset + 8)?;
-    Some(f64::from_le_bytes(bytes.try_into().ok()?))
+    one_pattern(options)?;
+    text::parse_xy(bytes)
 }
diff --git a/src/python.rs b/src/python.rs
index b5289ab..badeb82 100644
--- a/src/python.rs
+++ b/src/python.rs
@@ -1,50 +1,45 @@
-use crate::{from_reader, read, Error, Pattern};
+use crate::{read_bytes_with_options, read_with_options, Error, Pattern, ReadOptions};
 use pyo3::exceptions::{PyIOError, PyValueError};
 use pyo3::prelude::*;
 use pyo3::types::PyBytes;
-use std::io::Cursor;
 
-/// Convert a Rust library error into a Python exception.
 fn to_py_err(err: Error) -> PyErr {
     match err {
         Error::Io(err) => PyIOError::new_err(err.to_string()),
-        Error::Zip(err) => PyValueError::new_err(err.to_string()),
-        Error::Parse(msg) => PyValueError::new_err(msg),
-        Error::UnknownFormat => PyValueError::new_err("Unknown format"),
-        Error::FileNotFoundInArchive(name) => {
-            PyValueError::new_err(format!("File not found in archive: {}", name))
-        }
+        other => PyValueError::new_err(other.to_string()),
     }
 }
 
 #[pymethods]
 impl Pattern {
     #[new]
-    fn py_new(x: Vec<f64>, y: Vec<f64>, e: Option<Vec<f64>>) -> PyResult<Self> {
-        Pattern::new(x, y, e).map_err(to_py_err)
+    fn py_new(x: Vec<f64>, y: Vec<f64>) -> PyResult<Self> {
+        Pattern::new(x, y).map_err(to_py_err)
     }
 }
 
-/// Load a pattern from a file path.
-#[pyfunction(name = "read")]
-fn read_py(path: &str) -> PyResult<Pattern> {
-    read(path).map_err(to_py_err)
+/// Load one XRD pattern as x (2theta degrees) and y (intensity).
+#[pyfunction(name = "read", signature = (path, *, index=0, block=None))]
+fn read_py(path: &str, index: usize, block: Option<String>) -> PyResult<Pattern> {
+    read_with_options(path, &ReadOptions { index, block }).map_err(to_py_err)
 }
 
-/// Load a pattern from raw bytes with a filename hint.
-#[pyfunction]
+/// Load bytes using content detection and a filename hint.
+#[pyfunction(signature = (data, filename, *, index=0, block=None))]
 fn read_bytes(
     data: &Bound<'_, PyBytes>,
     filename: &str,
+    index: usize,
+    block: Option<String>,
 ) -> PyResult<Pattern> {
-    let cursor = Cursor::new(data.as_bytes());
-    from_reader(cursor, filename).map_err(to_py_err)
+    read_bytes_with_options(data.as_bytes(), filename, &ReadOptions { index, block })
+        .map_err(to_py_err)
 }
 
-/// Python module definition for the `geddes` extension.
 #[pymodule]
 fn geddes(m: &Bound<'_, PyModule>) -> PyResult<()> {
     m.add_class::<Pattern>()?;
+    m.add("__version__", env!("CARGO_PKG_VERSION"))?;
     m.add_function(wrap_pyfunction!(read_py, m)?)?;
     m.add_function(wrap_pyfunction!(read_bytes, m)?)?;
     Ok(())
diff --git a/src/text.rs b/src/text.rs
new file mode 100644
index 0000000..69a8fe0
--- /dev/null
+++ b/src/text.rs
@@ -0,0 +1,748 @@
+//! Text diffraction formats. Only measured positions and intensities are retained.
+use crate::{
+    error::Error,
+    parser::{decode, ParsedPattern},
+};
+use std::collections::HashMap;
+
+fn invalid(message: impl Into<String>) -> Error {
+    Error::Parse(message.into())
+}
+
+fn number(token: &str) -> Result<f64, Error> {
+    let value = token
+        .parse::<f64>()
+        .or_else(|_| {
+            if token.contains(['d', 'D']) {
+                token.replace(['d', 'D'], "E").parse::<f64>()
+            } else {
+                token.parse::<f64>()
+            }
+        })
+        .map_err(|_| invalid(format!("Invalid numeric value {token:?}")))?;
+    if !value.is_finite() {
+        return Err(invalid(format!("Non-finite numeric value {token:?}")));
+    }
+    Ok(value)
+}
+
+fn pattern(x: Vec<f64>, y: Vec<f64>, format: &str) -> Result<ParsedPattern, Error> {
+    if x.is_empty() || x.len() != y.len() {
+        return Err(invalid(format!("{format}: no complete x/y pattern found")));
+    }
+    Ok(ParsedPattern { x, y })
+}
+
+fn fields(line: &str) -> impl Iterator<Item = &str> {
+    line.split(|c: char| c == ',' || c.is_whitespace())
+        .filter(|s| !s.is_empty())
+}
+
+fn xy_row(line: &str, format: &str) -> Result<(f64, f64), Error> {
+    let mut parts = fields(line);
+    let x = parts
+        .next()
+        .ok_or_else(|| invalid(format!("{format}: missing position")))?;
+    let y = parts
+        .next()
+        .ok_or_else(|| invalid(format!("{format}: missing intensity")))?;
+    Ok((number(x)?, number(y)?))
+}
+
+pub(crate) fn parse_xy(bytes: &[u8]) -> Result<ParsedPattern, Error> {
+    let mut x = Vec::new();
+    let mut y = Vec::new();
+    let text = decode(bytes)?;
+    for line in text.lines() {
+        let row = line.trim().trim_start_matches('\u{feff}');
+        if row.contains('\0') {
+            return Err(invalid("Binary data supplied to an ASCII pattern reader"));
+        }
+        if !row.is_empty() && !row.starts_with(['#', '!', '\'', '/', ';']) {
+            let mut parts = fields(row);
+            if let (Some(a), Some(b)) = (parts.next(), parts.next()) {
+                // As in conventional XY readers, prose headers are ignored.
+                if let (Ok(a), Ok(b)) = (a.parse::<f64>(), b.parse::<f64>()) {
+                    if !a.is_finite() || !b.is_finite() {
+                        return Err(invalid("ASCII pattern contains a non-finite value"));
+                    }
+                    x.push(a);
+                    y.push(b);
+                }
+            }
+        }
+    }
+    pattern(x, y, "ASCII")
+}
+
+pub(crate) fn parse_gsas(bytes: &[u8], scan: usize) -> Result<ParsedPattern, Error> {
+    let text = decode(bytes)?;
+    let lines: Vec<&str> = text.lines().collect();
+    let banks: Vec<usize> = lines
+        .iter()
+        .enumerate()
+        .filter_map(|(i, line)| (line.split_whitespace().next() == Some("BANK")).then_some(i))
+        .collect();
+    let &start_line = banks.get(scan).ok_or_else(|| {
+        invalid(format!(
+            "GSAS: bank index {scan} is out of range ({} banks)",
+            banks.len()
+        ))
+    })?;
+    let header: Vec<&str> = lines[start_line].split_whitespace().collect();
+    if header.len() < 5 {
+        return Err(invalid("GSAS: incomplete BANK header"));
+    }
+    let bintype = header[4].to_ascii_uppercase();
+    if !matches!(bintype.as_str(), "CONS" | "CONST") {
+        return Err(invalid(format!(
+            "GSAS: {bintype} binning does not provide a supported 2theta axis"
+        )));
+    }
+    if header.len() < 7 {
+        return Err(invalid("GSAS: CONS/CONST requires a start and step"));
+    }
+    let count = header[2]
+        .parse::<usize>()
+        .map_err(|_| invalid("GSAS: invalid channel count"))?;
+    if count == 0 {
+        return Err(invalid("GSAS: zero channels"));
+    }
+    let start = number(header[5])? / 100.0;
+    let step = number(header[6])? / 100.0;
+    let mut flag = "STD";
+    for token in &header[7..] {
+        if token.starts_with(['#', '!']) {
+            break;
+        }
+        if token
+            .as_bytes()
+            .first()
+            .is_some_and(u8::is_ascii_alphabetic)
+        {
+            flag = token;
+            break;
+        }
+        number(token)?;
+    }
+    let flag = flag.to_ascii_uppercase();
+    if !matches!(flag.as_str(), "STD" | "ESD" | "FXYE") {
+        return Err(invalid(format!("GSAS: unsupported record type {flag}")));
+    }
+    let end_line = banks.get(scan + 1).copied().unwrap_or(lines.len());
+    let body: Vec<&str> = lines[start_line + 1..end_line]
+        .iter()
+        .copied()
+        .filter(|l| {
+            let s = l.trim();
+            !s.is_empty() && !s.starts_with(['#', '!'])
+        })
+        .collect();
+    let mut x = Vec::new();
+    let mut y = Vec::new();
+    if flag == "FXYE" {
+        for line in body {
+            let mut row = line.split_whitespace();
+            let a = row
+                .next()
+                .ok_or_else(|| invalid("GSAS FXYE: missing position"))?;
+            let b = row
+                .next()
+                .ok_or_else(|| invalid("GSAS FXYE: missing intensity"))?;
+            let esd = row
+                .next()
+                .ok_or_else(|| invalid("GSAS FXYE: missing third column"))?;
+            if row.next().is_some() {
+                return Err(invalid(
+                    "GSAS FXYE: each record must have exactly three columns",
+                ));
+            }
+            x.push(number(a)? / 100.0);
+            y.push(number(b)?);
+            number(esd)?;
+        }
+        // APS 11-BM exports can carry a final endpoint beyond NCHAN. Keep
+        // all explicit FXYE rows, as their positions are self-contained.
+        if y.len() < count {
+            return Err(invalid(format!(
+                "GSAS FXYE: BANK declares {count} points but {} were read",
+                y.len()
+            )));
+        }
+    } else {
+        if step == 0.0 {
+            return Err(invalid("GSAS: step must be nonzero"));
+        }
+        let mut values = Vec::new();
+        for line in body {
+            if flag == "ESD" {
+                // ESD has ten 8-character fields per 80-character record. A
+                // full-width number may touch its neighbor with no whitespace.
+                if !line.is_ascii() {
+                    return Err(invalid("GSAS ESD: non-ASCII numeric record"));
+                }
+                if line.len() >= 16 && line.len() % 8 == 0 {
+                    for chunk in line.as_bytes().chunks(8) {
+                        let field = std::str::from_utf8(chunk).unwrap().trim();
+                        if !field.is_empty() {
+                            values.push(number(field)?);
+                        }
+                    }
+                } else {
+                    // Some exporters use free-format ESD pairs. Fixed-width
+                    // records with trailing spaces removed still parse first.
+                    let fixed: Result<Vec<f64>, Error> = line
+                        .as_bytes()
+                        .chunks(8)
+                        .filter_map(|p| {
+                            let token = std::str::from_utf8(p).unwrap().trim();
+                            (!token.is_empty()).then(|| number(token))
+                        })
+                        .collect();
+                    match fixed {
+                        Ok(v) if v.len() % 2 == 0 => values.extend(v),
+                        _ => {
+                            let v: Result<Vec<_>, _> =
+                                line.split_whitespace().map(number).collect();
+                            let v = v?;
+                            if v.len() % 2 != 0 {
+                                return Err(invalid("GSAS ESD: incomplete intensity/esd pair"));
+                            }
+                            values.extend(v);
+                        }
+                    }
+                }
+            } else {
+                // Uncompressed STD records reserve the first two characters
+                // of each 8-character field. Do not mistake a repeat count
+                // for an intensity; compressed STD is outside the reference
+                // reader's supported layouts and is explicitly rejected.
+                if line.is_ascii() && line.len() >= 8 && line.len() % 8 == 0 {
+                    let chunks: Vec<&[u8]> = line.as_bytes().chunks(8).collect();
+                    let positional = chunks.iter().all(|p| {
+                        let prefix = std::str::from_utf8(&p[..2]).unwrap().trim();
+                        let value = std::str::from_utf8(&p[2..]).unwrap().trim();
+                        (prefix.is_empty() || prefix.parse::<u8>().is_ok())
+                            && !value.is_empty()
+                            && number(value).is_ok()
+                    });
+                    if positional {
+                        for chunk in chunks {
+                            let repeat = std::str::from_utf8(&chunk[..2]).unwrap().trim();
+                            if !repeat.is_empty() && repeat != "0" && repeat != "1" {
+                                return Err(invalid(
+                                    "GSAS STD: compressed repeat-count records are unsupported",
+                                ));
+                            }
+                            values.push(number(std::str::from_utf8(&chunk[2..]).unwrap().trim())?);
+                        }
+                        continue;
+                    }
+                }
+                values.extend(
+                    line.split_whitespace()
+                        .map(number)
+                        .collect::<Result<Vec<_>, _>>()?,
+                );
+            }
+        }
+        let width = if flag == "ESD" { 2 } else { 1 };
+        if values.len() % width != 0 || values.len() / width < count {
+            return Err(invalid(format!(
+                "GSAS {flag}: data is shorter than the declared {count} channels"
+            )));
+        }
+        // The last legacy record may be padded with zero fields to 80 columns.
+        if values[count * width..].iter().any(|v| *v != 0.0) || values.len() - count * width >= 10 {
+            return Err(invalid(format!(
+                "GSAS {flag}: unexpected data beyond the declared channel count"
+            )));
+        }
+        for i in 0..count {
+            x.push(start + i as f64 * step);
+            y.push(values[i * width]);
+        }
+    }
+    pattern(x, y, "GSAS")
+}
+
+fn axis_key(value: &str) -> String {
+    value
+        .chars()
+        .filter(|c| !c.is_whitespace() && *c != '-' && *c != '_')
+        .flat_map(char::to_lowercase)
+        .collect()
+}
+
+fn check_axis(value: &str, format: &str) -> Result<(), Error> {
+    let key = axis_key(value);
+    if matches!(
+        key.as_str(),
+        "theta"
+            | "omega"
+            | "phi"
+            | "chi"
+            | "khi"
+            | "psi"
+            | "x"
+            | "y"
+            | "z"
+            | "alpha"
+            | "beta"
+            | "q"
+            | "d"
+            | "tof"
+            | "time"
+            | "2thetarad"
+    ) {
+        return Err(invalid(format!(
+            "{format}: axis {value:?} is not 2theta in degrees"
+        )));
+    }
+    Ok(())
+}
+
+pub(crate) fn parse_ras(bytes: &[u8], scan: usize) -> Result<ParsedPattern, Error> {
+    let text = decode(bytes)?;
+    let mut index = 0;
+    let mut active = false;
+    let mut axis = String::new();
+    let mut count = None;
+    let mut x = Vec::new();
+    let mut y = Vec::new();
+    for line in text.lines().map(str::trim).filter(|l| !l.is_empty()) {
+        match line {
+            "*RAS_HEADER_START" => {
+                axis.clear();
+                count = None;
+            }
+            "*RAS_INT_START" => {
+                if active {
+                    return Err(invalid("RAS: nested intensity blocks"));
+                }
+                active = true;
+                if index == scan {
+                    check_axis(&axis, "RAS")?;
+                }
+            }
+            "*RAS_INT_END" => {
+                if !active {
+                    return Err(invalid(
+                        "RAS: intensity block closes without an opening marker",
+                    ));
+                }
+                if index == scan {
+                    if count.is_some_and(|n| n != x.len()) {
+                        return Err(invalid(
+                            "RAS: declared point count disagrees with intensity block",
+                        ));
+                    }
+                    return pattern(x, y, "RAS");
+                }
+                index += 1;
+                active = false;
+            }
+            _ if active => {
+                if index == scan {
+                    let (a, b) = xy_row(line, "RAS")?;
+                    x.push(a);
+                    y.push(b);
+                }
+            }
+            _ => {
+                if let Some((key, value)) = line.split_once(char::is_whitespace) {
+                    let value = value.trim().trim_matches('"');
+                    if key == "*MEAS_SCAN_AXIS_X" {
+                        axis = value.to_owned();
+                    }
+                    if key == "*MEAS_DATA_COUNT" {
+                        count = Some(
+                            value
+                                .parse::<usize>()
+                                .map_err(|_| invalid("RAS: invalid point count"))?,
+                        );
+                    }
+                }
+            }
+        }
+    }
+    if active {
+        return Err(invalid("RAS: file ends before *RAS_INT_END"));
+    }
+    Err(invalid(format!(
+        "RAS: scan {scan} is out of range ({index} scans)"
+    )))
+}
+
+pub(crate) fn parse_uxd(bytes: &[u8], scan: usize) -> Result<ParsedPattern, Error> {
+    let text = decode(bytes)?;
+    let mut header = HashMap::<String, String>::new();
+    let mut opened = HashMap::new();
+    let mut marker: Option<&str> = None;
+    let mut index = 0;
+    let mut x = Vec::new();
+    let mut y = Vec::new();
+    for line in text
+        .lines()
+        .map(str::trim)
+        .filter(|l| !l.is_empty() && !l.starts_with(';'))
+    {
+        if matches!(line, "_COUNTS" | "_CPS" | "_2THETACOUNTS" | "_2THETACPS") {
+            if marker.is_some() {
+                if index == scan {
+                    break;
+                }
+                index += 1;
+            }
+            marker = Some(line);
+            if index == scan {
+                opened = header.clone();
+            }
+        } else if let Some((key, value)) = line.strip_prefix('_').and_then(|s| s.split_once('=')) {
+            header.insert(
+                key.trim().to_ascii_uppercase(),
+                value.trim().trim_matches(['\'', '"']).to_owned(),
+            );
+        } else if line.starts_with('_') {
+            return Err(invalid(format!("UXD: unsupported block marker {line:?}")));
+        } else {
+            let marker = marker.ok_or_else(|| invalid("UXD: data precedes a counts block"))?;
+            if index == scan {
+                if marker.starts_with("_2THETA") {
+                    let (a, b) = xy_row(line, "UXD")?;
+                    x.push(a);
+                    y.push(b);
+                } else {
+                    y.extend(fields(line).map(number).collect::<Result<Vec<_>, _>>()?);
+                }
+            }
+        }
+    }
+    if marker.is_none() || index != scan {
+        return Err(invalid(format!("UXD: scan {scan} is out of range")));
+    }
+    check_axis(opened.get("DRIVE").map(String::as_str).unwrap_or(""), "UXD")?;
+    if x.is_empty() && !y.is_empty() {
+        let start = number(
+            opened
+                .get("START")
+                .ok_or_else(|| invalid("UXD: missing _START for counts-only data"))?,
+        )?;
+        let step = number(
+            opened
+                .get("STEPSIZE")
+                .ok_or_else(|| invalid("UXD: missing _STEPSIZE for counts-only data"))?,
+        )?;
+        if step == 0.0 {
+            return Err(invalid("UXD: _STEPSIZE must be nonzero"));
+        }
+        x = (0..y.len()).map(|i| start + i as f64 * step).collect();
+    }
+    pattern(x, y, "UXD")
+}
+
+pub(crate) fn parse_chi(bytes: &[u8]) -> Result<ParsedPattern, Error> {
+    let text = decode(bytes)?;
+    let mut lines = text.lines();
+    lines
+        .next()
+        .ok_or_else(|| invalid("CHI: missing four-line header"))?;
+    let label = lines
+        .next()
+        .ok_or_else(|| invalid("CHI: missing x axis label"))?
+        .to_lowercase();
+    let key = axis_key(&label);
+    let is_angle =
+        key.contains("2theta") || key.contains("2th") || key.contains("tth") || key.contains('θ');
+    let words: Vec<&str> = label
+        .split(|c: char| !c.is_alphanumeric())
+        .filter(|s| !s.is_empty())
+        .collect();
+    let is_other = words
+        .iter()
+        .any(|w| matches!(*w, "q" | "d" | "radial" | "pixel" | "channel"))
+        || key.starts_with("qnm")
+        || key.starts_with("qa")
+        || key.contains("dspacing");
+    if (!is_angle && is_other) || label.contains("radian") || label.contains("(rad)") {
+        return Err(invalid(format!(
+            "CHI: x axis {label:?} is not 2theta in degrees"
+        )));
+    }
+    lines
+        .next()
+        .ok_or_else(|| invalid("CHI: missing intensity label"))?;
+    let count_line = lines
+        .next()
+        .ok_or_else(|| invalid("CHI: missing point count"))?;
+    let mut counts = count_line.split_whitespace();
+    let count = counts
+        .next()
+        .and_then(|s| s.parse::<usize>().ok())
+        .ok_or_else(|| invalid("CHI: invalid point count"))?;
+    if let Some(datasets) = counts.next() {
+        if datasets != "1" {
+            return Err(invalid("CHI: only one dataset per profile is supported"));
+        }
+    }
+    if counts.next().is_some() {
+        return Err(invalid("CHI: invalid point-count header"));
+    }
+    let mut x = Vec::new();
+    let mut y = Vec::new();
+    for line in lines.filter(|l| !l.trim().is_empty()) {
+        let (a, b) = xy_row(line, "CHI")?;
+        x.push(a);
+        y.push(b);
+    }
+    if x.len() != count {
+        return Err(invalid(format!(
+            "CHI: header declares {count} points but {} were read",
+            x.len()
+        )));
+    }
+    pattern(x, y, "CHI")
+}
+
+#[derive(Debug)]
+struct CifToken {
+    value: String,
+    quoted: bool,
+}
+
+impl CifToken {
+    fn control(&self) -> bool {
+        if self.quoted {
+            return false;
+        }
+        let s = self.value.to_ascii_lowercase();
+        s.starts_with('_')
+            || s.starts_with("data_")
+            || s.starts_with("save_")
+            || matches!(s.as_str(), "loop_" | "stop_" | "global_")
+    }
+}
+
+fn cif_tokens(text: &str) -> Result<Vec<CifToken>, Error> {
+    let bytes = text.as_bytes();
+    let mut tokens = Vec::new();
+    let mut i = 0;
+    while i < bytes.len() {
+        if bytes[i].is_ascii_whitespace() {
+            i += 1;
+            continue;
+        }
+        if bytes[i] == b'#' {
+            while i < bytes.len() && bytes[i] != b'\n' {
+                i += 1;
+            }
+            continue;
+        }
+        if bytes[i] == b';' && (i == 0 || bytes[i - 1] == b'\n') {
+            let start = i + 1;
+            i = start;
+            while i < bytes.len() && !(bytes[i] == b';' && bytes[i - 1] == b'\n') {
+                i += 1;
+            }
+            if i == bytes.len() {
+                return Err(invalid("pdCIF: unterminated semicolon text field"));
+            }
+            tokens.push(CifToken {
+                value: text[start..i].to_owned(),
+                quoted: true,
+            });
+            i += 1;
+        } else if matches!(bytes[i], b'\'' | b'"') {
+            let quote = bytes[i];
+            i += 1;
+            let start = i;
+            while i < bytes.len()
+                && !(bytes[i] == quote
+                    && (i + 1 == bytes.len() || bytes[i + 1].is_ascii_whitespace()))
+            {
+                if bytes[i] == b'\n' {
+                    return Err(invalid("pdCIF: unterminated quoted value"));
+                }
+                i += 1;
+            }
+            if i == bytes.len() {
+                return Err(invalid("pdCIF: unterminated quoted value"));
+            }
+            tokens.push(CifToken {
+                value: text[start..i].to_owned(),
+                quoted: true,
+            });
+            i += 1;
+        } else {
+            let start = i;
+            while i < bytes.len() && !bytes[i].is_ascii_whitespace() {
+                i += 1;
+            }
+            tokens.push(CifToken {
+                value: text[start..i].to_owned(),
+                quoted: false,
+            });
+        }
+    }
+    Ok(tokens)
+}
+
+fn cif_number(token: &str) -> Result<f64, Error> {
+    if let Some(start) = token.find('(') {
+        let end = token[start + 1..]
+            .find(')')
+            .map(|i| start + 1 + i)
+            .ok_or_else(|| invalid("pdCIF: malformed numeric uncertainty"))?;
+        if !token[start + 1..end].bytes().all(|c| c.is_ascii_digit()) || end == start + 1 {
+            return Err(invalid("pdCIF: malformed numeric uncertainty"));
+        }
+        let plain = format!("{}{}", &token[..start], &token[end + 1..]);
+        number(&plain)
+    } else {
+        number(token)
+    }
+}
+
+#[derive(Default)]
+struct CifBlock {
+    name: String,
+    columns: HashMap<String, Vec<String>>,
+    scalars: HashMap<String, String>,
+}
+
+fn cif_column(block: &CifBlock, alternatives: &[&str]) -> Option<Vec<String>> {
+    alternatives
+        .iter()
+        .find_map(|tag| block.columns.get(*tag).filter(|c| !c.is_empty()).cloned())
+}
+
+fn cif_2theta_axis(block: &CifBlock, point_count: usize) -> Result<Option<Vec<f64>>, Error> {
+    // Corrected angles take precedence, whether explicit or evenly spaced.
+    // Range increments are scalar spacing metadata, never angle columns.
+    for (column, prefix) in [
+        ("_pd_proc_2theta_corrected", "_pd_proc_2theta_range"),
+        ("_pd_meas_2theta_scan", "_pd_meas_2theta_range"),
+    ] {
+        if let Some(col) = cif_column(block, &[column]) {
+            return col
+                .iter()
+                .map(|s| cif_number(s))
+                .collect::<Result<Vec<_>, _>>()
+                .map(Some);
+        }
+        if let (Some(start), Some(step)) = (
+            block.scalars.get(&format!("{prefix}_min")),
+            block.scalars.get(&format!("{prefix}_inc")),
+        ) {
+            let start = cif_number(start)?;
+            let step = cif_number(step)?;
+            if step <= 0.0 {
+                return Err(invalid("pdCIF: 2theta increment must be positive"));
+            }
+            let x: Vec<f64> = (0..point_count).map(|j| start + j as f64 * step).collect();
+            if let Some(end) = block.scalars.get(&format!("{prefix}_max")) {
+                let end = cif_number(end)?;
+                if x.last()
+                    .is_some_and(|last| (last - end).abs() > step.abs() * 1e-6 + 1e-8)
+                {
+                    return Err(invalid("pdCIF: angular range disagrees with point count"));
+                }
+            }
+            return Ok(Some(x));
+        }
+    }
+    Ok(None)
+}
+
+pub(crate) fn parse_pdcif(bytes: &[u8], selection: Option<&str>) -> Result<ParsedPattern, Error> {
+    let text = decode(bytes)?;
+    let tokens = cif_tokens(&text)?;
+    let mut blocks = Vec::<CifBlock>::new();
+    let mut i = 0;
+    while i < tokens.len() {
+        let token = &tokens[i];
+        let key = token.value.to_ascii_lowercase();
+        if !token.quoted && key.starts_with("data_") {
+            blocks.push(CifBlock {
+                name: token.value[5..].to_owned(),
+                ..CifBlock::default()
+            });
+            i += 1;
+        } else if !token.quoted && key == "loop_" {
+            let block = blocks
+                .last_mut()
+                .ok_or_else(|| invalid("pdCIF: loop precedes a data block"))?;
+            i += 1;
+            let mut tags = Vec::new();
+            while i < tokens.len() && !tokens[i].quoted && tokens[i].value.starts_with('_') {
+                tags.push(tokens[i].value.to_ascii_lowercase());
+                i += 1;
+            }
+            if tags.is_empty() {
+                return Err(invalid("pdCIF: loop has no column tags"));
+            }
+            let start = i;
+            while i < tokens.len() && !tokens[i].control() {
+                i += 1;
+            }
+            if (i - start) % tags.len() != 0 {
+                return Err(invalid("pdCIF: incomplete loop row"));
+            }
+            for (offset, tag) in tags.iter().enumerate() {
+                let col = (start + offset..i)
+                    .step_by(tags.len())
+                    .map(|j| tokens[j].value.clone())
+                    .collect();
+                if block.columns.insert(tag.clone(), col).is_some() {
+                    return Err(invalid(format!("pdCIF: duplicate loop tag {tag}")));
+                }
+            }
+        } else if !token.quoted && key.starts_with('_') {
+            let block = blocks
+                .last_mut()
+                .ok_or_else(|| invalid("pdCIF: tag precedes a data block"))?;
+            i += 1;
+            if i == tokens.len() || tokens[i].control() {
+                return Err(invalid(format!("pdCIF: missing value for {key}")));
+            }
+            block.scalars.insert(key, tokens[i].value.clone());
+            i += 1;
+        } else if !token.quoted && (key == "stop_" || key.starts_with("save_") || key == "global_")
+        {
+            i += 1;
+        } else {
+            return Err(invalid(format!(
+                "pdCIF: unexpected token {:?}",
+                token.value
+            )));
+        }
+    }
+    for block in blocks {
+        if selection.is_some_and(|s| !block.name.contains(s)) {
+            continue;
+        }
+        let Some(y) = cif_column(
+            &block,
+            &[
+                "_pd_proc_intensity_total",
+                "_pd_meas_intensity_total",
+                "_pd_meas_counts_total",
+            ],
+        ) else {
+            continue;
+        };
+        let y: Vec<f64> = y.iter().map(|s| cif_number(s)).collect::<Result<_, _>>()?;
+        let Some(x) = cif_2theta_axis(&block, y.len())? else {
+            continue;
+        };
+        if x.len() != y.len() {
+            return Err(invalid(
+                "pdCIF: 2theta and intensity columns have different lengths",
+            ));
+        }
+        return pattern(x, y, "pdCIF");
+    }
+    Err(invalid(
+        "pdCIF: no matching block with 2theta and intensity data",
+    ))
+}
diff --git a/src/xml.rs b/src/xml.rs
new file mode 100644
index 0000000..17a6051
--- /dev/null
+++ b/src/xml.rs
@@ -0,0 +1,439 @@
+//! XML and ZIP pattern containers. Only the selected profile is interpreted.
+use crate::parser::{decode, ParsedPattern};
+use crate::Error;
+use quick_xml::events::{BytesStart, Event};
+use quick_xml::{Reader, XmlVersion};
+use std::io::{Cursor, Read, Seek};
+use zip::ZipArchive;
+
+const MAX_MEMBER_BYTES: u64 = 256 * 1024 * 1024;
+
+#[derive(Default, Debug)]
+struct Element {
+    name: String,
+    attrs: Vec<(String, String)>,
+    text: String,
+    children: Vec<Element>,
+}
+
+impl Element {
+    fn attr(&self, key: &str) -> Option<&str> {
+        self.attrs
+            .iter()
+            .find(|(k, _)| k == key)
+            .map(|(_, v)| v.as_str())
+    }
+    fn child(&self, name: &str) -> Option<&Self> {
+        self.children.iter().find(|c| c.name == name)
+    }
+    fn descendants<'a>(&'a self, name: &str, out: &mut Vec<&'a Self>) {
+        if self.name == name {
+            out.push(self);
+        }
+        for child in &self.children {
+            child.descendants(name, out);
+        }
+    }
+    fn all(&self, name: &str) -> Vec<&Self> {
+        let mut out = Vec::new();
+        self.descendants(name, &mut out);
+        out
+    }
+}
+
+fn error(msg: impl Into<String>) -> Error {
+    Error::Parse(msg.into())
+}
+
+fn unescape(value: &str) -> Result<String, Error> {
+    quick_xml::escape::unescape(value)
+        .map(|v| v.into_owned())
+        .map_err(|e| error(format!("XML entity: {e}")))
+}
+
+fn element(start: &BytesStart<'_>) -> Result<Element, Error> {
+    let mut node = Element {
+        name: String::from_utf8_lossy(start.local_name().as_ref()).into_owned(),
+        ..Element::default()
+    };
+    for attr in start.attributes() {
+        let attr = attr.map_err(|e| error(format!("XML attribute: {e}")))?;
+        let key = String::from_utf8_lossy(attr.key.as_ref())
+            .rsplit(':')
+            .next()
+            .unwrap_or("")
+            .to_owned();
+        let value = attr
+            .normalized_value(XmlVersion::Implicit1_0)
+            .map_err(|e| error(format!("XML attribute: {e}")))?;
+        node.attrs.push((key, value.into_owned()));
+    }
+    Ok(node)
+}
+
+fn document(bytes: &[u8]) -> Result<Element, Error> {
+    let text = decode(bytes)?;
+    let mut reader = Reader::from_str(&text);
+    let mut stack = vec![Element::default()];
+    loop {
+        match reader
+            .read_event()
+            .map_err(|e| error(format!("XML parse: {e}")))?
+        {
+            Event::Start(start) => {
+                if stack.len() > 128 {
+                    return Err(error("XML nesting exceeds 128 elements"));
+                }
+                stack.push(element(&start)?);
+            }
+            Event::Empty(start) => stack.last_mut().unwrap().children.push(element(&start)?),
+            Event::Text(text) => {
+                let text = text.decode().map_err(|e| error(format!("XML text: {e}")))?;
+                stack.last_mut().unwrap().text.push_str(&text);
+            }
+            Event::CData(text) => {
+                let text = text
+                    .decode()
+                    .map_err(|e| error(format!("XML CDATA: {e}")))?;
+                stack.last_mut().unwrap().text.push_str(&text);
+            }
+            Event::GeneralRef(reference) => {
+                let entity = format!("&{};", String::from_utf8_lossy(reference.as_ref()));
+                stack.last_mut().unwrap().text.push_str(&unescape(&entity)?);
+            }
+            Event::End(_) => {
+                if stack.len() == 1 {
+                    return Err(error("unexpected XML closing element"));
+                }
+                let node = stack.pop().unwrap();
+                stack.last_mut().unwrap().children.push(node);
+            }
+            Event::DocType(_) => {
+                return Err(error("XML document type declarations are not supported"))
+            }
+            Event::Eof => break,
+            _ => {}
+        }
+    }
+    if stack.len() != 1 {
+        return Err(error("truncated XML document"));
+    }
+    let mut wrapper = stack.pop().unwrap();
+    if wrapper.children.len() != 1 || !wrapper.text.trim().is_empty() {
+        return Err(error("XML must contain exactly one root element"));
+    }
+    Ok(wrapper.children.remove(0))
+}
+
+fn numbers(text: &str) -> Result<Vec<f64>, Error> {
+    text.split_whitespace().map(number).collect()
+}
+fn number(value: &str) -> Result<f64, Error> {
+    let v = value
+        .trim()
+        .parse::<f64>()
+        .map_err(|_| error(format!("invalid numeric value {value:?}")))?;
+    if !v.is_finite() {
+        return Err(error("non-finite numeric value"));
+    }
+    Ok(v)
+}
+fn index(value: Option<&str>) -> Result<usize, Error> {
+    value
+        .ok_or_else(|| error("missing column Start/Length"))?
+        .parse()
+        .map_err(|_| error("invalid column Start/Length"))
+}
+fn select<T>(values: &[T], scan: usize) -> Result<&T, Error> {
+    values.get(scan).ok_or_else(|| {
+        error(format!(
+            "scan {scan} is out of range ({} scans)",
+            values.len()
+        ))
+    })
+}
+fn axis_key(axis: &str) -> String {
+    axis.to_lowercase().replace([' ', '-', '_'], "")
+}
+fn check_rigaku_axis(axis: &str) -> Result<(), Error> {
+    if !matches!(
+        axis_key(axis).as_str(),
+        "twotheta"
+            | "twothetatheta"
+            | "twothetaomega"
+            | "2theta"
+            | "2thetaw"
+            | "2thetatheta"
+            | "2thetaomega"
+    ) {
+        return Err(error(format!(
+            "scan axis {axis:?} is not a supported 2theta scan"
+        )));
+    }
+    Ok(())
+}
+
+pub(crate) fn parse_xrdml(bytes: &[u8], scan: usize) -> Result<ParsedPattern, Error> {
+    let root = document(bytes)?;
+    if root.name != "xrdMeasurements" {
+        return Err(error("not an XRDML measurement"));
+    }
+    let scans: Vec<_> = root
+        .children
+        .iter()
+        .filter(|m| m.name == "xrdMeasurement")
+        .flat_map(|m| m.children.iter().filter(|s| s.name == "scan"))
+        .collect();
+    let scan = select(&scans, scan)?;
+    if let Some(axis) = scan.attr("scanAxis") {
+        if !matches!(
+            axis_key(axis).as_str(),
+            "gonio"
+                | "2theta"
+                | "2thetaomega"
+                | "omega2theta"
+                | "omegatwotheta"
+                | "twotheta"
+                | "omegatheta"
+                | "2thetatheta"
+        ) {
+            return Err(error(format!("XRDML scan axis {axis:?} is not 2theta")));
+        }
+    }
+    let points = scan
+        .child("dataPoints")
+        .ok_or_else(|| error("XRDML scan has no dataPoints"))?;
+    let intensity = points
+        .child("intensities")
+        .or_else(|| points.child("counts"))
+        .ok_or_else(|| error("XRDML missing intensities/counts"))?;
+    let mut y = numbers(&intensity.text)?;
+    if y.is_empty() {
+        return Err(error("XRDML has no intensity points"));
+    }
+    let positions = points
+        .children
+        .iter()
+        .find(|p| p.name == "positions" && p.attr("axis") == Some("2Theta"))
+        .ok_or_else(|| error("XRDML missing 2Theta positions"))?;
+    if let Some(unit) = positions.attr("unit") {
+        if !matches!(
+            unit.to_lowercase().as_str(),
+            "deg" | "degree" | "degrees" | "°"
+        ) {
+            return Err(error(format!("XRDML 2Theta unit {unit:?} is not degrees")));
+        }
+    }
+    let x = if let Some(list) = positions.child("listPositions") {
+        let x = numbers(&list.text)?;
+        if x.len() != y.len() {
+            return Err(error("XRDML position/intensity lengths differ"));
+        }
+        x
+    } else if let (Some(start), Some(end)) = (
+        positions.child("startPosition"),
+        positions.child("endPosition"),
+    ) {
+        let start = number(&start.text)?;
+        let end = number(&end.text)?;
+        if y.len() == 1 {
+            vec![start]
+        } else {
+            (0..y.len())
+                .map(|i| start + (end - start) * i as f64 / (y.len() - 1) as f64)
+                .collect()
+        }
+    } else if y.len() == 1 {
+        vec![number(
+            &positions
+                .child("commonPosition")
+                .ok_or_else(|| error("XRDML missing stepped 2Theta positions"))?
+                .text,
+        )?]
+    } else {
+        return Err(error(
+            "XRDML has a fixed or missing 2Theta axis, not a powder profile",
+        ));
+    };
+    if let Some(factors) = points.child("beamAttenuationFactors") {
+        let factors = numbers(&factors.text)?;
+        if factors.len() != y.len() || factors.iter().any(|v| *v <= 0.) {
+            return Err(error(
+                "XRDML attenuation factors must be positive and match intensity length",
+            ));
+        }
+        // <counts> stores detector counts; <intensities> is already corrected.
+        if intensity.name == "counts" {
+            for (y, factor) in y.iter_mut().zip(factors) {
+                *y *= factor;
+            }
+        }
+    }
+    Ok(ParsedPattern { x, y })
+}
+
+fn member<R: Read + Seek>(archive: &mut ZipArchive<R>, name: &str) -> Result<Vec<u8>, Error> {
+    let file = archive.by_name(name).map_err(|e| match e {
+        zip::result::ZipError::FileNotFound => Error::FileNotFoundInArchive(name.to_owned()),
+        other => Error::Zip(other),
+    })?;
+    let mut bytes = Vec::new();
+    file.take(MAX_MEMBER_BYTES + 1).read_to_end(&mut bytes)?;
+    if bytes.len() as u64 > MAX_MEMBER_BYTES {
+        return Err(error("archive pattern member exceeds 256 MiB"));
+    }
+    Ok(bytes)
+}
+
+pub(crate) fn parse_rasx(bytes: &[u8], scan: usize) -> Result<ParsedPattern, Error> {
+    let mut archive = ZipArchive::new(Cursor::new(bytes))?;
+    let root = document(&member(&mut archive, "root.xml")?)?;
+    let mut groups = Vec::new();
+    for group in &root.children {
+        if !group
+            .name
+            .strip_prefix("Data")
+            .is_some_and(|v| !v.is_empty() && v.bytes().all(|b| b.is_ascii_digit()))
+        {
+            continue;
+        }
+        let names: Vec<_> = group
+            .children
+            .iter()
+            .filter(|e| e.name == "ContentHashList")
+            .filter_map(|e| e.attr("Name"))
+            .collect();
+        if let Some(profile) = names.iter().find(|n| n.to_lowercase().ends_with(".txt")) {
+            let conditions = names.iter().find(|n| {
+                n.to_lowercase().contains("conditions") && n.to_lowercase().ends_with(".xml")
+            });
+            groups.push((
+                format!("{}/{}", group.name, profile),
+                conditions.map(|n| format!("{}/{n}", group.name)),
+            ));
+        }
+    }
+    let (profile, conditions) = select(&groups, scan)?;
+    if let Some(conditions) = conditions {
+        let root = document(&member(&mut archive, conditions)?)?;
+        let scans = root.all("ScanInformation");
+        let axes = scans.first().copied().unwrap_or(&root).all("AxisName");
+        if let Some(axis) = axes.first() {
+            check_rigaku_axis(axis.text.trim())?;
+        }
+    }
+    let raw = member(&mut archive, profile)?;
+    let text = decode(&raw)?;
+    let mut x = Vec::new();
+    let mut y = Vec::new();
+    for line in text.lines().filter(|l| !l.trim().is_empty()) {
+        let mut fields = line.split_whitespace();
+        x.push(number(
+            fields.next().ok_or_else(|| error("RASX missing 2theta"))?,
+        )?);
+        y.push(number(
+            fields
+                .next()
+                .ok_or_else(|| error("RASX missing intensity"))?,
+        )?);
+    }
+    Ok(ParsedPattern { x, y })
+}
+
+pub(crate) fn parse_brml(bytes: &[u8], scan: usize) -> Result<ParsedPattern, Error> {
+    let mut archive = ZipArchive::new(Cursor::new(bytes))?;
+    let manifest = archive
+        .file_names()
+        .find(|n| n.ends_with("DataContainer.xml"))
+        .map(str::to_owned)
+        .ok_or_else(|| error("BRML missing DataContainer.xml"))?;
+    let root = document(&member(&mut archive, &manifest)?)?;
+    let members: Vec<String> = root
+        .all("RawDataReferenceList")
+        .iter()
+        .flat_map(|e| &e.children)
+        .map(|e| e.text.trim().to_owned())
+        .filter(|s| !s.is_empty())
+        .collect();
+    let raw = document(&member(&mut archive, select(&members, scan)?)?)?;
+    let routes = raw.all("DataRoute");
+    let measured: Vec<_> = routes
+        .iter()
+        .copied()
+        .filter(|r| r.attr("RouteFlag") == Some("Measured"))
+        .collect();
+    let route = if measured.len() == 1 {
+        measured[0]
+    } else if routes.len() == 1 {
+        routes[0]
+    } else {
+        return Err(error("BRML requires one unambiguous measured data route"));
+    };
+    let mut x_column = None;
+    let mut y_column = None;
+    for view in route.all("RawDataView") {
+        let start = index(view.attr("Start"))?;
+        let length = index(view.attr("Length"))?;
+        match view
+            .attr("type")
+            .unwrap_or("")
+            .rsplit(':')
+            .next()
+            .unwrap_or("")
+        {
+            "VaryingRawDataView" => {
+                let fields = view.all("FieldDefinitions");
+                if fields.len() > length {
+                    return Err(error("BRML fields exceed declared view length"));
+                }
+                for (offset, field) in fields.iter().enumerate() {
+                    let axis = field
+                        .attr("AxisId")
+                        .filter(|a| !a.trim().is_empty())
+                        .or_else(|| field.attr("FieldName"))
+                        .unwrap_or("")
+                        .trim();
+                    if axis.eq_ignore_ascii_case("TwoTheta") && x_column.is_none() {
+                        x_column = Some(
+                            start
+                                .checked_add(offset)
+                                .ok_or_else(|| error("BRML column overflow"))?,
+                        );
+                    }
+                }
+            }
+            "RecordedRawDataView" => {
+                if length != 1 {
+                    return Err(error(
+                        "BRML detector frames are not integrated XRD profiles",
+                    ));
+                }
+                if y_column.is_none() {
+                    y_column = Some(start);
+                }
+            }
+            _ => {}
+        }
+    }
+    let xi = x_column.ok_or_else(|| error("BRML has no varying TwoTheta column"))?;
+    let yi = y_column.ok_or_else(|| error("BRML has no recorded intensity column"))?;
+    let rows = route.all("Datum");
+    let mut x = Vec::with_capacity(rows.len());
+    let mut y = Vec::with_capacity(rows.len());
+    for row in rows {
+        let mut px = None;
+        let mut py = None;
+        for (i, value) in row.text.split(',').enumerate() {
+            if i == xi {
+                px = Some(number(value)?);
+            }
+            if i == yi {
+                py = Some(number(value)?);
+            }
+        }
+        x.push(px.ok_or_else(|| error("BRML datum missing TwoTheta column"))?);
+        y.push(py.ok_or_else(|| error("BRML datum missing intensity column"))?);
+    }
+    // Bruker has already applied its absorption factor to the stored intensity.
+    Ok(ParsedPattern { x, y })
+}
diff --git a/tests/README.md b/tests/README.md
index 8f225dc..d26b788 100644
--- a/tests/README.md
+++ b/tests/README.md
@@ -1,37 +1,139 @@
-# Test Run Guide
+# Tests and fixture references
 
-Run commands from the repository root (`geddes/`).
+Run these commands from the Geddes repository root.
 
-## Rust tests
+## Rust
 
-Run the Rust loader test suite:
-
-```bash
-cargo test --test test_rust -- --nocapture
+```sh
+cargo test
 ```
 
-Run a single Rust test:
+The suite checks the x/y-only API, text formats, Bruker binary layouts, XML/ZIP
+profiles, selection and malformed inputs. Targeted text or binary regressions
+can be run with:
 
-```bash
-cargo test --test test_rust test_14_bruker_raw_diffrac_eva_loads_with_axis -- --nocapture
+```sh
+cargo test --test text_formats
+cargo test --test bruker_formats
 ```
 
-## Python tests
+The [shared fixture manifest](data/formats/manifest.json) identifies source
+files, expected point counts, scan/block selections, tolerances and full-array
+CSV references. These references test every x and y value rather than only
+successful loading or array lengths. The [provenance record](data/formats/README.md)
+describes experimental files and their licenses; synthetic fixtures specify
+their intended arrays directly.
+
+## Python
 
-Install the Python extension module and test dependency:
+Build the local extension and run its tests:
 
-```bash
+```sh
 python -m pip install -e ".[test]"
+python -m pytest tests/test_python.py -q
 ```
 
-Run the Python test file:
+Python tests cover path and byte loading, the two-argument
+`geddes.Pattern(x, y)` constructor, selections, errors, and the absence of `e`.
+Rebuild the extension after changing Rust source before testing Python.
 
-```bash
-python -m pytest tests/test_python.py -q
+## Node.js
+
+Build the bindings from the local Rust source:
+
+```sh
+npm --prefix node install
+npm --prefix node run build
+node node/test.cjs
+```
+
+The Node test loads every manifest case through both path and byte APIs. To use
+a separately built native binding, set its absolute path:
+
+```sh
+GEDDES_BINDING=/absolute/path/to/geddes.node node node/test.cjs
+```
+
+The Node API returns `{ x, y }`. Both `read` and `readBytes` accept an optional
+`{ index, block }` selection object; examples are in the
+[usage guide](../docs/reading-patterns.md#pattern-selection).
+
+## Release packages
+
+The [package checks](../.github/workflows/check-packages.yml) run on pushes and
+pull requests to `main` and `dev`, and before release tagging.
+
+| Package | Installation checks |
+|---|---|
+| Rust | Package, compile, and test the unpacked crate on Linux, macOS, and Windows |
+| Python | Install wheels on all three systems with Python 3.10–3.14; also build and install the source distribution |
+| Node.js | Install npm tarballs on all six supported OS/architecture targets with Node 16 and 24; Windows ARM64 uses Node 20 and 24 |
+
+Python and Node checks use fresh environments outside the checkout and run the
+complete fixture suite. Node installations use the packaged JavaScript loader
+and platform dependency, with registry access disabled. Release checks also
+verify package versions, selection and error behavior, and distribution metadata.
+Publishing waits for these checks; PyPI and npm receive the tested archives.
+
+To check a locally built Python distribution:
+
+```sh
+python tests/check_python_package.py --dist-dir /path/to/dist --kind wheel
+python tests/check_python_package.py --dist-dir /path/to/dist --kind sdist
+```
+
+To check the Node tarballs downloaded from a `node-packages` workflow artifact:
+
+```sh
+npm --prefix node run check:package -- /path/to/node-packages
 ```
 
-Run a single Python test:
+## Rebuilding reference data
+
+[build_fixture_corpus.py](build_fixture_corpus.py) is a development tool, not a
+runtime dependency. Install NumPy and gemmi in a development environment, then
+rebuild the committed CSV references and manifest:
 
-```bash
-python -m pytest tests/test_python.py -k test_04_read_xrdml -q
+```sh
+python -m pip install numpy gemmi
+python tests/build_fixture_corpus.py
 ```
+
+It uses literal expected arrays for synthetic cases and independent,
+fixture-specific extraction for real files: NumPy text loading, Python XML/ZIP
+and `struct`, and gemmi's CIF grammar. It imports neither Geddes nor Rietx. These
+extractors document the selected fixture layouts; they are not general-purpose
+replacement readers. Inspect changes to the expected arrays when regenerating
+them, since changing a reference can hide a reader regression.
+
+To refresh vendored experimental inputs, use a Rietx checkout at commit
+`88d2353f446d98632ef233437000cbe7bc4e1142`:
+
+```sh
+python tests/build_fixture_corpus.py --rietx-source /path/to/rietx
+```
+
+The command copies the listed input files and regenerates references; it does
+not fetch or verify the checkout's Git revision. Preserve the provenance and
+license files when updating the corpus.
+
+## Benchmarking
+
+Use the separate `geddes-test` repository, which
+consumes this manifest. Build Geddes in release mode for timed comparisons.
+The benchmark validates full arrays before measuring file loading and reports
+unsupported or numerically different results separately. It does not discard
+rows, interpolate, or change the selected scan to force agreement.
+
+Keep these semantics in mind when interpreting comparisons:
+
+- Geddes preserves x/y rows whose uncertainty or weight is zero. Rietx may
+  filter such rows; a different array length is a semantic mismatch.
+- XRDML raw `<counts>` receive supplied attenuation factors; processed
+  `<intensities>` and BRML intensities are preserved. No counts-per-second
+  normalization occurs.
+- Descending profiles are reversed as paired arrays. Duplicate x values are
+  rejected, not deduplicated.
+- Small synthetic files often measure API overhead. Large experimental files
+  exercise parsing and decompression. Scrambled RAW4 intensities can verify
+  byte decoding but cannot validate a physical measurement.
diff --git a/tests/bruker_formats.rs b/tests/bruker_formats.rs
new file mode 100644
index 0000000..bb993f5
--- /dev/null
+++ b/tests/bruker_formats.rs
@@ -0,0 +1,227 @@
+use geddes::{read_bytes, read_bytes_with_options, ReadOptions};
+
+fn put_u32(buf: &mut [u8], at: usize, value: u32) {
+    buf[at..at + 4].copy_from_slice(&value.to_le_bytes());
+}
+
+fn put_f64(buf: &mut [u8], at: usize, value: f64) {
+    buf[at..at + 8].copy_from_slice(&value.to_le_bytes());
+}
+
+// Literal field offsets are deliberately independent of the reader. Each
+// record contains an intensity and non-intensity payload to test its stride.
+fn raw4_scan(start: f64, step: f64, y: &[f32], stride: usize, drive: &str) -> Vec<u8> {
+    let mut out = vec![0; 160 + 92];
+    out[32..46].copy_from_slice(b"Locked Coupled");
+    put_f64(&mut out, 72, start);
+    put_f64(&mut out, 80, step);
+    put_u32(&mut out, 88, y.len() as u32);
+    put_u32(&mut out, 136, stride as u32);
+    put_u32(&mut out, 140, 92);
+    put_u32(&mut out, 160, 50);
+    put_u32(&mut out, 164, 92);
+    put_u32(&mut out, 168, 2);
+    out[172..172 + drive.len()].copy_from_slice(drive.as_bytes());
+    put_f64(&mut out, 216, start);
+    for value in y {
+        out.extend_from_slice(&value.to_le_bytes());
+        out.extend(vec![0x7f; stride - 4]);
+    }
+    out
+}
+
+fn raw4(scans: &[Vec<u8>]) -> Vec<u8> {
+    let mut out = vec![0; 61];
+    out[..8].copy_from_slice(b"RAW4.00\0");
+    for scan in scans {
+        out.extend_from_slice(scan);
+    }
+    out
+}
+
+fn raw3_scan(start: f64, step: f64, y: &[f32], measured: Option<&[f64]>) -> Vec<u8> {
+    // 304-byte header + one 40-byte optional record; two varying parameters
+    // exercise both the measured 2theta column and an additional ignored one.
+    let mut out = vec![0; 344];
+    put_u32(&mut out, 0, 304);
+    put_u32(&mut out, 4, y.len() as u32);
+    put_f64(&mut out, 16, start);
+    put_f64(&mut out, 176, step);
+    put_u32(&mut out, 248, if measured.is_some() { 3 } else { 0 });
+    put_u32(&mut out, 252, if measured.is_some() { 20 } else { 4 });
+    put_u32(&mut out, 256, 40);
+    put_u32(&mut out, 304, 10);
+    put_u32(&mut out, 308, 40);
+    for (i, value) in y.iter().enumerate() {
+        out.extend_from_slice(&value.to_le_bytes());
+        if let Some(x) = measured {
+            out.extend_from_slice(&x[i].to_le_bytes());
+            out.extend_from_slice(&(x[i] / 2.).to_le_bytes());
+        }
+    }
+    out
+}
+
+fn raw3(scans: &[Vec<u8>]) -> Vec<u8> {
+    let mut out = vec![0; 712];
+    out[..8].copy_from_slice(b"RAW1.01\0");
+    put_u32(&mut out, 12, scans.len() as u32);
+    for scan in scans {
+        out.extend_from_slice(scan);
+    }
+    out
+}
+
+#[test]
+fn bundled_binary_patterns_match_the_complete_known_pattern() {
+    let expected = read_bytes(
+        include_bytes!("data/formats/bruker/expected.xy"),
+        "expected.xy",
+    )
+    .unwrap();
+    for fixture in [
+        include_bytes!("data/formats/bruker/synthetic_raw3.raw").as_slice(),
+        include_bytes!("data/formats/bruker/synthetic_raw4_4byte.raw").as_slice(),
+        include_bytes!("data/formats/bruker/synthetic_raw4_8byte.raw").as_slice(),
+    ] {
+        let result = read_bytes(fixture, "pattern.raw").unwrap();
+        assert_eq!(result.y, expected.y);
+        assert_eq!(result.x.len(), expected.x.len());
+        for (&actual, &expected) in result.x.iter().zip(&expected.x) {
+            assert!((actual - expected).abs() < 1e-12);
+        }
+    }
+}
+
+#[test]
+fn raw4_reads_declared_strides_and_selects_scans() {
+    let mut second = raw4_scan(30., 0.5, &[123., 2.5, -7.], 12, "2Theta");
+    put_u32(&mut second, 0, 160); // alternate range marker
+    let bytes = raw4(&[raw4_scan(10., 1., &[1., 2.], 4, "2Theta"), second]);
+    assert_eq!(read_bytes(&bytes, "test.raw").unwrap().y, [1., 2.]);
+    let p = read_bytes_with_options(
+        &bytes,
+        "test.raw",
+        &ReadOptions {
+            index: 1,
+            block: None,
+        },
+    )
+    .unwrap();
+    assert_eq!(p.x, [30., 30.5, 31.]);
+    assert_eq!(p.y, [123., 2.5, -7.]);
+    assert!(read_bytes_with_options(
+        &bytes,
+        "test.raw",
+        &ReadOptions {
+            index: 2,
+            block: None
+        }
+    )
+    .is_err());
+}
+
+#[test]
+fn raw3_measured_positions_extra_records_and_multiple_scans() {
+    let bytes = raw3(&[
+        raw3_scan(10., 0.5, &[7., 8.], None),
+        raw3_scan(30., 0.5, &[101., 99., 1.], Some(&[30.01, 30.49, 31.02])),
+    ]);
+    assert_eq!(read_bytes(&bytes, "test.raw").unwrap().x, [10., 10.5]);
+    let p = read_bytes_with_options(
+        &bytes,
+        "test.raw",
+        &ReadOptions {
+            index: 1,
+            block: None,
+        },
+    )
+    .unwrap();
+    assert_eq!(p.x, [30.01, 30.49, 31.02]);
+    assert_eq!(p.y, [101., 99., 1.]);
+    let mut padded = bytes.clone();
+    padded.extend([0; 3280]);
+    assert!(read_bytes(&padded, "test.raw").is_ok());
+    padded.push(1);
+    assert!(read_bytes(&padded, "test.raw").is_err());
+}
+
+#[test]
+fn descending_binary_scans_keep_intensity_paired_with_angle() {
+    let bytes = raw4(&[raw4_scan(30., -0.5, &[2., 8., 11.], 8, "2Theta")]);
+    let p = read_bytes(&bytes, "test.raw").unwrap();
+    assert_eq!(p.x, [29., 29.5, 30.]);
+    assert_eq!(p.y, [11., 8., 2.]);
+}
+
+#[test]
+fn rejects_unsupported_versions_and_non_diffraction_axes() {
+    for bytes in [b"RAW \0\0\0\0".as_slice(), b"RAW2\0\0\0\0".as_slice()] {
+        let error = read_bytes(bytes, "old.raw").unwrap_err().to_string();
+        assert!(error.contains("unsupported"), "{error}");
+    }
+    let mut scan3 = raw3_scan(5., 1., &[1., 2.], None);
+    put_u32(&mut scan3, 196, 3); // rocking curve
+    for bytes in [
+        raw4(&[raw4_scan(5., 1., &[1., 2.], 4, "Theta")]),
+        raw4(&[raw4_scan(5., 1., &[1., 2.], 4, "Unknown")]),
+        raw3(&[scan3]),
+    ] {
+        let error = read_bytes(bytes, "other.raw").unwrap_err().to_string();
+        assert!(error.contains("2theta"), "{error}");
+    }
+}
+
+#[test]
+fn rejects_truncation_false_strides_and_drive_header_overruns() {
+    let good = raw4(&[raw4_scan(10., 1., &[1., 2., 3.], 8, "2Theta")]);
+    for cut in [7, 60, 62, 120, good.len() - 1] {
+        assert!(read_bytes(&good[..cut], "truncated.raw").is_err());
+    }
+    for (offset, value) in [(61 + 136, 3), (61 + 140, 93), (61 + 164, 96), (61 + 164, 0)] {
+        let mut broken = good.clone();
+        put_u32(&mut broken, offset, value);
+        assert!(
+            read_bytes(&broken, "broken.raw").is_err(),
+            "offset={offset}"
+        );
+    }
+    let mut broken3 = raw3(&[raw3_scan(10., 1., &[1., 2.], None)]);
+    put_u32(&mut broken3, 712 + 252, 12); // no varying parameters declared
+    assert!(read_bytes(&broken3, "broken.raw").is_err());
+    let invalid = raw4(&[raw4_scan(10., 1., &[f32::NAN, 2.], 4, "2Theta")]);
+    assert!(read_bytes(&invalid, "nonfinite.raw").is_err());
+}
+
+#[test]
+fn existing_raw4_files_decode_all_stored_intensity_records() {
+    // Exact data offsets are independently verified by walking the real
+    // files' headers; EVA's scrambled intensities establish byte fidelity.
+    for (bytes, offset, points, stride, start, step) in [
+        (
+            include_bytes!("data/bruker_raw/bruker4_v5converter.raw").as_slice(),
+            8117,
+            4059,
+            4,
+            37.0001,
+            0.020454544980000003,
+        ),
+        (
+            include_bytes!("data/bruker_raw/bruker4_diffrac_eva.raw").as_slice(),
+            1311,
+            7134,
+            8,
+            10.,
+            0.010520299896597862,
+        ),
+    ] {
+        let p = read_bytes(bytes, "actual.raw").unwrap();
+        assert_eq!(p.x.len(), points);
+        for i in 0..points {
+            let at = offset + i * stride;
+            let expected_y = f32::from_le_bytes(bytes[at..at + 4].try_into().unwrap()) as f64;
+            assert_eq!(p.y[i], expected_y);
+            assert!((p.x[i] - (start + i as f64 * step)).abs() < 1e-12);
+        }
+    }
+}
diff --git a/tests/build_fixture_corpus.py b/tests/build_fixture_corpus.py
new file mode 100644
index 0000000..b752a66
--- /dev/null
+++ b/tests/build_fixture_corpus.py
@@ -0,0 +1,181 @@
+"""Rebuild committed full-array references without importing Geddes or Rietx.
+
+Development-only: requires numpy and gemmi. The fixture-specific decoders below
+use Python's XML/ZIP/struct facilities and gemmi's CIF grammar. Synthetic cases
+use literal known arrays. Run with --rietx-source PATH to refresh vendored inputs.
+"""
+from pathlib import Path
+import argparse
+import hashlib
+import json
+import shutil
+import struct
+import xml.etree.ElementTree as ET
+import zipfile
+
+import gemmi
+import numpy as np
+
+ROOT = Path(__file__).resolve().parent / "data" / "formats"
+REV = "88d2353f446d98632ef233437000cbe7bc4e1142"
+SOURCE = f"https://github.com/yue-here/rietx/blob/{REV}/tests/data/"
+REAL = ["rigaku_powder.rasx", "rigaku_zno_counts.rasx", "rigaku_nims.ras",
+        "panalytical_attenuator.xrdml", "panalytical_mesh.xrdml", "bruker_absorber.brml",
+        "11BM_NAC.fxye", "11BM_LaB6_660a.fxye", "11BM_Si640c.xy", "FAP.XRA",
+        "nist_srm660c_100a.cif"]
+fixtures = []
+
+
+def digest(path):
+    return hashlib.sha256(path.read_bytes()).hexdigest()
+
+
+def add(name, fmt, path, x, y, *, scan=0, block=None, provenance=None, note=None):
+    x, y = np.asarray(x, dtype=float), np.asarray(y, dtype=float)
+    if len(x) > 1 and np.all(np.diff(x) < 0):
+        x, y = x[::-1], y[::-1]
+    assert x.shape == y.shape and x.ndim == 1 and len(x), name
+    assert np.all(np.isfinite(x)) and np.all(np.isfinite(y)) and np.all(np.diff(x) > 0), name
+    ref = ROOT / "references" / f"{name}.csv"
+    np.savetxt(ref, np.column_stack((x, y)), delimiter=",", fmt="%.17g", header="x,y", comments="")
+    source = ROOT / path
+    fixtures.append(dict(id=name, format=fmt, path=path, reference=f"references/{name}.csv",
+                         scan=scan, block=block, points=len(x), rtol=1e-12, atol=1e-9,
+                         sha256=digest(source), reference_sha256=digest(ref),
+                         provenance=provenance or "Geddes-authored synthetic pattern; MIT",
+                         note=note))
+
+
+def tree(raw):
+    root = ET.fromstring(raw)
+    for node in root.iter():
+        node.tag = node.tag.rsplit("}", 1)[-1]
+    return root
+
+
+def xrdml(path, scan=0):
+    root = tree(path.read_bytes())
+    p = root.findall("xrdMeasurement/scan")[scan].find("dataPoints")
+    intensity = p.find("intensities")
+    raw = intensity is None
+    if raw:
+        intensity = p.find("counts")
+    y = np.array([float(v) for v in intensity.text.split()])
+    pos = next(n for n in p.findall("positions") if n.get("axis") == "2Theta")
+    listed = pos.find("listPositions")
+    x = np.array([float(v) for v in listed.text.split()]) if listed is not None else np.linspace(
+        float(pos.findtext("startPosition")), float(pos.findtext("endPosition")), len(y))
+    attenuation = p.findtext("beamAttenuationFactors")
+    if raw and attenuation:
+        y *= np.array([float(v) for v in attenuation.split()])
+    return x, y
+
+
+def rasx(path):
+    # Every selected real fixture has this declared profile; no reader discovery is used.
+    with zipfile.ZipFile(path) as archive:
+        lines = archive.read("Data0/Profile0.txt").decode("utf-8-sig").splitlines()
+    a = np.array([[float(v) for v in line.split()[:2]] for line in lines if line.strip()])
+    return a[:, 0], a[:, 1]
+
+
+def gsas(path):
+    lines = path.read_text().splitlines()
+    at = next(i for i, line in enumerate(lines) if line.startswith("BANK"))
+    header = lines[at].split()
+    if header[-1] == "FXYE":
+        a = np.array([[float(v) for v in line.split()[:2]] for line in lines[at+1:] if line.strip()])
+        return a[:, 0] / 100, a[:, 1]
+    if header[-1] == "ESD":
+        vals = [float(line[i:i+8]) for line in lines[at+1:] if line.strip()
+                for i in range(0, len(line.rstrip()), 8)]
+        y = np.array(vals[::2][:int(header[2])])
+    else:
+        y = np.array([float(v) for line in lines[at+1:] for v in line.split()][:int(header[2])])
+    return float(header[5])/100 + np.arange(len(y))*float(header[6])/100, y
+
+
+def main():
+    args = argparse.ArgumentParser()
+    args.add_argument("--rietx-source", type=Path)
+    args = args.parse_args()
+    (ROOT / "references").mkdir(exist_ok=True)
+    if args.rietx_source:
+        for name in REAL:
+            shutil.copy2(args.rietx_source / "tests" / "data" / name, ROOT / "real" / name)
+
+    x, y = [10, 10.125, 10.25, 10.375, 10.5], [4, 81, 144, 9, 1]
+    for suffix, fmt in [("xy", "xy"), ("csv", "csv"), ("chi", "chi"), ("fxye", "gsas"),
+                        ("gsas", "gsas"), ("ras", "ras"), ("uxd", "uxd"), ("cif", "pdcif")]:
+        add(f"synthetic_{suffix}", fmt, f"text/profile.{suffix}", x, y)
+    for fmt in ["ras", "uxd", "cif"]:
+        add(f"synthetic_{fmt}_second", "pdcif" if fmt == "cif" else fmt, f"text/profile.{fmt}",
+            [20, 20.25, 20.5], [100, 64, 25], scan=0 if fmt == "cif" else 1,
+            block="_other" if fmt == "cif" else None)
+    add("synthetic_esd", "gsas", "text/profile_esd.gsas", x, y)
+    for name, fmt in [("synthetic_raw3", "bruker_raw3"), ("synthetic_raw4_4byte", "bruker_raw4"),
+                      ("synthetic_raw4_8byte", "bruker_raw4")]:
+        add(name, fmt, f"bruker/{name}.raw", [10, 10.02, 10.04, 10.06, 10.08, 10.10],
+            [12, 34.5, 90, 321.25, 87, 5])
+    for fmt in ["xrdml", "rasx", "brml"]:
+        if (ROOT / "xml" / f"synthetic.{fmt}").exists():
+            add(f"synthetic_{fmt}", fmt, f"xml/synthetic.{fmt}", x, y)
+
+    for name in ["rigaku_powder.rasx", "rigaku_zno_counts.rasx"]:
+        add(Path(name).stem, "rasx", f"real/{name}", *rasx(ROOT / "real" / name), provenance=SOURCE+name)
+    for name in ["panalytical_attenuator.xrdml", "panalytical_mesh.xrdml"]:
+        for scan in ([0, 50, 100] if "mesh" in name else [0]):
+            add(f"{Path(name).stem}_{scan}", "xrdml", f"real/{name}",
+                *xrdml(ROOT / "real" / name, scan), scan=scan, provenance=SOURCE+name)
+    name = "bruker_absorber.brml"
+    with zipfile.ZipFile(ROOT / "real" / name) as archive:
+        root = tree(archive.read("Experiment0/RawData0.xml"))
+    route = next(r for r in root.iter("DataRoute") if r.get("RouteFlag") == "Measured")
+    a = np.array([[float(v) for v in d.text.split(",")] for d in route.iter("Datum")])
+    add("bruker_absorber", "brml", f"real/{name}", a[:, 2], a[:, 7], provenance=SOURCE+name,
+        note="Independent fixture-specific columns: 2Theta=2, intensity=7; stored absorber correction retained.")
+    name = "rigaku_nims.ras"
+    text = (ROOT / "real" / name).read_text()
+    body = text.split("*RAS_INT_START", 1)[1].split("*RAS_INT_END", 1)[0]
+    a = np.array([[float(v) for v in line.split()[:2]] for line in body.splitlines() if line.strip()])
+    add("rigaku_nims", "ras", f"real/{name}", a[:, 0], a[:, 1], provenance=SOURCE+name)
+    for name in ["11BM_NAC.fxye", "11BM_LaB6_660a.fxye", "FAP.XRA"]:
+        add(Path(name).stem, "gsas", f"real/{name}", *gsas(ROOT / "real" / name), provenance=SOURCE+name)
+    name = "11BM_Si640c.xy"
+    a = np.loadtxt(ROOT / "real" / name)
+    add("11BM_Si640c", "xy", f"real/{name}", a[:, 0], a[:, 1], provenance=SOURCE+name)
+    name = "nist_srm660c_100a.cif"
+    doc = gemmi.cif.read(str(ROOT / "real" / name))
+    b = next(b for b in doc if b.name.endswith("_meas"))
+    x = [gemmi.cif.as_number(v) for v in b.find_loop("_pd_proc_2theta_corrected")]
+    y = [gemmi.cif.as_number(v) for v in b.find_loop("_pd_proc_intensity_total")]
+    add("nist_srm660c", "pdcif", f"real/{name}", x, y, block="_meas", provenance=SOURCE+name)
+
+    add("existing_xrdml", "xrdml", "../xrdml/sample.xrdml", *xrdml(ROOT / "../xrdml/sample.xrdml"),
+        provenance="Existing Geddes fixture; same measurement as Rietx panalytical_powder.xrdml")
+    add("existing_rasx", "rasx", "../rasx/sample.rasx", *rasx(ROOT / "../rasx/sample.rasx"),
+        provenance="Existing Geddes fixture")
+    add("existing_gsas", "gsas", "../gsas_raw/gsas.raw", *gsas(ROOT / "../gsas_raw/gsas.raw"),
+        provenance="Existing Geddes fixture")
+    for fmt in ["xy", "csv"]:
+        a = np.loadtxt(ROOT / ".." / fmt / f"sample.{fmt}")
+        add(f"existing_{fmt}", fmt, f"../{fmt}/sample.{fmt}", a[:, 0], a[:, 1], provenance="Existing Geddes fixture")
+    for name, offset, points, stride, start, step in [
+        ("bruker4_v5converter", 8117, 4059, 4, 37.0001, 0.020454544980000003),
+        ("bruker4_diffrac_eva", 1311, 7134, 8, 10, 0.010520299896597862)]:
+        path = f"../bruker_raw/{name}.raw"
+        raw = (ROOT / path).read_bytes()
+        y = [struct.unpack_from("<f", raw, offset+i*stride)[0] for i in range(points)]
+        add(name, "bruker_raw4", path, start+np.arange(points)*step, y,
+            provenance="Existing Geddes fixture; literal offsets independently verified against file layout",
+            note="EVA intensities scrambled: verifies byte decoding, not physical measurement correctness." if "eva" in name else None)
+    payload = dict(schema_version=1, rietx_reference_commit=REV,
+                   reference_method="Known synthetic arrays; fixture-specific independent Python/NumPy/XML/ZIP/struct/gemmi extraction. No Geddes or Rietx reader used.", fixtures=fixtures)
+    (ROOT / "manifest.json").write_text(json.dumps(payload, indent=2)+"\n")
+    print(f"Wrote {len(fixtures)} cases, {sum(f['points'] for f in fixtures):,} checked points")
+    for f in fixtures:
+        print(f["id"], f["points"])
+
+
+if __name__ == "__main__":
+    main()
diff --git a/tests/check_python_package.py b/tests/check_python_package.py
new file mode 100644
index 0000000..3222d33
--- /dev/null
+++ b/tests/check_python_package.py
@@ -0,0 +1,77 @@
+"""Install a built distribution in a fresh environment and run the Python suite.
+
+This checks the release artifact, never an editable checkout. Source archives
+are installed with pip's build isolation and cache disabled, so their compiled
+extension must be built from the archive itself.
+"""
+
+import argparse
+import json
+import os
+from pathlib import Path
+import subprocess
+import tempfile
+import venv
+
+
+def run(command, *, cwd, env):
+    print("+", " ".join(map(str, command)), flush=True)
+    subprocess.run(command, cwd=cwd, env=env, check=True)
+
+
+def main():
+    parser = argparse.ArgumentParser(description=__doc__)
+    parser.add_argument("--dist-dir", type=Path, required=True)
+    parser.add_argument("--kind", choices=("wheel", "sdist"), required=True)
+    args = parser.parse_args()
+    pattern = "*.whl" if args.kind == "wheel" else "*.tar.gz"
+    artifacts = sorted(args.dist_dir.resolve().glob(pattern))
+    if len(artifacts) != 1:
+        parser.error(f"expected exactly one {pattern} in {args.dist_dir}, found {len(artifacts)}")
+    artifact = artifacts[0]
+    repository = Path(__file__).resolve().parents[1]
+
+    env = os.environ.copy()
+    for key in ("PYTHONPATH", "PYTHONHOME", "PYO3_PYTHON", "PYO3_ENVIRONMENT_SIGNATURE"):
+        env.pop(key, None)
+
+    with tempfile.TemporaryDirectory(prefix="geddes-package-check-") as temporary:
+        work = Path(temporary)
+        environment = work / "venv"
+        venv.EnvBuilder(with_pip=True).create(environment)
+        python = environment / ("Scripts/python.exe" if os.name == "nt" else "bin/python")
+        env["VIRTUAL_ENV"] = str(environment)
+        env["PATH"] = str(python.parent) + os.pathsep + env.get("PATH", "")
+        # No wheel cache may satisfy an sdist check without rebuilding it.
+        pip = [
+            str(python), "-I", "-m", "pip", "--isolated",
+            "--disable-pip-version-check", "--cache-dir", str(work / "pip-cache"),
+        ]
+        run(pip + ["install", "--no-input", "--no-cache-dir", str(artifact), "pytest"], cwd=work, env=env)
+        run(pip + ["check"], cwd=work, env=env)
+
+        installed_check = "\n".join([
+            "import importlib.metadata, json, pathlib, sys, geddes",
+            "module = pathlib.Path(geddes.__file__).resolve()",
+            "prefix = pathlib.Path(sys.prefix).resolve()",
+            "assert module.is_relative_to(prefix), (module, prefix)",
+            "assert geddes.__version__ == importlib.metadata.version('geddes')",
+            "print(json.dumps({'python': sys.version, 'module': str(module), 'version': geddes.__version__}, indent=2))",
+        ])
+        run([str(python), "-I", "-c", installed_check], cwd=work, env=env)
+        run([
+            str(python), "-I", "-m", "pytest", "--import-mode=importlib",
+            str(repository / "tests" / "test_python.py"), "-q",
+            "-o", f"cache_dir={work / 'pytest-cache'}",
+        ], cwd=work, env=env)
+
+        # Install metadata tooling only after runtime tests pass, so its
+        # dependencies cannot hide a missing package runtime dependency.
+        run(pip + ["install", "--no-input", "twine"], cwd=work, env=env)
+        run([str(python), "-I", "-m", "twine", "check", "--strict", str(artifact)], cwd=work, env=env)
+
+    print(json.dumps({"artifact": str(artifact), "kind": args.kind, "status": "passed"}))
+
+
+if __name__ == "__main__":
+    main()
diff --git a/tests/check_release_version.py b/tests/check_release_version.py
new file mode 100644
index 0000000..5ea903c
--- /dev/null
+++ b/tests/check_release_version.py
@@ -0,0 +1,79 @@
+"""Check package version agreement, and a release/tag version when supplied.
+
+Ordinary branch and pull-request checks need no arguments. GitHub tag runs are
+validated automatically; release preparation passes ``--version 1.2.3``.
+This script reads manifests only and never updates package versions.
+"""
+
+from __future__ import annotations
+
+import argparse
+import json
+import os
+from pathlib import Path
+import re
+import sys
+import tomllib
+
+
+ROOT = Path(__file__).resolve().parents[1]
+VERSION = re.compile(r"(?:0|[1-9]\d*)\.(?:0|[1-9]\d*)\.(?:0|[1-9]\d*)(?:-[0-9A-Za-z.-]+)?(?:\+[0-9A-Za-z.-]+)?\Z")
+
+
+def check_versions(root: Path, requested: str | None = None, tag: str | None = None) -> str:
+    def toml(name):
+        return tomllib.loads((root / name).read_text(encoding="utf-8"))
+
+    version = toml("Cargo.toml")["package"]["version"]
+    if not isinstance(version, str) or not VERSION.fullmatch(version):
+        raise ValueError(f"Cargo.toml has an invalid release version: {version!r}")
+    versions = {"node/Cargo.toml": toml("node/Cargo.toml")["package"]["version"]}
+    package = json.loads((root / "node/package.json").read_text(encoding="utf-8"))
+    lock = json.loads((root / "node/package-lock.json").read_text(encoding="utf-8"))
+    versions["node/package.json"] = package["version"]
+    versions["node/package-lock.json"] = lock["version"]
+    versions["node/package-lock.json packages['']"] = lock["packages"][""]["version"]
+    for filename, names in (("Cargo.lock", ("geddes",)), ("node/Cargo.lock", ("geddes", "geddes-node"))):
+        packages = toml(filename)["package"]
+        for name in names:
+            matches = [p["version"] for p in packages if p["name"] == name and "source" not in p]
+            if len(matches) != 1:
+                raise ValueError(f"{filename} must contain exactly one local {name} package")
+            versions[f"{filename} ({name})"] = matches[0]
+    project = toml("pyproject.toml")["project"]
+    if "version" not in project.get("dynamic", []) or "version" in project:
+        raise ValueError("pyproject.toml must derive its version dynamically from Cargo.toml")
+    for filename, actual in versions.items():
+        if actual != version:
+            raise ValueError(f"{filename} version {actual!r} does not match Cargo.toml {version!r}")
+    if requested is not None:
+        requested = requested.removeprefix("v")
+        if requested != version:
+            raise ValueError(f"Requested version {requested!r} does not match Cargo.toml {version!r}")
+    if tag is not None and tag != f"v{version}":
+        raise ValueError(f"Tag {tag!r} does not match package version v{version}")
+    return version
+
+
+def main() -> int:
+    parser = argparse.ArgumentParser(description=__doc__)
+    parser.add_argument("--version", help="Requested release version, optionally prefixed with v")
+    parser.add_argument("--tag", help="Expected tag; defaults to GITHUB_REF_NAME on tag runs")
+    args = parser.parse_args()
+    tag = args.tag
+    if tag is None and os.environ.get("GITHUB_REF_TYPE") == "tag":
+        tag = os.environ.get("GITHUB_REF_NAME", "")
+    try:
+        version = check_versions(ROOT, requested=args.version, tag=tag)
+    except (ValueError, KeyError, OSError) as exc:
+        print(f"Version check failed: {exc}", file=sys.stderr)
+        return 1
+    if os.environ.get("GITHUB_OUTPUT"):
+        with open(os.environ["GITHUB_OUTPUT"], "a", encoding="utf-8") as stream:
+            stream.write(f"version={version}\ntag=v{version}\n")
+    print(f"Package versions agree: {version}")
+    return 0
+
+
+if __name__ == "__main__":
+    raise SystemExit(main())
diff --git a/tests/data/formats/README.md b/tests/data/formats/README.md
new file mode 100644
index 0000000..8d4c6d9
--- /dev/null
+++ b/tests/data/formats/README.md
@@ -0,0 +1,75 @@
+# XRD reader fixture corpus
+
+[manifest.json](manifest.json) is the shared correctness and benchmark index.
+Each entry gives a file path relative to this directory, its selected scan or
+CIF block, the expected point count, a full two-column reference CSV, numeric
+tolerances, SHA-256 hashes and provenance. Multiple entries can select different
+patterns from the same file.
+
+The current manifest contains **38 cases and 312,202 checked points**, covering
+all ten supported reader families across synthetic and experimental inputs.
+
+## Experimental inputs
+
+Files in `real/` were copied from the
+[Rietx test-data directory](https://github.com/yue-here/rietx/tree/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data)
+at commit **`88d2353f446d98632ef233437000cbe7bc4e1142`**. Original sources and
+license descriptions below follow its
+[provenance record](https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/README.md).
+Their numerical contents are retained, including zero-uncertainty points.
+
+| File | Profile used | Original source | Upstream terms |
+|---|---|---|---|
+| `11BM_NAC.fxye` | 59,498 explicit FXYE points, NAC powder | [GSAS-II tutorials](https://github.com/AdvancedPhotonSource/GSAS-II-tutorials), `TOF-CW Joint Refinement/data/` | Publicly distributed Argonne/APS tutorial data; upstream describes U.S. Government work |
+| `11BM_LaB6_660a.fxye` | 132,992 FXYE points, LaB6 SRM 660a | [GSAS-II tutorials](https://github.com/AdvancedPhotonSource/GSAS-II-tutorials), `FitPeaks/data/11bmb_3844.fxye` | Same Argonne/APS status |
+| `11BM_Si640c.xy` | 48,000 x/y points, silicon SRM 640c | Published APS 11-BM Standards Data, recovered by Rietx from the Internet Archive | Public Argonne/APS standard-reference measurement; upstream describes U.S. Government work |
+| `FAP.XRA` | 5,753 STD channels, fluorapatite | [GSAS-II tutorials](https://github.com/AdvancedPhotonSource/GSAS-II-tutorials), `LabData/data/` | Same Argonne/APS status |
+| `nist_srm660c_100a.cif` | 5,332 points from the `_meas` profile block | [NIST data record mds2-2315](https://data.nist.gov/od/id/mds2-2315) | NIST open data; upstream describes U.S. Government work |
+| `rigaku_nims.ras` | 3,501 points, 25–60 degrees | [nims-mdpf/M-DaC_XRD](https://github.com/nims-mdpf/M-DaC_XRD), `source/XRD_RIGAKU.ras` | Original project MIT license |
+| `rigaku_powder.rasx` | 2,726 points | [FAIRmat readers-xrd](https://github.com/FAIRmat-NFDI/readers-xrd), `tests/data/TwoTheta_scan_powder.rasx` | Apache-2.0 |
+| `rigaku_zno_counts.rasx` | 7,001 points | [FAIRmat readers-xrd](https://github.com/FAIRmat-NFDI/readers-xrd), `tests/data/ZnO-ALD-training_001_1_0-000_0-000.rasx` | Apache-2.0 |
+| `panalytical_attenuator.xrdml` | 1,800 points, raw counts and varying attenuation factors | [FAIRmat readers-xrd](https://github.com/FAIRmat-NFDI/readers-xrd), `tests/data/m54313_om2th_10.xrdml` | Apache-2.0 |
+| `panalytical_mesh.xrdml` | 101 available scans of 255 explicit positions; selected scans listed in manifest | [FAIRmat readers-xrd](https://github.com/FAIRmat-NFDI/readers-xrd), `tests/data/m82762_rc1mm_1_16dg_src_slit_phi-101_3dg_-420_mesh_long.xrdml` | Apache-2.0 |
+| `bruker_absorber.brml` | 2,001 points with intensity in the declared intensity field | [FAIRmat readers-xrd](https://github.com/FAIRmat-NFDI/readers-xrd), `tests/data/23-012-AG_2thomegascan_long.brml` | Apache-2.0 |
+
+The NAC file's actual 59,498 complete rows differ from both its BANK header
+(59,497) and Rietx's older provenance prose (54,000). Geddes keeps every explicit
+FXYE x/y row. Its full reference therefore has **59,498 points**. Rietx's
+uncertainty filtering can produce another count; that does not change the
+contents of the input file.
+
+The [Apache-2.0 license](licenses/LICENSE) accompanies FAIRmat-derived files.
+[Rietx's MIT notice](licenses/rietx-MIT.txt) is retained separately; it does not
+replace the original data sources' terms. The RAS input's original MIT source is
+the NIMS project linked above; its [MIT notice](licenses/nims-MIT.txt), including
+the original copyright statement, is included.
+
+## Synthetic and existing Geddes inputs
+
+[text/](text/README.md) contains authored examples for ASCII, GSAS STD/ESD/FXYE,
+RAS, UXD, CHI and pdCIF. Their intended x/y arrays are explicitly documented,
+including selectable secondary profiles. [bruker/](bruker/README.md) contains
+authored RAW3 and RAW4 binary examples with independently specified values.
+XML/ZIP examples, when listed in the manifest, likewise encode known arrays.
+These authored examples use Geddes's MIT license and are not experimental data.
+
+The manifest also points to the original Geddes samples elsewhere in
+`tests/data/`; their provenance is marked separately. The existing
+`bruker4_diffrac_eva.raw` is byte-identical to Rietx's
+`bruker_raw4_scrambled.raw`. Its scrambled intensities support byte-decoding and
+performance tests, not physical-profile validation. The existing XRDML sample
+contains the same measurement as Rietx's `panalytical_powder.xrdml`.
+
+## Independent references
+
+[../../build_fixture_corpus.py](../../build_fixture_corpus.py) regenerates the
+full x/y CSV references using literal synthetic arrays and independent,
+fixture-specific Python/NumPy/XML/ZIP/`struct`/gemmi extraction. It never calls a
+Geddes or Rietx reader. Reference intensities follow Geddes's defined contract:
+native units, XRDML raw-count attenuation correction, no extra correction to
+BRML or processed XRDML intensities, and no uncertainty-based row filtering.
+
+See the [test guide](../../README.md) for regeneration commands and the separate
+`geddes-test` repository for timing methodology.
+The benchmark validates full arrays before timing and excludes numerical or
+selection mismatches from speed comparisons.
diff --git a/tests/data/formats/bruker/README.md b/tests/data/formats/bruker/README.md
new file mode 100644
index 0000000..a0925b1
--- /dev/null
+++ b/tests/data/formats/bruker/README.md
@@ -0,0 +1,20 @@
+# Bruker format fixtures
+
+These three small synthetic files encode the complete pattern in `expected.xy`:
+RAW3 (`RAW1.01`), RAW4 with a four-byte intensity record, and RAW4 with an
+eight-byte record whose final four bytes are the integer 1. Intensities are
+invented, not a physical measurement. They establish numeric decoding and
+prevent regression to reading record flags as intensities.
+
+The files were packed from the public field descriptions in
+[Rietx's RAW format notes](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/bruker_raw.py)
+and [independent binary writers](https://github.com/yue-here/rietx/blob/main/tests/writers_xrd.py),
+using literal offsets independently of Geddes's reader. The integration tests
+also pack malformed and multiple-scan examples from literal field offsets.
+
+These synthetic fixtures cannot independently establish the vendor's format.
+The existing `tests/data/bruker_raw/bruker4_v5converter.raw` and
+`bruker4_diffrac_eva.raw` exercise real RAW4 structures and distinct record
+strides. The EVA intensities were scrambled upstream and are useful only for
+checking bytes are decoded faithfully, not for physical intensity validation.
+No vendor-produced RAW3 sample is included here.
diff --git a/tests/data/formats/bruker/expected.xy b/tests/data/formats/bruker/expected.xy
new file mode 100644
index 0000000..7488484
--- /dev/null
+++ b/tests/data/formats/bruker/expected.xy
@@ -0,0 +1,6 @@
+10.00 12
+10.02 34.5
+10.04 90
+10.06 321.25
+10.08 87
+10.10 5
diff --git a/tests/data/formats/bruker/synthetic_raw3.raw b/tests/data/formats/bruker/synthetic_raw3.raw
new file mode 100644
index 0000000..4adbc82
Binary files /dev/null and b/tests/data/formats/bruker/synthetic_raw3.raw differ
diff --git a/tests/data/formats/bruker/synthetic_raw4_4byte.raw b/tests/data/formats/bruker/synthetic_raw4_4byte.raw
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index 0000000..738570f
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diff --git a/tests/data/formats/bruker/synthetic_raw4_8byte.raw b/tests/data/formats/bruker/synthetic_raw4_8byte.raw
new file mode 100644
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diff --git a/tests/data/formats/licenses/LICENSE b/tests/data/formats/licenses/LICENSE
new file mode 100644
index 0000000..261eeb9
--- /dev/null
+++ b/tests/data/formats/licenses/LICENSE
@@ -0,0 +1,201 @@
+                                 Apache License
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+
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diff --git a/tests/data/formats/licenses/nims-MIT.txt b/tests/data/formats/licenses/nims-MIT.txt
new file mode 100644
index 0000000..25c22cf
--- /dev/null
+++ b/tests/data/formats/licenses/nims-MIT.txt
@@ -0,0 +1,13 @@
+The MIT License
+
+Copyright (c) 2018 National Institute for Materials Science
+
+Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to deal in the Software without restriction, including without limitation the rights to use, copy, modify, merge, publish, distribute, sublicense, and/or sell copies of the Software, and to permit persons to whom the Software is furnished to do so, subject to the following conditions:
+
+The above copyright notice and this permission notice shall be included in all copies or substantial portions of the Software.
+
+THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY, FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM, OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE SOFTWARE.
+
+
+
+
diff --git a/tests/data/formats/licenses/rietx-MIT.txt b/tests/data/formats/licenses/rietx-MIT.txt
new file mode 100644
index 0000000..99f866d
--- /dev/null
+++ b/tests/data/formats/licenses/rietx-MIT.txt
@@ -0,0 +1,21 @@
+MIT License
+
+Copyright (c) 2026 Yue Wu
+
+Permission is hereby granted, free of charge, to any person obtaining a copy
+of this software and associated documentation files (the "Software"), to deal
+in the Software without restriction, including without limitation the rights
+to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
+copies of the Software, and to permit persons to whom the Software is
+furnished to do so, subject to the following conditions:
+
+The above copyright notice and this permission notice shall be included in all
+copies or substantial portions of the Software.
+
+THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
+IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
+FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
+AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
+LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
+OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
+SOFTWARE.
diff --git a/tests/data/formats/manifest.json b/tests/data/formats/manifest.json
new file mode 100644
index 0000000..852ef38
--- /dev/null
+++ b/tests/data/formats/manifest.json
@@ -0,0 +1,577 @@
+{
+  "schema_version": 1,
+  "rietx_reference_commit": "88d2353f446d98632ef233437000cbe7bc4e1142",
+  "reference_method": "Known synthetic arrays; fixture-specific independent Python/NumPy/XML/ZIP/struct/gemmi extraction. No Geddes or Rietx reader used.",
+  "fixtures": [
+    {
+      "id": "synthetic_xy",
+      "format": "xy",
+      "path": "text/profile.xy",
+      "reference": "references/synthetic_xy.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "dffb6da9583bcd8f39bd2e98b64ba020dfa47cf1a5cb3b1f2334ed44cc8015e4",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_csv",
+      "format": "csv",
+      "path": "text/profile.csv",
+      "reference": "references/synthetic_csv.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "a7aea2a27c62fcfff3daf5fcab07b770b852519e1b347c027b5073dae035b1ac",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_chi",
+      "format": "chi",
+      "path": "text/profile.chi",
+      "reference": "references/synthetic_chi.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "1dcd17f66231f4aa451a63c8ede1d4b6a98e73648d9bdc2638c48c8833146854",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_fxye",
+      "format": "gsas",
+      "path": "text/profile.fxye",
+      "reference": "references/synthetic_fxye.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "9adf858ba37f445c2a088264ca4b7a3567fcce6f310a4ed5b577ea6a873a0ae7",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_gsas",
+      "format": "gsas",
+      "path": "text/profile.gsas",
+      "reference": "references/synthetic_gsas.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "56ae268859b670351b6b1c9598af8646e48d869bfa56360483f078cf44964590",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_ras",
+      "format": "ras",
+      "path": "text/profile.ras",
+      "reference": "references/synthetic_ras.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "3aa68934a5f9385f687b4280545b04f8ae125637d38266ef68bf6d50a4f9780b",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_uxd",
+      "format": "uxd",
+      "path": "text/profile.uxd",
+      "reference": "references/synthetic_uxd.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "012d93791fa0e4880c052ade90dff551dcde176df8d64006e0a829f0b7647a62",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_cif",
+      "format": "pdcif",
+      "path": "text/profile.cif",
+      "reference": "references/synthetic_cif.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "7d8102b1517716bfb16c4c40d5f40d38d00b28e5308da72e45cbb828840d36ff",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_ras_second",
+      "format": "ras",
+      "path": "text/profile.ras",
+      "reference": "references/synthetic_ras_second.csv",
+      "scan": 1,
+      "block": null,
+      "points": 3,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "3aa68934a5f9385f687b4280545b04f8ae125637d38266ef68bf6d50a4f9780b",
+      "reference_sha256": "72f14122079731d15839d62e44b8561c10e53e6ca411f6cf258680ef30015124",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_uxd_second",
+      "format": "uxd",
+      "path": "text/profile.uxd",
+      "reference": "references/synthetic_uxd_second.csv",
+      "scan": 1,
+      "block": null,
+      "points": 3,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "012d93791fa0e4880c052ade90dff551dcde176df8d64006e0a829f0b7647a62",
+      "reference_sha256": "72f14122079731d15839d62e44b8561c10e53e6ca411f6cf258680ef30015124",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_cif_second",
+      "format": "pdcif",
+      "path": "text/profile.cif",
+      "reference": "references/synthetic_cif_second.csv",
+      "scan": 0,
+      "block": "_other",
+      "points": 3,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "7d8102b1517716bfb16c4c40d5f40d38d00b28e5308da72e45cbb828840d36ff",
+      "reference_sha256": "72f14122079731d15839d62e44b8561c10e53e6ca411f6cf258680ef30015124",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_esd",
+      "format": "gsas",
+      "path": "text/profile_esd.gsas",
+      "reference": "references/synthetic_esd.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "ca03fb9eb2343cb07b261243e1c2e6a6747215616ee3b98e953d7d067dd4f1ba",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_raw3",
+      "format": "bruker_raw3",
+      "path": "bruker/synthetic_raw3.raw",
+      "reference": "references/synthetic_raw3.csv",
+      "scan": 0,
+      "block": null,
+      "points": 6,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "9e9cf4526473dcd4270acdb0b1cfc5d69d097bcc4efb4fd6d90c91f9e86f13e7",
+      "reference_sha256": "c2108285893da7b2af0a9abb29ee44ea1a119743c79e2c7d0cf0243cfe0209a6",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_raw4_4byte",
+      "format": "bruker_raw4",
+      "path": "bruker/synthetic_raw4_4byte.raw",
+      "reference": "references/synthetic_raw4_4byte.csv",
+      "scan": 0,
+      "block": null,
+      "points": 6,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "3eef74b5147c57eeaee7965fdd39bdea2d1a7bf115dc33e252c642799c3a76a4",
+      "reference_sha256": "c2108285893da7b2af0a9abb29ee44ea1a119743c79e2c7d0cf0243cfe0209a6",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_raw4_8byte",
+      "format": "bruker_raw4",
+      "path": "bruker/synthetic_raw4_8byte.raw",
+      "reference": "references/synthetic_raw4_8byte.csv",
+      "scan": 0,
+      "block": null,
+      "points": 6,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "7c579cdf0967300d923fa17509ca97ee72108236c6f84c10b1cea898ba201f40",
+      "reference_sha256": "c2108285893da7b2af0a9abb29ee44ea1a119743c79e2c7d0cf0243cfe0209a6",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_xrdml",
+      "format": "xrdml",
+      "path": "xml/synthetic.xrdml",
+      "reference": "references/synthetic_xrdml.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "3a0e546db2ad717fdc241afab0c3f0bb0a5915c0a212f1c0745ed22deeceaf74",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_rasx",
+      "format": "rasx",
+      "path": "xml/synthetic.rasx",
+      "reference": "references/synthetic_rasx.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "c2a2ca3d49e419f81230db6d70cfc90cf4d89025d91ef7bd3c309027d3a99570",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "synthetic_brml",
+      "format": "brml",
+      "path": "xml/synthetic.brml",
+      "reference": "references/synthetic_brml.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "dd145c8e062ab91c81e9c445a727ba7ae0e7e1db2836eddd6f2159429494ceff",
+      "reference_sha256": "2df76682d56d66381a68fe616474d4637304f3bf5687fffc2dd5f3b3290f24f1",
+      "provenance": "Geddes-authored synthetic pattern; MIT",
+      "note": null
+    },
+    {
+      "id": "rigaku_powder",
+      "format": "rasx",
+      "path": "real/rigaku_powder.rasx",
+      "reference": "references/rigaku_powder.csv",
+      "scan": 0,
+      "block": null,
+      "points": 2726,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "d39fb8f9256bfa31349fe14ee8df2ab7b8ca7d54747609cc2ef4e29c6f6ff0d6",
+      "reference_sha256": "81302a6258f155a2e831c26c533001e79409e855c1566d7c8d6c2d9a4c8edc5e",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/rigaku_powder.rasx",
+      "note": null
+    },
+    {
+      "id": "rigaku_zno_counts",
+      "format": "rasx",
+      "path": "real/rigaku_zno_counts.rasx",
+      "reference": "references/rigaku_zno_counts.csv",
+      "scan": 0,
+      "block": null,
+      "points": 7001,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "5cefe27fd845669f0dc4626a313c1d56ab55e8198bdf7be99e6740aa490b1829",
+      "reference_sha256": "f0ed63503d93bfb5f3872488d5a951f8ddae1ce072caf1bab7285d2e0e75e074",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/rigaku_zno_counts.rasx",
+      "note": null
+    },
+    {
+      "id": "panalytical_attenuator_0",
+      "format": "xrdml",
+      "path": "real/panalytical_attenuator.xrdml",
+      "reference": "references/panalytical_attenuator_0.csv",
+      "scan": 0,
+      "block": null,
+      "points": 1800,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "fff6bef2766d87bb0ff7109a8463fdf76dd8233335228933656f5ef35317cb9e",
+      "reference_sha256": "df6aea3bdc6ebb90cd3ccf422e7f2dd211413cf0c59446cc738f9e41238d6e46",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/panalytical_attenuator.xrdml",
+      "note": null
+    },
+    {
+      "id": "panalytical_mesh_0",
+      "format": "xrdml",
+      "path": "real/panalytical_mesh.xrdml",
+      "reference": "references/panalytical_mesh_0.csv",
+      "scan": 0,
+      "block": null,
+      "points": 255,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "b314a128f5d4d24a03db9ab72d321a8e4f7c78a0075a1fa51a4a2f26ad625438",
+      "reference_sha256": "0b18daef76826fcdb7ad495679e7ab74a7baa7e043b6482e4507d275922471de",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/panalytical_mesh.xrdml",
+      "note": null
+    },
+    {
+      "id": "panalytical_mesh_50",
+      "format": "xrdml",
+      "path": "real/panalytical_mesh.xrdml",
+      "reference": "references/panalytical_mesh_50.csv",
+      "scan": 50,
+      "block": null,
+      "points": 255,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "b314a128f5d4d24a03db9ab72d321a8e4f7c78a0075a1fa51a4a2f26ad625438",
+      "reference_sha256": "483e7e7ac319fb857de8a8b76d8ac579924793c059a7825ecf01bc557e761456",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/panalytical_mesh.xrdml",
+      "note": null
+    },
+    {
+      "id": "panalytical_mesh_100",
+      "format": "xrdml",
+      "path": "real/panalytical_mesh.xrdml",
+      "reference": "references/panalytical_mesh_100.csv",
+      "scan": 100,
+      "block": null,
+      "points": 255,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "b314a128f5d4d24a03db9ab72d321a8e4f7c78a0075a1fa51a4a2f26ad625438",
+      "reference_sha256": "792ef56e2669430036e48fd090c75c3abb6dc9ccfacad485b495a1d46c67f4dc",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/panalytical_mesh.xrdml",
+      "note": null
+    },
+    {
+      "id": "bruker_absorber",
+      "format": "brml",
+      "path": "real/bruker_absorber.brml",
+      "reference": "references/bruker_absorber.csv",
+      "scan": 0,
+      "block": null,
+      "points": 2001,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "055c3daf95626a098184142513473e9d4141c435d138ea7352954311a641c7cd",
+      "reference_sha256": "406b0362912f1657845145def40e279ae82161b03babd1464a2ff0a45c208af0",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/bruker_absorber.brml",
+      "note": "Independent fixture-specific columns: 2Theta=2, intensity=7; stored absorber correction retained."
+    },
+    {
+      "id": "rigaku_nims",
+      "format": "ras",
+      "path": "real/rigaku_nims.ras",
+      "reference": "references/rigaku_nims.csv",
+      "scan": 0,
+      "block": null,
+      "points": 3501,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "2e78f5daf944b30656172c5d1dbd90e7a0fe17b23fad721ee4d99e92a7f115d3",
+      "reference_sha256": "99c129b20fd6ac8d0ebea36dbec7e7aebb5b66d4c7bdc7d099656c47560ead6d",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/rigaku_nims.ras",
+      "note": null
+    },
+    {
+      "id": "11BM_NAC",
+      "format": "gsas",
+      "path": "real/11BM_NAC.fxye",
+      "reference": "references/11BM_NAC.csv",
+      "scan": 0,
+      "block": null,
+      "points": 59498,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "e2b8ef256c97d896a38b131b934da5671831354f983ae28b3817e02dc71f3a20",
+      "reference_sha256": "5af409cf03415bde8db972a4971b3ed733839cde8014782781ba1e92e1e60565",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/11BM_NAC.fxye",
+      "note": null
+    },
+    {
+      "id": "11BM_LaB6_660a",
+      "format": "gsas",
+      "path": "real/11BM_LaB6_660a.fxye",
+      "reference": "references/11BM_LaB6_660a.csv",
+      "scan": 0,
+      "block": null,
+      "points": 132992,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "24fea862c2c93af5ce3de8b05675a2d55d753c9930bea7fab75cb22994a397ea",
+      "reference_sha256": "0633ba2215817e3ef3829a62b5d342abcd4cf48b1804271193fa917797a394ac",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/11BM_LaB6_660a.fxye",
+      "note": null
+    },
+    {
+      "id": "FAP",
+      "format": "gsas",
+      "path": "real/FAP.XRA",
+      "reference": "references/FAP.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5753,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "b567c0cc2b022143002976824b5ba544ac09119d67a40b0fc1cf2d52d562d304",
+      "reference_sha256": "06eee84b37953ec3a8fb5f07a12b89fead5f66616c3d70c34273d00817aa1d88",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/FAP.XRA",
+      "note": null
+    },
+    {
+      "id": "11BM_Si640c",
+      "format": "xy",
+      "path": "real/11BM_Si640c.xy",
+      "reference": "references/11BM_Si640c.csv",
+      "scan": 0,
+      "block": null,
+      "points": 48000,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "a10f555ed01e10f488eaaf5b7a22500dde1fe9b21dceb5429f4c0eb771621578",
+      "reference_sha256": "e26fcb42782b1145c0300c04ec0d3bde3a797c08ff24f7eb9c2806b5a1502b5b",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/11BM_Si640c.xy",
+      "note": null
+    },
+    {
+      "id": "nist_srm660c",
+      "format": "pdcif",
+      "path": "real/nist_srm660c_100a.cif",
+      "reference": "references/nist_srm660c.csv",
+      "scan": 0,
+      "block": "_meas",
+      "points": 5332,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "0cad5db7735655e2f816ffdcecf04a2a1a9b912a23d323e78627812c15f98561",
+      "reference_sha256": "fde5a5b360ba6194cc1e51f51c4cd4b168513d54aa147dd479472e4a3a517edf",
+      "provenance": "https://github.com/yue-here/rietx/blob/88d2353f446d98632ef233437000cbe7bc4e1142/tests/data/nist_srm660c_100a.cif",
+      "note": null
+    },
+    {
+      "id": "existing_xrdml",
+      "format": "xrdml",
+      "path": "../xrdml/sample.xrdml",
+      "reference": "references/existing_xrdml.csv",
+      "scan": 0,
+      "block": null,
+      "points": 5027,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "4a1778123b276a48120ff85dd86ff139f216cc29a51537b04b26140ab99cd83b",
+      "reference_sha256": "5b31a2882aa9be9c27d4d0212549000618cba28cab30a20342150c4b00ac2c3b",
+      "provenance": "Existing Geddes fixture; same measurement as Rietx panalytical_powder.xrdml",
+      "note": null
+    },
+    {
+      "id": "existing_rasx",
+      "format": "rasx",
+      "path": "../rasx/sample.rasx",
+      "reference": "references/existing_rasx.csv",
+      "scan": 0,
+      "block": null,
+      "points": 2334,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "576802110f0f64929f54ef324cc832972c5996bfd5bd987ae251b747e7ee8fb9",
+      "reference_sha256": "b82a647d4182e00843e434b1a45af2f6078c0c0de1675e306a6536cc4541397e",
+      "provenance": "Existing Geddes fixture",
+      "note": null
+    },
+    {
+      "id": "existing_gsas",
+      "format": "gsas",
+      "path": "../gsas_raw/gsas.raw",
+      "reference": "references/existing_gsas.csv",
+      "scan": 0,
+      "block": null,
+      "points": 4941,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "994f38c5bc847360072e39ae534490b91b224426a8cd9172df478fe340501ae8",
+      "reference_sha256": "24dac336466ff91b2ca38b36c74ffb550823855b269471c3ac4a8d9581c0b7ff",
+      "provenance": "Existing Geddes fixture",
+      "note": null
+    },
+    {
+      "id": "existing_xy",
+      "format": "xy",
+      "path": "../xy/sample.xy",
+      "reference": "references/existing_xy.csv",
+      "scan": 0,
+      "block": null,
+      "points": 11900,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "1aafd973b2adb9b868ebf48bbda7d75713c97fee745077c62f1d9627ceca3672",
+      "reference_sha256": "1a95c384745180aefc28ab5ef86ba30e7107207993ccc7d6452aa62bd852ff15",
+      "provenance": "Existing Geddes fixture",
+      "note": null
+    },
+    {
+      "id": "existing_csv",
+      "format": "csv",
+      "path": "../csv/sample.csv",
+      "reference": "references/existing_csv.csv",
+      "scan": 0,
+      "block": null,
+      "points": 7351,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "d16e4fc45bddd4b5f62dbd18deff5c1902928d5dc3468909c87ac003a5844e08",
+      "reference_sha256": "cb88de58328f9a13a4591326c7da070357491ba11bb0ffcf112cf57c3feede9b",
+      "provenance": "Existing Geddes fixture",
+      "note": null
+    },
+    {
+      "id": "bruker4_v5converter",
+      "format": "bruker_raw4",
+      "path": "../bruker_raw/bruker4_v5converter.raw",
+      "reference": "references/bruker4_v5converter.csv",
+      "scan": 0,
+      "block": null,
+      "points": 4059,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "c36706dce91b6b1b0a47fc68be9d7db7346eb0beaf3f0b8490bca112690bc391",
+      "reference_sha256": "5e0f36eb92e5ece41c73c5ba4ee7388eb40e00f07cc7e5d1be3ffd82dbceeaa5",
+      "provenance": "Existing Geddes fixture; literal offsets independently verified against file layout",
+      "note": null
+    },
+    {
+      "id": "bruker4_diffrac_eva",
+      "format": "bruker_raw4",
+      "path": "../bruker_raw/bruker4_diffrac_eva.raw",
+      "reference": "references/bruker4_diffrac_eva.csv",
+      "scan": 0,
+      "block": null,
+      "points": 7134,
+      "rtol": 1e-12,
+      "atol": 1e-09,
+      "sha256": "303f35b65280ec82d36abf2a2843ccb1958d10ecf4929dfc94f5da0db00ade99",
+      "reference_sha256": "d69ad2295e4c969245a8af6aa258929ae30d3a67475f247b909ded2996e922f7",
+      "provenance": "Existing Geddes fixture; literal offsets independently verified against file layout",
+      "note": "EVA intensities scrambled: verifies byte decoding, not physical measurement correctness."
+    }
+  ]
+}
diff --git a/tests/data/formats/real/11BM_LaB6_660a.fxye b/tests/data/formats/real/11BM_LaB6_660a.fxye
new file mode 100644
index 0000000..f0dbe7c
--- /dev/null
+++ b/tests/data/formats/real/11BM_LaB6_660a.fxye
@@ -0,0 +1,133053 @@
+GSAS input created by BIN11BM from oct09/11bmb_3844.asc
+# Calibration from: /data/oct09/11bmb_3843.calib
+# Mean wavelength is:     0.413128
+## mda2ascii 0.3.2 generated output
+# MDA File Version = 1.3
+# Scan number = 3844
+# Overall scan dimension = 1-D
+# Total requested scan size = 120000
+#  Extra PV: name, descr, values (, unit)
+#saveData_realTime1D, enum, "Yes"
+#saveData_scanNumber, long, "3845",
+#saveData_fileSystem, filesystem, "//s11bmsrv1/RAID/data"
+#saveData_subDir, subdir, "oct09"
+#saveData_fileName, filename, "11bmb_3844.mda"
+#saveData_comment1, comment1, "robotic collection"
+#saveData_comment2, comment2, " "
+#userHolder1.VAL, sample_name, "SRM 660a"
+#userHolder2.VAL, chemical_formula, "Lanthanum Hexaboride (LaB6)"
+#userHolder3.VAL, proposal_no, "0"
+#userHolder4.VAL, email, "brian.toby@anl.gov ribaud@anl.gov vondr"
+#userHolder5.VAL, Collection T, "295.0"
+#userHolder6.VAL, focus_cond., "Collimated, Vertical &  Sagittal focus"
+#userHolder7.VAL, Analyzer_setting, "all 12 analyzers Si 111"
+#userHolder8.VAL, Barcode_id, "HA00AP2922"
+#A1sens_num.VAL, I0sens, "200"
+#A1sens_unit.VAL, I0sens_unit, "nA/V"
+#A1offset_sign.VAL, I0offset_sign, "-"
+#A1offset_num.VAL, I0offset, "10"
+#A1offset_unit.VAL, I0offset_unit, "nA"
+#A1off_u_put.VAL, I0off_uput, "-36",
+#A2sens_num.VAL, MONsens, "10"
+#A2sens_unit.VAL, MONsens_unit, "nA/V"
+#A2offset_sign.VAL, MONoffset_sign, "+"
+#A2offset_num.VAL, MONoffset, "500"
+#A2offset_unit.VAL, MONoffset_unit, "pA"
+#A2off_u_put.VAL, MONoff_uput, "47",
+# Extra PV 61: 11bma:EnCalc, energy, "30.0005136", KeV
+# Extra PV 62: 11bma:LambdaCalc, wavelength, "0.413259592", A
+#slew_setup.A, start_tth, "-15",
+#slew_setup.B, end_tth, "45",
+#slew_setup.C, minimal_step, "0.0004",
+#slew_setup.D, step_size_input, "0.0005",
+#slew_setup.E, MCS prescale, "5",
+#slew_setup.F, NPTS, "120000",
+#slew_setup.H, Time/step, "0.028",
+#slew_setup.I, motor_speed, "0.357142857",
+#slew_setup.J, base_speed, "0.00595238095",
+#slew_setup.K, Accel_time, "0.00595238095",
+#slew_setup.L, Total_time, "3360",
+#m28.RBV, start_tth_rbk, "-15", degrees
+# 1-D Scan
+# Points completed = 120000 of 120000
+#slew
+# Scan time = OCT 23, 2009 02:44:33.737404
+#  Positioner: name, descr, step mode, unit, rdbk name, rdbk descr, rdbk unit
+#  Detector: name, descr, unit
+# Column Descriptions:
+#    1  [     Index      ]
+#m28.VAL, tth, FLY, degrees, 11bmb:m28.RBV, tth, degrees
+# 1-D Scan Values
+BANK 1  132992 132992 CONS       49.950       0.050  0 0 FXYE 
+      49.950    13.0092        1.29518    
+      50.000    13.0384        1.29562    
+      50.050    14.0483        1.34547    
+      50.100    13.1129        1.29876    
+      50.150    13.7311        1.32666    
+      50.200    14.7742        1.36892    
+      50.250    14.6748        1.36061    
+      50.300    14.7220        1.37224    
+      50.350    14.1321        1.35421    
+      50.400    15.1078        1.38914    
+      50.450    14.9359        1.38084    
+      50.500    13.9351        1.33007    
+      50.550    14.0913        1.34064    
+      50.600    12.3812        1.25802    
+      50.650    11.5575        1.22132    
+      50.700    11.8981        1.23356    
+      50.750    12.4120        1.25890    
+      50.800    15.2675        1.39655    
+      50.850    14.7239        1.36412    
+      50.900    14.5251        1.36169    
+      50.950    13.1070        1.29504    
+      51.000    13.1176        1.29876    
+      51.050    13.9990        1.34083    
+      51.100    14.3184        1.35469    
+      51.150    15.0744        1.39265    
+      51.200    13.5414        1.32024    
+      51.250    12.4587        1.26209    
+      51.300    11.9441        1.23159    
+      51.350    12.5637        1.27156    
+      51.400    13.6892        1.32843    
+      51.450    14.2027        1.35119    
+      51.500    14.2566        1.35321    
+      51.550    14.5335        1.36325    
+      51.600    14.2806        1.34976    
+      51.650    12.6838        1.27370    
+      51.700    12.7452        1.27833    
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diff --git a/tests/data/formats/real/11BM_NAC.fxye b/tests/data/formats/real/11BM_NAC.fxye
new file mode 100644
index 0000000..68c9939
--- /dev/null
+++ b/tests/data/formats/real/11BM_NAC.fxye
@@ -0,0 +1,59515 @@
+NAC /nov12/11bmb_1804
+# Run no. =               1804 
+# No. steps =             54000 
+# Scan time =             NOV 29, 2012 18:07:11.025644 
+# Sample Comment =        NAC 
+# User sample name =      1.5 mm diameter 
+# Composition =           Na2Ca3Al2F14
+# Temp (K) =              298.0 
+# Start 2theta (deg) =    -16.0 
+# End 2theta (deg) =      38.0 
+# 2theta step (deg) =     0.001 
+# Time per step (sec) =   0.1 
+# Intensity scale =       9383.82768362 
+# Calibration file =      11bmb_1800_2thcorrected.calib 
+# 2Theta correction subtracted 
+# Calibrated wavelength = 0.413909
+BANK  1    59497   59497 CONS      50.00      0.10 0 0 FXYE
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+        5962.44        104.315       30.81
+        5962.54        173.721       39.99
+        5962.64        207.147       43.66
+        5962.74        183.077       41.11
+        5962.84        175.361       40.23
+        5962.94        183.476        41.1
+        5963.04        205.123       43.33
+        5963.14        137.264       35.48
+        5963.24        187.228       41.48
+        5963.34        241.621       47.21
+        5963.44        226.366        45.4
+        5963.54        134.393       35.17
+        5963.64        156.496       37.96
+        5963.74        147.731       36.84
+        5963.84        129.204       34.22
+        5963.94         210.59       44.06
+        5964.04        211.298       43.64
+        5964.14        120.457       32.96
+        5964.24        182.159       40.91
+        5964.34        144.258       36.46
+        5964.44        175.905       40.24
+        5964.54        186.789       41.05
+        5964.64        113.723       31.91
+        5964.74        191.969        42.1
+        5964.84        168.766       39.28
+        5964.94        118.645       33.02
+        5965.04        149.573       37.14
+        5965.14        172.494        39.7
+        5965.24        224.742       45.53
+        5965.34        195.037        42.4
+        5965.44        184.491       41.11
+        5965.54        240.884       47.11
+        5965.64        191.429       41.75
+        5965.74        109.767        31.7
+        5965.84        94.5471       29.04
+        5965.94        172.476       39.89
+        5966.04        185.481       41.33
+        5966.14            167       39.15
+        5966.24        186.376       41.33
+        5966.34        146.183       36.56
+        5966.44        184.026          41
+        5966.54        128.405       34.36
+        5966.64         150.13       37.15
+        5966.74        146.424       36.58
+        5966.84         209.63       43.98
+        5966.94        215.672       44.52
+        5967.04        157.451       38.07
+        5967.13        135.423       35.28
+        5967.23        159.161       38.33
+        5967.33        161.819       38.64
+        5967.43        163.162       38.69
+        5967.53        221.012       45.13
+        5967.63        244.254       47.43
+        5967.73        210.756       43.93
+        5967.83        158.827       38.22
+        5967.93        184.852       41.27
+        5968.03        170.272       39.54
+        5968.13        211.876       44.18
+        5968.23        201.088       43.04
+        5968.33        163.936        38.9
+        5968.43        172.917       39.84
+        5968.53        200.546       42.79
+        5968.63        144.993        36.5
+        5968.73         170.83       39.71
+        5968.83         193.96       42.29
+        5968.93        214.684       44.51
+        5969.03        177.453       40.32
+        5969.13        138.346       35.64
+        5969.23        173.214       39.96
+        5969.33        191.429       42.03
+        5969.43        184.508       41.26
+        5969.53        184.413       41.24
+        5969.63        181.802       40.92
+        5969.73        173.047       39.97
+        5969.83        192.758       41.93
+        5969.93        224.089        44.7
+        5970.03        147.591       35.84
+        5970.13        246.965       47.43
+        5970.23        161.354       38.59
+        5970.33        170.053       39.43
+        5970.43        201.177       42.73
+        5970.53        112.432       32.15
+        5970.63        119.519       32.66
+        5970.73        216.492       44.56
+        5970.83        264.517       49.39
+        5970.93        253.516       48.25
+        5971.03        278.269       50.36
+        5971.13        207.165       43.52
+        5971.23        244.721       47.38
+        5971.33         215.45       44.33
+        5971.43        259.305       48.58
+        5971.53        160.916       38.52
+        5971.63         155.27        37.8
+        5971.73        183.261       41.11
+        5971.83        200.476       43.02
+        5971.93        204.334       43.39
+        5972.03        209.574       43.82
+        5972.13        153.984       37.66
+        5972.23        161.033       38.48
+        5972.33        169.892       39.33
+        5972.43        129.589       34.39
+        5972.53        194.102       42.21
+        5972.63        212.463          44
+        5972.73        153.135       37.59
+        5972.83        147.111       36.65
+        5972.93        112.489       32.14
+        5973.03        152.045       37.37
+        5973.13        198.118       42.67
+        5973.23         225.54       45.65
+        5973.33        201.375       43.09
+        5973.43        169.905        39.6
+        5973.53        170.783       39.62
+        5973.63         208.37       43.81
+        5973.73        204.744       43.39
+        5973.83        180.396       40.75
+        5973.93        192.595       42.04
+        5974.03        159.003       38.25
+        5974.13        170.037        39.5
+        5974.23        158.617       38.11
+        5974.33        174.282       39.78
+        5974.43        116.691       32.81
+        5974.53        137.904       35.63
+        5974.63        168.336       39.33
+        5974.73        179.138       40.59
+        5974.83        144.811       36.57
+        5974.93        150.433       37.21
+        5975.03        181.265       40.88
+        5975.13        187.369       41.53
+        5975.23        193.565       42.18
+        5975.33        203.373       43.11
+        5975.43        178.159       40.25
+        5975.53        230.334       46.05
+        5975.63          196.3       42.45
+        5975.73        156.881       38.03
+        5975.83         176.01        39.9
+        5975.93        224.075       45.33
+        5976.03        168.863       39.44
+        5976.13        147.106       36.78
+        5976.23        142.032       36.15
+        5976.33        156.547       37.98
+        5976.43        154.541       37.67
+        5976.53         181.17       40.87
+        5976.63        168.491       39.38
+        5976.73        166.758       39.21
+        5976.83        201.023       43.01
+        5976.93        191.119       41.54
+        5977.03        166.211       38.52
+        5977.13        225.627        45.5
+        5977.23        174.654       40.13
+        5977.33        163.657       38.85
+        5977.43         172.12       39.87
+        5977.53        172.798       39.91
+        5977.63        180.938       40.84
+        5977.73        175.448       40.25
+        5977.83         154.81       37.66
+        5977.93        120.094       33.31
+        5978.03        144.178       36.27
+        5978.13        177.379       40.42
+        5978.23        162.861       38.79
+        5978.33        188.807       41.54
+        5978.43        197.747       42.31
+        5978.53        129.169       34.52
+        5978.63        186.154       40.68
+        5978.73        219.808       44.38
+        5978.83        179.709       40.13
+        5978.93        211.647       43.75
+        5979.03        134.667       35.23
+        5979.13        183.699       40.47
+        5979.23         253.09       48.31
+        5979.33        219.695       45.01
+        5979.43        206.744       43.68
+        5979.53        219.425       44.97
+        5979.63        204.297       43.26
+        5979.73        173.718       40.04
+        5979.83        154.579        37.5
+        5979.93        148.578       36.62
+        5980.03        233.096       46.23
+        5980.13          261.2       49.03
+        5980.23         194.19       41.89
+        5980.33        152.244       37.34
+        5980.43        207.692       43.69
+        5980.53        204.931       43.23
+        5980.63        179.941        40.6
+        5980.73        204.597       43.46
+        5980.83        189.977       41.88
+        5980.93        231.867       45.95
+        5981.03        299.118       52.53
+        5981.13        248.736       47.47
+        5981.23        215.251       44.34
+        5981.33        259.887       48.99
+        5981.43         221.32       45.09
+        5981.53         216.65       44.55
+        5981.63        250.148       48.02
+        5981.73        215.759       44.55
+        5981.83         192.89        42.2
+        5981.93        190.921       41.96
+        5982.03        240.667       46.57
+        5982.13        281.412       50.76
+        5982.23        239.223          47
+        5982.33        261.849       49.16
+        5982.43        268.663        49.8
+        5982.53         253.95       48.38
+        5982.63        261.462       49.07
+        5982.73        230.707       45.87
+        5982.83        171.289       39.78
+        5982.93        183.174       41.07
+        5983.03        202.729       43.22
+        5983.13        164.239       38.59
+        5983.23        107.173       31.39
+        5983.33        109.614       31.71
+        5983.43        211.645       43.25
+        5983.53        230.839       45.44
+        5983.63        147.506       36.88
+        5983.73        174.026       39.96
+        5983.83        181.251       40.83
+        5983.93        152.599       37.54
+        5984.03        173.952       39.92
+        5984.13        198.428       42.77
+        5984.23        216.221       44.63
+        5984.33        200.101       42.76
+        5984.43        165.956       39.14
+        5984.53        135.119       34.86
+        5984.63        141.422       35.51
+        5984.73            176       40.26
+        5984.83        143.512       36.36
+        5984.93        129.265       34.55
+        5985.03         151.51       37.26
+        5985.13        148.028       36.77
+        5985.23        183.432        40.5
+        5985.33        213.036       44.18
+        5985.43        179.973       40.76
+        5985.53        166.347       39.11
+        5985.63        179.537       40.53
+        5985.73         235.29       46.56
+        5985.83        222.009       45.13
+        5985.93        148.107        36.7
+        5986.03        161.055       38.05
+        5986.13        184.476       41.13
+        5986.23        161.537       38.61
+        5986.33         180.07       40.75
+        5986.43        207.886        43.8
+        5986.53        193.601       42.15
+        5986.63        175.375       40.21
+        5986.73        180.189       40.81
+        5986.83        170.842       39.72
+        5986.93        152.202       37.45
+        5987.03        142.974        36.3
+        5987.13        142.896        36.3
+        5987.23        199.565       42.43
+        5987.33         178.65       39.58
+        5987.43        158.149       37.61
+        5987.53        226.158       45.64
+        5987.63        206.651       43.52
+        5987.73        199.191       42.82
+        5987.83        207.544       43.77
+        5987.93        222.567       45.26
+        5988.03        244.232       47.45
+        5988.13        215.995       44.58
+        5988.23          160.6       38.33
+        5988.33        138.963       35.82
+        5988.43        157.427       38.12
+        5988.53        185.207       41.28
+        5988.63        227.094       45.72
+        5988.73          201.2       42.82
+        5988.83        166.596        39.2
+        5988.93        189.945       41.85
+        5989.03        188.411       41.66
+        5989.13        165.647       39.09
+        5989.23        181.408       40.86
+        5989.33        188.654       41.72
+        5989.43        200.014       42.92
+        5989.53        221.264       45.17
+        5989.63        226.188       45.66
+        5989.73        176.847          40
+        5989.83        149.055       37.04
+        5989.93        186.073       41.41
+        5990.03        197.975       42.73
+        5990.13        233.306       46.24
+        5990.23        208.214       43.46
+        5990.33         181.91       40.91
+        5990.43        208.201       43.85
+        5990.53        251.866       48.05
+        5990.63        240.685       46.93
+        5990.73        182.997       41.05
+        5990.83        141.054       35.97
+        5990.93        175.446       39.81
+        5991.03        221.163       45.14
+        5991.13        221.362       45.19
+        5991.23        206.484       43.65
+        5991.33        219.387       44.95
+        5991.43        229.999       46.08
+        5991.53        241.587       47.16
+        5991.63        248.037       47.82
+        5991.73        265.924       49.53
+        5991.83        276.292       50.53
+        5991.93        267.915       49.75
+        5992.03        293.123       51.95
+        5992.13        272.405       50.02
+        5992.23        255.623       48.57
+        5992.33        278.342       50.71
+        5992.43        327.934       54.96
+        5992.53        364.699       57.98
+        5992.63        348.234       56.67
+        5992.73        280.441       50.74
+        5992.83        250.721       48.12
+        5992.93        248.151       47.87
+        5993.03        276.377       50.39
+        5993.13        304.489          53
+        5993.23        246.959       47.53
+        5993.33        245.557        47.5
+        5993.43        303.592       52.92
+        5993.53        227.524       45.07
+        5993.63        178.068       40.47
+        5993.73        220.697        45.1
+        5993.83        208.206       43.77
+        5993.93         163.39       38.79
+        5994.03        131.575       34.79
+        5994.13         82.447       27.08
+        5994.23        119.728       32.24
+        5994.33        198.351        42.7
+        5994.43        189.601       41.74
+        5994.53        165.946       39.11
+        5994.63        182.039       40.95
+        5994.73        177.952       40.51
+        5994.83        182.227          41
+        5994.93         215.34       44.57
+        5995.03        204.094       43.32
+        5995.13        184.533       41.26
+        5995.23        221.875       45.15
+        5995.33        217.669       44.76
+        5995.43        194.084       42.35
+        5995.53        151.412        37.1
+        5995.63        157.018       37.86
+        5995.73         163.68       38.83
+        5995.83         179.58       40.62
+        5995.93        213.906       44.45
+        5996.03        205.591       43.52
+        5996.13        183.268       41.11
+        5996.23         159.88       38.41
+        5996.33        163.624       38.85
+        5996.43        191.295       42.01
+        5996.53        150.585       36.85
+        5996.63        158.047       37.85
+        5996.73        136.435       34.91
+        5996.83        134.258       34.87
+        5996.93        150.613       37.27
+        5997.03        133.143       35.04
+        5997.13        160.572       38.35
+        5997.23         190.09       41.91
+        5997.33        167.991       39.31
+        5997.43        179.083       40.55
+        5997.53         202.81       43.24
+        5997.63         145.71       36.12
+        5997.73        148.376       36.64
+        5997.83        184.737       41.31
+        5997.93        174.351       40.11
+        5998.03        160.753       38.49
+        5998.13        172.345       39.84
+        5998.23        200.349          43
+        5998.33        212.462        44.3
+        5998.43        191.761       42.03
+        5998.53        206.086        43.5
+        5998.63        173.888       39.63
+        5998.73        155.099       37.75
+        5998.83        155.021       37.79
+        5998.93        205.538        43.1
diff --git a/tests/data/formats/real/11BM_Si640c.xy b/tests/data/formats/real/11BM_Si640c.xy
new file mode 100644
index 0000000..85c4061
--- /dev/null
+++ b/tests/data/formats/real/11BM_Si640c.xy
@@ -0,0 +1,48015 @@
+## Title:  From feb10/11bmb_4918.mda processed @ 10-02-26 15:06 
+## Run no. =               4918 
+## No. steps =             34000 
+## Scan time =             FEB 25  2010 17:14:00.580709 
+## Sample name =           Silicon (Si)  NIST SRM 640c, certified cell length of 5.4311946 Angstroms
+## Chemical formula =      Si
+## Start 2theta =          -6.0 
+## End 2theta =            28.0 
+## 2theta step=            0.001 
+## Time per step =         0.1 
+## Intensity scale =       5889.56694072 
+## Calibration file =      feb10/11bmb_4917.calib 
+## Calibrated wavelength = 0.412359 
+##
+## 2theta  intensity  sigma(intensity)
+1.996000  184.055647  19.735763
+1.997000  203.970743  20.898962
+1.998000  176.157267  19.391613
+1.999000  193.597888  20.279832
+2.000000  189.134945  18.043620
+2.001000  211.238669  19.144028
+2.002000  230.817956  19.935298
+2.003000  180.803061  17.599398
+2.004000  195.286766  18.344742
+2.005000  202.387859  18.668955
+2.006000  199.394292  18.511461
+2.007000  214.087235  19.184408
+2.008000  182.623664  17.680036
+2.009000  189.350619  18.085294
+2.010000  212.602297  19.100567
+2.011000  193.009483  18.208271
+2.012000  188.213226  18.037612
+2.013000  186.909968  18.009647
+2.014000  211.651528  19.126298
+2.015000  205.278475  18.795370
+2.016000  183.556179  17.732567
+2.017000  203.956349  18.746812
+2.018000  216.311298  19.286717
+2.019000  202.425696  18.648785
+2.020000  211.481756  19.110270
+2.021000  206.934096  18.865417
+2.022000  208.305886  18.941473
+2.023000  197.192473  18.426834
+2.024000  183.320182  17.787749
+2.025000  167.741668  16.955644
+2.026000  200.787563  18.507409
+2.027000  213.559173  19.196061
+2.028000  215.690606  19.337716
+2.029000  193.241952  18.304718
+2.030000  191.521339  18.168837
+2.031000  166.756484  16.956671
+2.032000  165.913490  16.898436
+2.033000  199.995196  18.641651
+2.034000  192.768433  18.212989
+2.035000  168.162379  16.932023
+2.036000  176.526549  17.401771
+2.037000  159.024904  16.580556
+2.038000  198.929063  18.452113
+2.039000  185.224974  17.832311
+2.040000  190.780176  18.111071
+2.041000  186.019444  17.866846
+2.042000  203.119454  18.744396
+2.043000  195.709383  18.335559
+2.044000  200.636982  18.546151
+2.045000  166.031667  16.818976
+2.046000  221.339891  19.509000
+2.047000  163.235232  16.720063
+2.048000  186.680528  17.790259
+2.049000  197.153120  18.470626
+2.050000  197.916744  18.405063
+2.051000  196.625097  18.387307
+2.052000  191.267284  18.160009
+2.053000  174.795582  17.364824
+2.054000  173.803734  17.319759
+2.055000  201.580833  18.549205
+2.056000  220.877498  19.526136
+2.057000  217.283012  19.373426
+2.058000  208.510816  18.940030
+2.059000  195.363292  18.323040
+2.060000  193.771121  18.190818
+2.061000  187.854830  17.925668
+2.062000  196.639214  18.437578
+2.063000  214.725884  19.194333
+2.064000  183.993157  17.755797
+2.065000  165.024452  16.817517
+2.066000  180.902119  17.670657
+2.067000  173.743765  17.316604
+2.068000  197.324972  18.386628
+2.069000  157.345224  16.398323
+2.070000  166.413822  16.905492
+2.071000  231.173974  19.937932
+2.072000  201.848792  18.590345
+2.073000  189.783192  18.069997
+2.074000  199.445482  18.550788
+2.075000  151.612529  16.115588
+2.076000  194.605018  18.255240
+2.077000  185.450698  17.845717
+2.078000  181.616940  17.687119
+2.079000  195.057207  18.313075
+2.080000  157.764064  16.391027
+2.081000  194.834115  18.307981
+2.082000  167.885769  16.968283
+2.083000  175.319319  17.344386
+2.084000  183.414582  17.756545
+2.085000  176.812788  17.378651
+2.086000  205.239774  18.866717
+2.087000  182.112883  17.733494
+2.088000  209.457656  18.943361
+2.089000  183.890356  17.768236
+2.090000  184.589904  17.824024
+2.091000  188.814569  18.032907
+2.092000  204.531808  18.801943
+2.093000  198.789250  18.521999
+2.094000  206.959167  18.859716
+2.095000  191.380064  18.112043
+2.096000  215.983379  19.278425
+2.097000  194.551496  18.274544
+2.098000  201.168037  18.589006
+2.099000  164.008384  16.761081
+2.100000  177.039449  17.446552
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+49.991000  84.414471  25.144190
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+49.993000  59.073526  21.114206
+49.994000  64.802935  22.557549
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diff --git a/tests/data/formats/real/FAP.XRA b/tests/data/formats/real/FAP.XRA
new file mode 100644
index 0000000..fb66435
--- /dev/null
+++ b/tests/data/formats/real/FAP.XRA
@@ -0,0 +1,578 @@
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+      91      64      89      64      88     120     143     167     241     249
+     248     172     139     117      89      88      88      95     109     121
+     138     142     179     142     112      95      90      84      91      91
+      96      83     124     145     182     206     189     164     121     113
+     118     106     136     131     133     174     227     346     404     454
+     392     274     230     148     144     106     103     120     137     159
+     186     221     194     197     149     118      85      80      65      77
+      78      92      84      91      98     139     166     168     215     185
+     147     129      96     109      76      76      94      92     109     105
+     150     141     135     125     117      99     102     132     124     178
+     188     238     223     169     154     118     116     119     137     137
+     179     216     271     349     304     258     216     178     221     242
+     290     307     396     365     431     557     701     833     746     592
+     371     253     263     239     205     241     256     270     319     357
+     419     387     327     242     188     141     117     134     151     147
+     211     258     337     422     384     344     272     224     213     176
+     209     242     342     499     685     748     679     539     402     294
+     200     196     215     200     208     238     314     320     389     325
+     228     168     138     122     117     115      94      87      76     105
+     101     101      90      97      83      70      76      90      78      82
+      83      87      99     139     156     160     184     143     126     114
+      70      84      71      90      99      96      93     112     119     126
+     117      94      89     101     106     111     122     149     187     244
+     344     343     309     207     170     145     121     106     102     121
+     108     123     149     186     193     170     145     124      98      99
+      85      96      82      84      79      85     107     101      97      91
+      77      69      67      84      66      71      73      70      83      78
+      94      95      90      86      71      66      57      69      80      76
+      85      85      71      81      90      85      62      74      70      79
+      80      74      78      84      87      93      92     106     104     113
+     107     121     124     147     151     225     323     469     736     753
+     699     518     366     241     247     206     241     293     349     476
+     557     585     580     476     422     297     236     256     216     192
+     188     216     225     279     303     293     244     231     207     172
+     185     193     227     267     393     465     510     456     366     266
+     222     209     169     150     130     152     164     179     227     321
+     328     294     250     180     143     130     139     113     103      94
+     102     106     106     101     109     120     153     136     148     136
+     143     169     189     228     309     389     664    1014    1271    1330
+    1056     779     496     330     286     229     222     210     256     269
+     379     527     698     649     602     464     298     185     167     146
+     126     123     124      94     112      96      75      79      70      66
+      67      79      71      74      86      44      67      85      58      67
+      59      66      65      84      85      92     120     138     127      97
+      78      90      93      77      81      86      71      70      88      83
+     107     103      99      95      92      79      72      72      80      71
+      47      64      69      77      67      74      68      58      59      60
+      72      69      56      60      62      59      62      55      63      57
+      59      59      52      58      48      66      67      64      58      62
+      58      58      55      63      59      63      67      66      50      65
+      54      65      68      85      78      80      98      84      94     113
+     123     181     200     342     429     457     418     285     217     166
+     140     143     133      95     113     115     152     161     224     268
+     275     235     196     140     114      90     100      96     107     113
+     127     168     226     291     294     234     179     126     103     103
+     105      95      86      90      79      96     127     150     168     140
+     136     105     103      86      88      74      66      72      67      71
+      74      78      78      92      88     102     116     135     165     140
+     124     104      93      74      88      83      91      83      94      86
+      81      88     110      83      92      96      85      63      77      67
+      63      76      61      74      69      51      79      68      69      63
+      51      62      62      61      65      65      69      65      69      89
+      67      70      55      63      66      66      88      83     116     151
+     130     124     114     112      74      71      79      71      65      65
+      71      81      70      91     107     123     123     104      87      97
+      73      89      89      90     108     135     138     115     107     102
+      77      82      64      61      60      72      73      65      78      72
+     107     112     104     109     102      77      68      49      52      63
+      55      66      61      65      60      57      64      64      55      60
+      53      43      52      70      55      52      58      58      83      56
+      58      49      46      73      59      60      66      55      65      61
+      67      54      73      58      62      58      71      69      49      67
+      76      87      76     100      90      96      79      75      85     110
+     122     139     184     211     203     197     146     128     129      86
+     104      94     103     114     105     134     161     187     257     236
+     177     186     159     130     134     150     146     190     242     240
+     258     245     216     201     185     165     157     153     128     147
+     186     249     312     465     511     564     462     343     259     185
+     149     139     136     141     139     147     157     159     254     232
+     347     358     404     377     363     340     285     223     196     213
+     263     305     336     337     312     251     211     228     238     268
+     280     260     256     222     209     199     203     210     243     216
+     258     218     235     227     307     417     466     468     354     341
+     204     155     128     144     127     123     118      96     111     124
+     183     190     234     249     231     162     139     140     107      87
+      89      98      75      92      74      71      86      64      65      78
+      68      65      75      76      87      78      79     100      89      85
+      77      95     105     116     116     158     195     248     235     233
+     172     139     125     114      94      81     117     106      92     114
+     109     138     149     194     246     313     343     438     444     443
+     354     295     243     224     195     207     146     137     111     141
+     142     129     182     210     235     246     234     208     187     159
+     155     133     144     130     105     101      98     101      76      89
+      80      85      97     102     108     112     115     146     173     255
+     302     462     468     392     337     271     182     168     128     127
+     138     118     134     127     139     127     192     204     255     295
+     280     268     215     218     210     218     271     366     427     376
+     362     275     189     178     136     139     119     153     159     153
+     180     279     310     343     431     399     359     290     221     178
+     151     118     124     116      93      97      99     121     139     161
+     159     178     160     147     122     115     113     120     125     145
+     179     212     198     188     180     128     102     108      92      74
+      78      80      77      81      85      95     100     122     135     152
+     121     159     169     165     157     193     183     175     134      91
+      99     101      90      83      74      70      65      73      74      90
+      76     112     107     110     127      95      87      68      69      83
+      74      74      84      75      77      60      80      71      75      77
+      56      63      58      69      65      58      68      65      73      55
+      52      73      65      71      91      69      62      72      57      90
+      68      71      61      73      64      79      80      80      82      65
+      77      81      86      87     105     120     119     159     161     166
+     187     174     176     172     226     325     446     501     545     439
+     362     255     195     172     146     148     150     153     161     161
+     137     154     169     214     254     289     325     315     257     240
+     202     206     193     185     135     140     125      85     101     106
+      91      95      91      96      90     102     112     124     128     158
+     161     161     146     189     178     185     212     290     371     544
+     660     671     631     520     351     265     198     171     138     146
+     138     147     123     152     145     164     216     251     313     418
+     403     335     312     215     180     143     159     136     124     164
+     122     162     173     237     310     414     573     541     503     374
+     268     230     185     150     142     123     116     139      99     133
+     133     146     161     215     273     289     310     314     229     148
+     146     121     107     113      82      74     104      88      85      89
+      81      79      86      60      81      86      81     117     135     125
+      98     118     108      92      77     110     106     140     147     222
+     234     231     227     166     157     104     117     114      87      92
+     100     110      92      89      88      96     104     124     129     155
+     162     150     168     133     174     195     215     256     286     222
+     184     140      99     113     105      88      96      85      93      94
+      82      93      93      99     121     121     146     126     165     130
+     114     109      81      86      85      69      57      87      62      54
+      66      68      52      64      66      60      70      66      69      64
+      70      66      69      53      80      74      63      63      44      71
+      74      55      64      62      59      69      75      65      65      70
+      81      70      76      72      75      72      83      84      71      77
+      65      59      68      67      70      54      70      61      71      72
+      64      85      84      75      86      66      80      99      83     100
+     111     131     167     184     199     180     147     138     112     101
+      98      96     120     133     142     192     219     202     173     150
+     151     115     184     118     128     150     128     129     111      88
+      86      82      91      97     134     129     127     140     147     123
+     143     167     188     209     189     177     153     123     108     103
+      90     108      99     111      94      80      83      91     101     101
+     119     108     128     121     133     139     115     124      96     107
+     105      77     114     114      90     103     123     117     141     133
+     132     151     202     247     325     394     516     524     582     623
+     587     524     369     313     236     181     168     164     148     129
+     132     134     130     152     208     223     269     328     337     363
+     380     327     373     352     328     240     188     187     155     108
+     106     105     100      92      80     109      88      90      76      91
+      91     101      98     117     141     129     119     134     113     118
+     133     127     122     123      97      79      89      84      70      76
+      76      68      76      92      65      62      77      67      90      95
+     119     147     154     144     133     119     104      76      90      94
+      86      82      89      68      77      74      88      72      85      82
+      87      90      74      96     100      92      95      79      86      94
+      96     100      99     103     135     166     190     224     228     203
+     202     135     128      96     112     103     102      97      88      75
+      85      92      85     116     131     153     175     252     249     303
+     248     225     194     110     122     104      92     104      90     109
+      98      97      82      98      94     120     140     132     165     182
+     187     167     139     137     121     100      80      90      82      94
+      92     101     117     146     156     138     135     109     107     110
+     109     107      86     100      92      69      77      82      62      84
+      90      80     117     100     112     111     132     131     131     120
+     133     161     196     246     300     288     237     232     191     170
+     137     124     109      98      99     113      97      96     100     110
+     106     102     114     125     165     219     223     258     269     269
+     244     269     242     194     192     175     167     183     194     263
+     345     430     534     592     538     457     344     283     244     178
+     170     187     196     162     154     177     176     152     153     148
+     188     198     207     254     283     329     301     290     238     210
+     153     136     131     127      96     109      95     106     109     105
+      79      96     102     115      92      91      98     111      77      70
+      88     108      90      97      92      90      82      74      68      81
+      86      85      91      84     105     104     125     174     203     225
+     216     230     189     159     147     134     135     159     190     183
+     147     170     116     140     130     104     118      94      93     115
+     133     146     157     176     162     148     126     129     123     128
+     119     168     178     206     217     237     222     224     189     173
+     184     128     126     108     104      71      87      70      95      94
+      91      68      80      69     105      89     109     128     147     143
+     152     150     122     118     132      94      94     108      88      90
+      77      76      74      72      75      69      72      63      75      67
+      74      59      69      73      76      76      75      78      52      68
+      83      78      88      73      79      78      61      68      57      66
+      72      64      61      64      60      60      76      72      72      75
+      68      85      87      95     122     118     152     149     129     131
+      87      90      65      74      74      93      74      82      86      85
+      71      84      86     114     130     157     171     176     163     144
+     139     111     117     111      99      99      87      68      73      96
+      74      75      90      63      86      75      58      94      85      81
+     119     118     119     101      99      87      76      75      87      70
+      76      56      58      65      68      73      69      58      56      60
+      72      71      70      69      56      75      62      68      64      68
+      68      70      73      86      78      83      79      83      72      81
+      69      73      59      72      59      97      76      96     100     126
+     156     152     160     172     156     155      84      91     101      94
+      94      78      78      79      78      64      78      82      66      77
+      82      67      84      83      97      93     108     111      90      90
+     119     103      94     104     100      78      89      75      72      82
+      65      56      82      67      69      62      85      67      74      59
+      66      56      76      60      60      80      75      67      80      86
+      87      85      83      65      65      88      65      68      78      68
+      89      61     102      77      90      71      73      62      80      86
+     101     110     108     143     198     190     201     186     218     176
+     145     136     135     114     110     119      88      88      77      85
+      88      87      80      71      84      90      87      78     108     121
+     107     120     137     144     160     145     139     128     115     124
+     154     163     164     199     210     227     221     207     161     163
+     150     143     148     153     166     208     232     280     285     289
+     240     238     186     161     131     131     120     132     144     160
+     154     180     150     163     156     148     150     147     162     131
+     142     160     170     183     191     199     200     184     185     165
+     119     117     136     105      85     113     117     114     119     110
+      92     108     121     130     154     180     194     240     280     245
+     264     302     287     219     174     164     167     139     109     103
+     111      99      97      97     105     102      94      96     123      93
+     108     101     132     151     172     157     193     212     230     212
+     199     176     144     127     101      91     110     107      81      78
+      94      85      82      78      92      81      76      80      79      86
+     101      76      73      81      81      89     109      93      79      83
+      66      83      79      97      68      71      71      68      77      67
+      84      78      92      79      83      80      76      71      77      75
+      70      64      84      79      91      81      82      96     111     142
+     119     137     148     114     128     112     103     106      84      84
+      87      96      89      84      79      94      99     105     118      95
+     103     116     134     146     173     234     240     300     303     285
+     308     279     275     256     277     277     238     235     194     206
+     181     185     138     158     144     161     210     220     232     260
+     251     212     184     191     207     196     198     225     199     180
+     208     200     190     223     224     238     243     251     300     333
+     318     310     294     239     206     213     200     216     191     184
+     167     137     114     109     102     112     118     112      98     110
+     119      86     126     120     117     121     136     149     184     168
+     168     152     147     154     116     114     104      97      99      89
+      82      87     106      78      89      87      88      76      78      77
+      86      88      95      85      88      77     100      68      71      62
+      60      73      71      72      73      61      77      71      76      71
+      74      81      59      68      68      69      93      57      71      78
+      86      63      78      77      84      85      78      98     100     105
+     102     135     144     165     202     212     221     196     188     157
+     140     114     110      95      90      96      90      82      82      84
+      84       0       0       0       0       0       0       0       0       0
diff --git a/tests/data/formats/real/bruker_absorber.brml b/tests/data/formats/real/bruker_absorber.brml
new file mode 100644
index 0000000..7c39456
Binary files /dev/null and b/tests/data/formats/real/bruker_absorber.brml differ
diff --git a/tests/data/formats/real/nist_srm660c_100a.cif b/tests/data/formats/real/nist_srm660c_100a.cif
new file mode 100644
index 0000000..3c0b1ed
--- /dev/null
+++ b/tests/data/formats/real/nist_srm660c_100a.cif
@@ -0,0 +1,10806 @@
+#
+data_diffrn_radiation_NIST_DBD_graphite_mono
+
+_diffrn_radiation_type                  'Cu K\a'
+_diffrn_radiation_monochromator         'post-specimen graphite analyzer'
+_diffrn_radiation_probe                 x-ray
+data_diffrn_detector_NIST_DBD_scint_graphite_mono
+
+_diffrn_detector                        'point detector'
+_diffrn_detector_type                   scintillator
+data_citation_NIST_DBD_graphite_mono
+
+loop_
+  _citation_id
+  _citation_title
+  _citation_journal_abbrev
+  _citation_year
+  _citation_doi
+  _citation_special_details
+         primary   'Certification of Standard Reference Material 660c for powder diffraction'     'Pow. Dif. J.'     2020     10.1017/S0885715620000068    
+; Primary paper on this SRM, 
+  describing data collection and analysis using Fundamental Parameters Approach
+  and Bruker AXS Topas software.
+
+Attached measured data are exactly the raw data sets used for certification. 
+
+However, the fits have been recomputed for the purposes of this data release. 
+The instrument parameters have been re-refined, and
+the calculated results field contain a pattern calculated from these new parameters.
+
+Note: Certain commercial equipment, instruments, software, or materials are identified in this file in order to specify the experimental procedure adequately. Such identification is not intended to imply recommendation or endorsement by the U.S. government, nor is it intended to imply that the materials or equipment identified are necessarily the best available for the purpose.
+
+;        
+         machine   
+; The Optics and Alignment of the Divergent Beam Laboratory 
+  X-ray Powder Diffractometer and its Calibration 
+  Using NIST Standard Reference Materials
+;        'J. Res. NIST'      2015      10.6028/jres.120.013          'Primary description of the use of the NIST DBD' 
+         machine_second_source         
+;  The optics and alignment of the divergent-beam laboratory X-ray powder diffractometer 
+   and its calibration using NIST standard reference materials
+;        'Intl. Tables for Cryst. Vol. H, Chapter 3.1'     2019      10.1107/97809553602060000115 'Alternative source for the description of the use of the NIST DBD'  
+         std_err_calc        
+; Poisson errors and adaptive rebinning in 
+  X-ray powder diffraction data
+;        'Pow. Diff.'        2018      10.1017/S0885715618000726     
+; Description of how the statistical weights are properly calculated in the data sets.
+  In particular, note that the statistical weight 1/sigma^2 is tau^2/(N+1),
+  where tau is the counting time, and N is the number of counts.
+;        
+         monochromators      
+; The optics of focusing bent-crystal monochromators 
+  on X-ray powder diffractometers
+     with application to lattice parameter determination 
+     and microstructure analysis
+;        'J. Appl. Cryst.'   2019      10.1107/S1600576719010951     
+; A variant of this method is used to correct the native Cu K\a spectrum for the 
+  narrowing effects of the graphite monochromator.  In these files,
+  the passband is taken to be Gaussian, with a width assumed to be roughly the mosaic angle, and an offset.
+  There is not an extra dispersion 
+  term due to the monochromator, since it is adjacent to the detector.
+; 
+data_cell_LaB6_660c
+
+_cell_length_a                          4.156780
+_cell_length_b                          4.156780
+_cell_length_c                          4.156780
+_cell_angle_alpha                       90.0
+_cell_angle_beta                        90.0
+_cell_angle_gamma                       90.0
+_cell_volume                            71.824243
+_symmetry_cell_setting                  cubic
+_symmetry_space_group_name_H-M          'P m 3 m'
+_chemical_formula_sum                   'B6 La'
+_chemical_formula_weight                204.959
+_cell_formula_units_Z                   1
+_diffrn_ambient_temperature             294.0
+loop_
+  _atom_site_type_symbol
+  _atom_site_label
+  _atom_site_fract_x
+  _atom_site_fract_y
+  _atom_site_fract_z
+  _atom_site_occupancy
+  _atom_site_thermal_displace_type
+  _atom_site_U_iso_or_equiv
+  _atom_site_symmetry_multiplicity
+         La        LA1       0.0       0.0       0.0       1.0       Uiso      0.0045   1        
+         B         B         0.198     0.5       0.5       1.0       Uiso      0.0035   6
+loop_
+  _atom_type_symbol
+  _atom_type_number_in_cell
+         La        1.0       
+         B         6.0 
+data_pd_spec_660_cert_cif_mosaic_consensus_100a
+
+_pd_spec_description                    660c
+_pd_spec_temperature                    20.85
+_pd_spec_vertical_displacement_mm       -0.07877
+data_pd_instr_660_cert_cif_mosaic_consensus_100a
+
+_pd_instr_monochr_post_spec             '26.6 degree graphite mosaic'
+_pd_instr_beam_size_ax                  15
+_pd_instr_beam_size_eq                  3.986
+_pd_instr_dist_spec/detc                217.5
+_pd_instr_divg_eq_mono/spec             1.05
+_pd_instr_geometry                      Bragg-Brentano
+_pd_instr_alpha_counts                  240.0
+_pd_instr_divg_ax_src/spec              6.776
+_pd_instr_divg_ax_spec/detc             6.776
+_pd_instr_source_size_ax                12
+_pd_instr_source_size_eq                0.04
+_pd_instr_slit_eq_spec/anal             0.2
+_pd_instr_mono_mosaic_offset            0.854
+data_pd_proc_660_cert_cif_mosaic_consensus_100a_meas
+
+_pd_block_id 
+                                        2020-10-28T20:48:40|660_cert_cif_mosaic_consensus_100a_meas|NIST|DBD
+_pd_proc_info_author_name               'NIST MML MMSD Cline/Mendenhall'
+_pd_proc_info_author_email              marcus.mendenhall@nist.gov
+_pd_phase_name                          'SRM 660c LaB6'
+_pd_proc_2theta_range_min               20.3001
+_pd_proc_2theta_range_max               150.9081
+_pd_proc_number_of_points               5332
+loop_
+  _pd_proc_2theta_corrected
+  _pd_proc_intensity_total
+  _pd_proc_ls_weight
+         20.300    19.00     1.03e-01  
+         20.310    10.50     1.81e-01  
+         20.320    12.00     1.60e-01  
+         20.330    18.50     1.05e-01  
+         20.340    17.00     1.14e-01  
+         20.350    9.50      1.99e-01  
+         20.360    14.50     1.33e-01  
+         20.370    14.50     1.33e-01  
+         20.380    11.00     1.74e-01  
+         20.390    11.00     1.74e-01  
+         20.400    8.50      2.22e-01  
+         20.410    10.00     1.91e-01  
+         20.420    13.00     1.48e-01  
+         20.430    14.00     1.38e-01  
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+data_pd_proc_660_cert_cif_mosaic_consensus_100a_calc
+
+_pd_block_id 
+                                        2020-10-28T20:48:40|660_cert_cif_mosaic_consensus_100a_calc|NIST|DBD
+_pd_proc_info_author_name               'NIST MML MMSD Cline/Mendenhall'
+_pd_proc_info_author_email              marcus.mendenhall@nist.gov
+_pd_phase_name                          'SRM 660c LaB6'
+_pd_proc_2theta_range_min               20.3001
+_pd_proc_2theta_range_max               150.9081
+_pd_proc_number_of_points               5332
+loop_
+  _pd_proc_2theta_corrected
+  _pd_proc_intensity_total
+  _pd_proc_ls_weight
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+         150.860   8.48      1.78e+00  
+         150.876   8.46      1.79e+00  
+         150.892   8.43      1.77e+00  
+         150.908   8.41      1.80e+00 
\ No newline at end of file
diff --git a/tests/data/formats/real/panalytical_attenuator.xrdml b/tests/data/formats/real/panalytical_attenuator.xrdml
new file mode 100644
index 0000000..3e48718
--- /dev/null
+++ b/tests/data/formats/real/panalytical_attenuator.xrdml
@@ -0,0 +1,128 @@
+<xrdMeasurements xmlns="http://www.xrdml.com/XRDMeasurement/2.1" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://www.xrdml.com/XRDMeasurement/2.1 http://www.xrdml.com/XRDMeasurement/2.1/XRDMeasurement.xsd" status="Completed">
+	<comment>
+		<entry>Configuration=Safe configuration, Owner=user, Creation date=14-Sep-09 9:17:06 AM</entry>
+		<entry>Goniometer=PW3050/65 (Theta/2Theta); Minimum step size 2Theta:0.0001; Minimum step size Omega:0.0001</entry>
+		<entry>Sample stage=MRD Cradle; Minimum step size Phi:0.01; Minimum step size Chi:0.01; Minimum step size X:0.01; Minimum step size Y:0.01; Minimum step size Z:0.001</entry>
+		<entry>Diffractometer system=XPERT-PRO</entry>
+		<entry>Measurement program=C:\PANalytical\Data Collector\Programs\Moritz_om2th_t.xrdmp, Identifier={928F8E65-EDCE-4496-861E-B4E25ADF243A}</entry>
+		<entry>Fine Calibration Offset for 2Theta = -0.0872 deg</entry>
+	</comment>
+	<sample type="To be analyzed">
+		<id></id>
+		<name></name>
+		<preparedBy></preparedBy>
+	</sample>
+	<xrdMeasurement measurementType="Scan" status="Completed" sampleMode="Reflection">
+		<comment>
+			<entry>m54313</entry>
+			<entry>PHD Lower Level = 5.63 (keV), PHD Upper Level = 12.87 (keV)</entry>
+		</comment>
+		<usedWavelength intended="K-Alpha">
+			<kAlpha1 unit="Angstrom">1.5405980</kAlpha1>
+			<kAlpha2 unit="Angstrom">1.5444260</kAlpha2>
+			<kBeta unit="Angstrom">1.3922500</kBeta>
+			<ratioKAlpha2KAlpha1>0.5000</ratioKAlpha2KAlpha1>
+		</usedWavelength>
+		<incidentBeamPath>
+			<radius unit="mm">320.00</radius>
+			<xRayTube id="1010048" name="Empyrean Cu LFF HR (9430 033 7310x) DK430398">
+				<tension unit="kV">40.0</tension>
+				<current unit="mA">40.0</current>
+				<anodeMaterial>Cu</anodeMaterial>
+				<focus type="Line">
+					<length unit="mm">12.0</length>
+					<width unit="mm">0.4</width>
+					<takeOffAngle unit="deg">4.2</takeOffAngle>
+				</focus>
+			</xRayTube>
+			<xRayMirror id="27090001" name="Inc. Beam Cu W/Si (hybrid MRD)" hybrid="true">
+				<crystal type="Graded" shape="Parabolic">W/Si</crystal>
+				<acceptanceAngle unit="deg">0.800</acceptanceAngle>
+				<length unit="mm">60.0</length>
+			</xRayMirror>
+			<monochromator id="23090002" name="Hybrid monochr. 2xGe(220) Cu asym." hybrid="true">
+				<crystal type="Asymmetric" shape="Flat">Ge</crystal>
+				<numberOfReflections>2</numberOfReflections>
+				<hkl>
+					<h>2</h>
+					<k>2</k>
+					<l>0</l>
+				</hkl>
+			</monochromator>
+			<sollerSlit id="21010002" name="Soller slits 0.04 rad.">
+				<opening unit="rad">0.0400</opening>
+			</sollerSlit>
+			<mask id="22030014" name="Fixed mask 1 mm  (rocking curve and triple axis)">
+				<width unit="mm">1.00</width>
+			</mask>
+			<divergenceSlit id="22010004" name="Fixed slit 1/2°" xsi:type="fixedDivergenceSlitType">
+				<distanceToSample unit="mm">220.00</distanceToSample>
+				<height unit="mm">0.76</height>
+			</divergenceSlit>
+			<beamAttenuator id="26010001" name="Progr. beam attenuator Ni 0.125 mm" xsi:type="intensitySwitchedBeamAttenuatorType">
+				<factor>188.00</factor>
+				<material>Ni</material>
+				<activateLevel unit="counts per second">500000</activateLevel>
+				<deactivateLevel unit="counts per second">400000</deactivateLevel>
+			</beamAttenuator>
+		</incidentBeamPath>
+		<sampleOffset>
+			<position axis="2Theta" unit="deg">0.0000</position>
+			<position axis="Omega" unit="deg">-0.2165</position>
+		</sampleOffset>
+		<diffractedBeamPath>
+			<radius unit="mm">320.00</radius>
+			<receivingSlit id="22020011" name="Fixed slit 1 mm (rocking curve and triple axis)">
+				<height unit="mm">1.00</height>
+			</receivingSlit>
+			<detector id="7010011" name="Proportional detector Xe" xsi:type="pointDetectorType">
+				<phd unit="%">
+					<lowerLevel>35.0</lowerLevel>
+					<upperLevel>80.0</upperLevel>
+				</phd>
+			</detector>
+		</diffractedBeamPath>
+		<scan appendNumber="0" mode="Continuous" scanAxis="2Theta-Omega" status="Completed">
+			<header>
+				<startTimeStamp>2022-09-26T17:05:54+02:00</startTimeStamp>
+				<endTimeStamp>2022-09-26T17:21:44+02:00</endTimeStamp>
+				<author>
+					<name>User</name>
+				</author>
+				<source>
+					<applicationSoftware version="6.1">Data Collector</applicationSoftware>
+					<instrumentControlSoftware version="2.2F 20161117">XPERT-PRO</instrumentControlSoftware>
+					<instrumentID>0000000000001263</instrumentID>
+				</source>
+			</header>
+			<dataPoints>
+				<positions axis="2Theta" unit="deg">
+					<startPosition>26.0250</startPosition>
+					<endPosition>79.9950</endPosition>
+				</positions>
+				<positions axis="Omega" unit="deg">
+					<startPosition>12.8560</startPosition>
+					<endPosition>39.8410</endPosition>
+				</positions>
+				<positions axis="Phi" unit="deg">
+					<commonPosition>0.00</commonPosition>
+				</positions>
+				<positions axis="Chi" unit="deg">
+					<commonPosition>0.00</commonPosition>
+				</positions>
+				<positions axis="X" unit="mm">
+					<commonPosition>-0.18</commonPosition>
+				</positions>
+				<positions axis="Y" unit="mm">
+					<commonPosition>-1.90</commonPosition>
+				</positions>
+				<positions axis="Z" unit="mm">
+					<commonPosition>6.317</commonPosition>
+				</positions>
+				<beamAttenuationFactors>1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 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1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 188.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00</beamAttenuationFactors>
+				<commonCountingTime unit="seconds">0.50</commonCountingTime>
+				<counts unit="counts">0 0 0 0 0 0 2 2 0 3 2 0 2 2 1 0 2 2 0 1 1 0 1 2 3 0 1 0 1 0 1 0 0 1 1 0 2 2 4 1 2 3 3 3 1 1 2 1 2 3 2 2 0 1 0 0 2 3 4 2 2 0 2 0 4 1 0 1 1 1 0 1 2 3 2 3 5 2 1 1 1 1 2 1 1 6 1 1 3 2 4 4 6 5 4 3 1 2 1 1 2 2 3 1 5 1 4 2 1 2 5 3 3 1 0 3 8 1 6 2 5 4 7 1 7 6 4 6 2 6 6 3 6 1 2 3 4 3 4 3 5 5 2 3 0 3 3 5 4 3 1 3 4 1 2 4 6 4 6 4 12 5 13 10 7 10 11 16 15 14 18 20 15 24 19 37 23 36 40 44 23 49 40 48 58 79 94 204 3347 8676 82 26 14 6 3 6 6 8 6 10 16 14 26 22 32 25 39 38 43 52 68 51 66 67 72 65 80 82 80 78 79 93 111 100 104 114 101 136 126 113 124 125 113 124 121 126 125 109 105 143 140 113 120 118 106 84 115 110 94 90 66 87 77 47 71 79 77 59 77 60 55 49 56 56 50 30 36 32 38 32 25 24 19 17 16 19 19 16 7 10 5 9 5 5 6 3 7 5 7 10 2 8 8 4 5 9 7 8 7 4 7 11 17 5 11 7 19 11 8 16 17 10 12 8 7 10 5 9 6 5 4 2 4 3 2 3 4 5 3 3 2 1 3 4 6 4 5 4 4 8 3 6 6 3 3 5 4 6 4 2 4 1 1 3 3 2 2 3 2 3 2 2 1 1 1 2 1 1 1 2 2 1 1 3 2 1 3 2 1 1 0 2 1 1 2 3 4 1 1 3 0 2 3 2 1 2 1 4 0 1 1 0 4 2 2 1 1 1 0 5 3 0 0 1 0 1 4 3 2 0 0 1 2 1 2 2 0 2 2 0 2 0 1 2 3 2 3 2 2 2 2 1 4 4 2 2 0 3 4 0 2 0 1 1 4 3 2 2 1 2 1 3 3 0 2 5 1 0 0 3 1 1 1 0 1 4 2 6 2 4 4 2 6 2 1 3 1 0 5 2 0 4 0 4 2 3 1 0 4 4 2 1 1 4 1 2 1 1 2 7 1 3 0 1 4 4 3 1 0 1 1 2 1 0 1 2 0 2 1 2 1 3 4 1 5 1 2 4 2 1 1 2 3 3 5 0 3 0 1 3 2 1 1 3 1 2 2 2 1 1 2 4 0 3 3 1 4 2 3 1 3 2 1 2 2 2 1 0 1 2 2 0 1 1 2 2 1 1 0 1 1 3 3 2 5 0 5 0 2 0 1 1 2 2 1 2 2 1 3 3 1 4 1 1 2 1 1 1 2 3 3 1 2 3 2 0 1 3 2 4 3 2 3 3 4 2 3 3 1 1 3 1 4 3 0 2 2 2 1 2 0 1 3 0 2 2 5 1 3 2 0 2 0 1 1 3 1 3 3 2 1 1 4 2 3 2 1 1 0 2 5 3 1 1 2 2 1 2 3 2 2 2 2 4 5 2 3 2 0 5 1 1 2 1 0 2 0 2 1 2 2 2 2 0 4 1 2 1 1 4 1 1 3 2 1 3 2 1 2 1 0 2 1 4 2 3 2 3 1 4 3 3 4 3 4 4 4 2 1 3 2 2 1 3 2 5 3 4 1 0 2 5 2 5 2 0 4 0 5 1 2 3 2 2 2 3 7 2 2 3 5 3 4 3 4 7 8 5 8 6 5 3 2 6 8 11 14 9 21 9 9 8 16 15 9 9 15 13 18 15 13 15 16 16 8 13 15 19 22 27 15 15 16 14 14 19 17 15 13 14 12 10 10 10 7 13 6 9 8 5 6 6 5 5 3 9 5 7 5 5 7 10 6 4 7 0 3 2 2 2 5 3 0 3 1 1 5 1 3 0 3 4 2 5 2 2 3 1 1 0 0 1 4 1 3 2 1 1 1 2 3 5 4 3 3 0 3 3 3 1 4 3 3 2 4 5 1 0 4 2 1 3 2 2 1 2 4 2 1 2 1 3 4 4 3 4 2 3 3 0 2 3 5 2 1 2 0 3 1 1 2 3 4 1 0 1 3 4 4 1 4 1 0 3 2 1 1 2 3 3 2 1 1 1 2 3 2 5 1 2 3 1 3 4 3 1 4 2 2 4 2 3 4 4 3 0 1 2 2 2 3 4 6 3 3 4 1 1 1 2 1 1 3 2 3 2 1 1 1 7 4 2 2 3 1 3 1 4 3 6 2 1 3 0 4 2 0 1 1 7 1 0 1 2 0 1 3 2 2 3 1 1 2 2 3 1 2 2 1 2 0 4 2 2 5 3 1 4 0 6 2 1 3 2 1 2 0 2 2 1 1 3 5 3 3 1 0 3 4 3 5 1 4 1 2 2 2 0 0 0 1 1 0 2 1 1 1 5 1 2 3 1 6 0 1 2 3 3 2 2 3 0 3 3 0 0 0 4 3 2 0 2 4 2 4 3 3 1 4 4 2 1 3 1 2 2 3 2 8 4 3 3 2 3 2 3 0 3 2 3 6 2 3 3 2 2 1 2 4 1 5 1 4 0 4 4 5 0 4 2 4 2 1 2 0 5 3 3 3 6 4 2 4 1 2 3 2 2 2 4 3 2 2 1 7 5 1 4 11 5 8 3 5 4 3 2 3 3 1 4 4 1 5 2 6 4 1 7 6 2 2 6 7 3 4 6 9 0 5 3 8 9 2 3 6 8 2 6 4 5 1 5 10 8 3 1 6 5 9 4 7 4 6 6 4 5 7 8 9 9 6 9 10 8 8 9 8 5 9 12 3 4 9 9 5 9 9 6 9 11 10 13 10 16 14 10 20 12 16 15 13 26 18 20 15 14 15 11 18 10 17 28 20 16 27 37 19 30 28 19 21 28 30 34 38 35 34 42 65 48 56 70 69 78 99 114 121 148 170 233 307 363 526 670 1341 14602 1877 13749 1667 537 263 217 150 119 108 89 78 63 60 49 53 47 43 31 43 27 31 28 24 25 18 29 31 20 16 23 21 22 22 19 22 25 20 30 21 23 20 31 20 23 20 13 22 20 18 13 13 14 19 12 18 16 19 19 6 13 8 10 11 8 15 9 11 11 12 17 15 17 16 13 16 19 16 13 23 23 33 22 32 25 24 27 40 43 37 53 47 41 55 46 48 47 48 55 57 43 56 46 59 45 74 46 46 37 46 40 45 42 34 36 38 36 47 39 31 33 30 28 23 24 30 19 17 32 20 17 21 14 17 12 17 17 14 16 14 8 6 10 7 7 6 7 5 9 7 7 1 6 4 4 5 9 5 3 3 1 4 3 3 4 2 4 2 4 3 3 1 4 6 3 0 1 1 3 2 1 1 1 0 3 4 1 2 1 2 3 2 4 2 6 1 5 7 2 3 2 3 1 2 2 4 7 5 1 1 2 3 5 4 2 1 5 2 3 2 5 1 3 0 2 2 2 2 2 3 3 0 1 4 0 3 1 2 2 5 5 4 3 4 0 1 4 3 4 0 2 1 1 2 4 2 3 1 3 0 3 1 0 1 1 1 0 2 0 2 2 1 0 2 1 3 1 0 2 0 0 2 0 1 1 5 0 0 2 1 0 1 0 4 3 0 0 2 1 0 0 4 0 2 2 1 1 1 4 1 1 1 3 1 2 2 1 3 2 2 0 2 2 0 3 0 0 3 1 1 0 0 2 1 2 0 1 0 0 2 2 3 6 1 0 1 1 2 1 2 2 3 5 3 1 2 0 0 2 2 1 2 1 2 1 2 2 0 1 1 0 0 3 1 1 1 1 1 2 3 0 1 0 1 3 1 0 1 4 1 0 3 0 2 4 2 3 1 0 2 3 4 1 2 3 0 5 1 0 2 1 1 1 3 1 1 1 0 2 0 1 1 1 1 3 2 1 1 1 1 0 1 0 0 1 0 1 0 0 2 3 1 0 1 3 2 1 1 2 0 1 1 0 2 1 2 4 2 2 0 2 1 0 2 0</counts>
+			</dataPoints>
+		</scan>
+	</xrdMeasurement>
+</xrdMeasurements>
diff --git a/tests/data/formats/real/panalytical_mesh.xrdml b/tests/data/formats/real/panalytical_mesh.xrdml
new file mode 100644
index 0000000..d9aed9c
--- /dev/null
+++ b/tests/data/formats/real/panalytical_mesh.xrdml
@@ -0,0 +1,5945 @@
+<xrdMeasurements xmlns="http://www.xrdml.com/XRDMeasurement/2.1" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://www.xrdml.com/XRDMeasurement/2.1 http://www.xrdml.com/XRDMeasurement/2.1/XRDMeasurement.xsd" status="Completed">
+	<comment>
+		<entry>Configuration=Factoryconfiguration, Owner=User-1, Creation date=5/27/2010 1:30:43 PM</entry>
+		<entry>Goniometer=PW3050/65 (Theta/2Theta); Minimum step size 2Theta:0.0001; Minimum step size Omega:0.0001</entry>
+		<entry>Sample stage=MRD Cradle; Minimum step size Phi:0.01; Minimum step size Chi:0.01; Minimum step size X:0.01; Minimum step size Y:0.01; Minimum step size Z:0.001</entry>
+		<entry>Diffractometer system=XPERT-PRO</entry>
+		<entry>Measurement program=C:\PANalytical\Data Collector\Programs\meshPIXCELstaticOB.xrdmp, Identifier={EEAD217F-2E02-4BCC-B10D-6A381801715F}</entry>
+		<entry>Fine Calibration Offset for 2Theta = -0.0447 deg</entry>
+		<entry>Fine Calibration Offset for Omega = 0.0003 deg</entry>
+	</comment>
+	<sample type="To be analyzed">
+		<id></id>
+		<name></name>
+		<preparedBy></preparedBy>
+	</sample>
+	<xrdMeasurement measurementType="Area measurement" status="Completed" measurementStepAxis="Omega" sampleMode="Reflection">
+		<comment>
+			<entry>2theta, omega</entry>
+			<entry>PHD Lower Level = 4.10 (keV), PHD Upper Level = 16.10 (keV)</entry>
+		</comment>
+		<usedWavelength intended="K-Alpha 1">
+			<kAlpha1 unit="Angstrom">1.5405980</kAlpha1>
+			<kAlpha2 unit="Angstrom">1.5444260</kAlpha2>
+			<kBeta unit="Angstrom">1.3922500</kBeta>
+			<ratioKAlpha2KAlpha1>0.5000</ratioKAlpha2KAlpha1>
+		</usedWavelength>
+		<incidentBeamPath>
+			<radius unit="mm">320.00</radius>
+			<xRayTube id="1010048" name="Empyrean Cu LFF HR (9430 033 7310x) DK421803">
+				<tension unit="kV">40.0</tension>
+				<current unit="mA">40.0</current>
+				<anodeMaterial>Cu</anodeMaterial>
+				<focus type="Line">
+					<length unit="mm">12.0</length>
+					<width unit="mm">0.4</width>
+					<takeOffAngle unit="deg">4.5</takeOffAngle>
+				</focus>
+			</xRayTube>
+			<xRayMirror id="27090001" name="Inc. Beam Cu W/Si (hybrid MRD)" hybrid="true">
+				<crystal type="Graded" shape="Parabolic">W/Si</crystal>
+				<acceptanceAngle unit="deg">0.800</acceptanceAngle>
+				<length unit="mm">60.0</length>
+			</xRayMirror>
+			<monochromator id="23090002" name="Hybrid monochr. 2xGe(220) Cu asym." hybrid="true">
+				<crystal type="Asymmetric" shape="Flat">Ge</crystal>
+				<numberOfReflections>2</numberOfReflections>
+				<hkl>
+					<h>2</h>
+					<k>2</k>
+					<l>0</l>
+				</hkl>
+			</monochromator>
+			<sollerSlit id="21010002" name="Soller slits 0.04 rad.">
+				<opening unit="rad">0.0400</opening>
+			</sollerSlit>
+			<mask id="22030008" name="Fixed mask 4 mm">
+				<width unit="mm">4.00</width>
+			</mask>
+			<divergenceSlit id="22010004" name="Fixed slit 1/2°" xsi:type="fixedDivergenceSlitType">
+				<distanceToSample unit="mm">220.00</distanceToSample>
+				<height unit="mm">0.76</height>
+			</divergenceSlit>
+		</incidentBeamPath>
+		<sampleOffset>
+			<position axis="2Theta" unit="deg">0.0000</position>
+			<position axis="Omega" unit="deg">-0.0090</position>
+			<position axis="Chi" unit="deg">-0.15</position>
+		</sampleOffset>
+		<diffractedBeamPath>
+			<radius unit="mm">320.00</radius>
+			<parallelPlateCollimator id="25010002" name="Parallel plate collimator 0.18°">
+				<opening unit="deg">0.18</opening>
+			</parallelPlateCollimator>
+			<detector id="7010015" name="PIXcel1D detector" xsi:type="rtmsDetectorType">
+				<phd unit="%">
+					<lowerLevel>25.5</lowerLevel>
+					<upperLevel>100.0</upperLevel>
+				</phd>
+				<mode>Static</mode>
+				<activeLength unit="deg">2.5108</activeLength>
+			</detector>
+		</diffractedBeamPath>
+		<measurementStepAxisCenter>
+			<position axis="Omega" unit="deg">61.4727</position>
+		</measurementStepAxisCenter>
+		<scan appendNumber="0" mode="Continuous" scanAxis="2Theta" status="Completed">
+			<header>
+				<startTimeStamp>2020-08-04T19:53:22+02:00</startTimeStamp>
+				<endTimeStamp>2020-08-04T20:00:55+02:00</endTimeStamp>
+				<author>
+					<name>User</name>
+				</author>
+				<source>
+					<applicationSoftware version="6.1">Data Collector</applicationSoftware>
+					<instrumentControlSoftware version="2.2F 20161117">XPERT-PRO</instrumentControlSoftware>
+					<instrumentID>0000000011073629</instrumentID>
+				</source>
+			</header>
+			<scanAxisCenter>
+				<position axis="2Theta" unit="deg">68.7010</position>
+			</scanAxisCenter>
+			<reflection>
+				<material>Ga2O3 (0 1 0)mon</material>
+				<hkl>
+					<h>-4</h>
+					<k>2</k>
+					<l>0</l>
+				</hkl>
+				<unitCell>
+					<alpha unit="deg">90.00000</alpha>
+					<beta unit="deg">103.83000</beta>
+					<gamma unit="deg">90.00000</gamma>
+					<a unit="Angstrom">12.21400</a>
+					<b unit="Angstrom">3.03710</b>
+					<c unit="Angstrom">5.79800</c>
+				</unitCell>
+			</reflection>
+			<dataPoints>
+				<positions axis="2Theta" unit="deg">
+					<listPositions>67.45053915 67.46038220 67.47022534 67.48006854 67.48991182 67.49975517 67.50959859 67.51944208 67.52928564 67.53912926 67.54897296 67.55881673 67.56866056 67.57850446 67.58834843 67.59819246 67.60803655 67.61788071 67.62772494 67.63756923 67.64741358 67.65725799 67.66710247 67.67694700 67.68679160 67.69663626 67.70648097 67.71632575 67.72617058 67.73601547 67.74586042 67.75570542 67.76555048 67.77539560 67.78524077 67.79508599 67.80493127 67.81477660 67.82462198 67.83446741 67.84431290 67.85415843 67.86400402 67.87384966 67.88369534 67.89354107 67.90338685 67.91323268 67.92307855 67.93292447 67.94277044 67.95261645 67.96246250 67.97230860 67.98215474 67.99200092 68.00184715 68.01169341 68.02153972 68.03138607 68.04123246 68.05107888 68.06092535 68.07077185 68.08061839 68.09046496 68.10031157 68.11015822 68.12000490 68.12985162 68.13969837 68.14954515 68.15939197 68.16923882 68.17908570 68.18893261 68.19877955 68.20862652 68.21847352 68.22832055 68.23816760 68.24801468 68.25786179 68.26770893 68.27755609 68.28740328 68.29725049 68.30709772 68.31694498 68.32679226 68.33663957 68.34648689 68.35633424 68.36618160 68.37602899 68.38587639 68.39572382 68.40557126 68.41541872 68.42526619 68.43511368 68.44496119 68.45480871 68.46465625 68.47450380 68.48435137 68.49419894 68.50404653 68.51389414 68.52374175 68.53358937 68.54343700 68.55328465 68.56313230 68.57297996 68.58282762 68.59267530 68.60252298 68.61237066 68.62221835 68.63206605 68.64191375 68.65176145 68.66160916 68.67145687 68.68130458 68.69115229 68.70100000 68.71084771 68.72069542 68.73054313 68.74039084 68.75023855 68.76008625 68.76993395 68.77978165 68.78962934 68.79947702 68.80932470 68.81917238 68.82902004 68.83886770 68.84871535 68.85856300 68.86841063 68.87825825 68.88810586 68.89795347 68.90780106 68.91764863 68.92749620 68.93734375 68.94719129 68.95703881 68.96688632 68.97673381 68.98658128 68.99642874 69.00627618 69.01612361 69.02597101 69.03581840 69.04566576 69.05551311 69.06536043 69.07520774 69.08505502 69.09490228 69.10474951 69.11459672 69.12444391 69.13429107 69.14413821 69.15398532 69.16383240 69.17367945 69.18352648 69.19337348 69.20322045 69.21306739 69.22291430 69.23276118 69.24260803 69.25245485 69.26230163 69.27214838 69.28199510 69.29184178 69.30168843 69.31153504 69.32138161 69.33122815 69.34107465 69.35092112 69.36076754 69.37061393 69.38046028 69.39030659 69.40015285 69.40999908 69.41984526 69.42969140 69.43953750 69.44938355 69.45922956 69.46907553 69.47892145 69.48876732 69.49861315 69.50845893 69.51830466 69.52815034 69.53799598 69.54784157 69.55768710 69.56753259 69.57737802 69.58722340 69.59706873 69.60691401 69.61675923 69.62660440 69.63644952 69.64629458 69.65613958 69.66598453 69.67582942 69.68567425 69.69551903 69.70536374 69.71520840 69.72505300 69.73489753 69.74474201 69.75458642 69.76443077 69.77427506 69.78411929 69.79396345 69.80380754 69.81365157 69.82349554 69.83333944 69.84318327 69.85302704 69.86287074 69.87271436 69.88255792 69.89240141 69.90224483 69.91208818 69.92193146 69.93177466 69.94161780 69.95146085</listPositions>
+				</positions>
+				<positions axis="Omega" unit="deg">
+					<commonPosition>60.9727</commonPosition>
+				</positions>
+				<positions axis="Phi" unit="deg">
+					<commonPosition>-101.32</commonPosition>
+				</positions>
+				<positions axis="Chi" unit="deg">
+					<commonPosition>0.00</commonPosition>
+				</positions>
+				<positions axis="X" unit="mm">
+					<commonPosition>-0.20</commonPosition>
+				</positions>
+				<positions axis="Y" unit="mm">
+					<commonPosition>0.97</commonPosition>
+				</positions>
+				<positions axis="Z" unit="mm">
+					<commonPosition>6.262</commonPosition>
+				</positions>
+				<commonCountingTime unit="seconds">358.920</commonCountingTime>
+				<counts unit="counts">41 34 44 36 39 36 44 45 32 37 51 30 42 47 51 47 36 45 40 46 45 40 41 40 58 48 41 53 39 49 64 55 47 61 39 53 58 61 52 60 38 49 57 53 73 65 68 55 54 61 64 54 73 49 64 73 51 54 50 49 57 63 62 58 56 61 60 39 43 53 33 44 44 38 39 45 50 42 40 31 46 36 40 38 46 29 33 43 35 32 43 41 35 38 38 38 33 26 34 35 34 35 34 27 36 47 41 29 32 41 30 34 36 34 30 29 53 37 42 35 50 33 40 37 27 36 41 39 47 53 37 37 48 32 40 51 32 33 43 30 57 44 40 32 33 40 49 45 47 40 47 38 52 45 42 38 44 52 27 40 50 39 42 44 44 43 44 46 40 36 47 43 63 51 40 41 49 37 34 38 52 46 39 45 41 39 41 46 36 33 54 47 51 43 41 50 34 27 54 42 39 31 40 50 24 46 41 40 29 44 43 31 33 38 34 29 44 32 30 36 37 40 42 22 31 33 42 32 36 33 24 29 24 32 32 29 27 31 27 21 42 18 20 21 33 29 22 25 19 25 32 19 25 23 26</counts>
+			</dataPoints>
+		</scan>
+		<scan appendNumber="0" mode="Continuous" scanAxis="2Theta" status="Completed">
+			<header>
+				<startTimeStamp>2020-08-04T20:01:00+02:00</startTimeStamp>
+				<endTimeStamp>2020-08-04T20:08:33+02:00</endTimeStamp>
+				<author>
+					<name>User</name>
+				</author>
+				<source>
+					<applicationSoftware version="6.1">Data Collector</applicationSoftware>
+					<instrumentControlSoftware version="2.2F 20161117">XPERT-PRO</instrumentControlSoftware>
+					<instrumentID>0000000011073629</instrumentID>
+				</source>
+			</header>
+			<scanAxisCenter>
+				<position axis="2Theta" unit="deg">68.7010</position>
+			</scanAxisCenter>
+			<reflection>
+				<material>Ga2O3 (0 1 0)mon</material>
+				<hkl>
+					<h>-4</h>
+					<k>2</k>
+					<l>0</l>
+				</hkl>
+				<unitCell>
+					<alpha unit="deg">90.00000</alpha>
+					<beta unit="deg">103.83000</beta>
+					<gamma unit="deg">90.00000</gamma>
+					<a unit="Angstrom">12.21400</a>
+					<b unit="Angstrom">3.03710</b>
+					<c unit="Angstrom">5.79800</c>
+				</unitCell>
+			</reflection>
+			<dataPoints>
+				<positions axis="2Theta" unit="deg">
+					<listPositions>67.45053915 67.46038220 67.47022534 67.48006854 67.48991182 67.49975517 67.50959859 67.51944208 67.52928564 67.53912926 67.54897296 67.55881673 67.56866056 67.57850446 67.58834843 67.59819246 67.60803655 67.61788071 67.62772494 67.63756923 67.64741358 67.65725799 67.66710247 67.67694700 67.68679160 67.69663626 67.70648097 67.71632575 67.72617058 67.73601547 67.74586042 67.75570542 67.76555048 67.77539560 67.78524077 67.79508599 67.80493127 67.81477660 67.82462198 67.83446741 67.84431290 67.85415843 67.86400402 67.87384966 67.88369534 67.89354107 67.90338685 67.91323268 67.92307855 67.93292447 67.94277044 67.95261645 67.96246250 67.97230860 67.98215474 67.99200092 68.00184715 68.01169341 68.02153972 68.03138607 68.04123246 68.05107888 68.06092535 68.07077185 68.08061839 68.09046496 68.10031157 68.11015822 68.12000490 68.12985162 68.13969837 68.14954515 68.15939197 68.16923882 68.17908570 68.18893261 68.19877955 68.20862652 68.21847352 68.22832055 68.23816760 68.24801468 68.25786179 68.26770893 68.27755609 68.28740328 68.29725049 68.30709772 68.31694498 68.32679226 68.33663957 68.34648689 68.35633424 68.36618160 68.37602899 68.38587639 68.39572382 68.40557126 68.41541872 68.42526619 68.43511368 68.44496119 68.45480871 68.46465625 68.47450380 68.48435137 68.49419894 68.50404653 68.51389414 68.52374175 68.53358937 68.54343700 68.55328465 68.56313230 68.57297996 68.58282762 68.59267530 68.60252298 68.61237066 68.62221835 68.63206605 68.64191375 68.65176145 68.66160916 68.67145687 68.68130458 68.69115229 68.70100000 68.71084771 68.72069542 68.73054313 68.74039084 68.75023855 68.76008625 68.76993395 68.77978165 68.78962934 68.79947702 68.80932470 68.81917238 68.82902004 68.83886770 68.84871535 68.85856300 68.86841063 68.87825825 68.88810586 68.89795347 68.90780106 68.91764863 68.92749620 68.93734375 68.94719129 68.95703881 68.96688632 68.97673381 68.98658128 68.99642874 69.00627618 69.01612361 69.02597101 69.03581840 69.04566576 69.05551311 69.06536043 69.07520774 69.08505502 69.09490228 69.10474951 69.11459672 69.12444391 69.13429107 69.14413821 69.15398532 69.16383240 69.17367945 69.18352648 69.19337348 69.20322045 69.21306739 69.22291430 69.23276118 69.24260803 69.25245485 69.26230163 69.27214838 69.28199510 69.29184178 69.30168843 69.31153504 69.32138161 69.33122815 69.34107465 69.35092112 69.36076754 69.37061393 69.38046028 69.39030659 69.40015285 69.40999908 69.41984526 69.42969140 69.43953750 69.44938355 69.45922956 69.46907553 69.47892145 69.48876732 69.49861315 69.50845893 69.51830466 69.52815034 69.53799598 69.54784157 69.55768710 69.56753259 69.57737802 69.58722340 69.59706873 69.60691401 69.61675923 69.62660440 69.63644952 69.64629458 69.65613958 69.66598453 69.67582942 69.68567425 69.69551903 69.70536374 69.71520840 69.72505300 69.73489753 69.74474201 69.75458642 69.76443077 69.77427506 69.78411929 69.79396345 69.80380754 69.81365157 69.82349554 69.83333944 69.84318327 69.85302704 69.86287074 69.87271436 69.88255792 69.89240141 69.90224483 69.91208818 69.92193146 69.93177466 69.94161780 69.95146085</listPositions>
+				</positions>
+				<positions axis="Omega" unit="deg">
+					<commonPosition>60.9827</commonPosition>
+				</positions>
+				<positions axis="Phi" unit="deg">
+					<commonPosition>-101.32</commonPosition>
+				</positions>
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+				<author>
+					<name>User</name>
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+				</source>
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+				<material>Ga2O3 (0 1 0)mon</material>
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+				<positions axis="Phi" unit="deg">
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+				<positions axis="Chi" unit="deg">
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+				</positions>
+				<positions axis="X" unit="mm">
+					<commonPosition>-0.20</commonPosition>
+				</positions>
+				<positions axis="Y" unit="mm">
+					<commonPosition>0.97</commonPosition>
+				</positions>
+				<positions axis="Z" unit="mm">
+					<commonPosition>6.262</commonPosition>
+				</positions>
+				<commonCountingTime unit="seconds">358.920</commonCountingTime>
+				<counts unit="counts">39 35 29 29 28 24 27 25 28 28 23 25 24 15 46 41 34 34 31 28 49 34 31 28 29 28 22 28 31 30 19 31 25 38 36 33 33 35 32 38 27 40 33 42 30 34 30 36 26 27 41 36 30 45 47 35 46 40 42 41 36 43 40 43 57 56 50 43 55 50 54 40 45 58 62 48 42 67 66 58 75 69 59 75 64 86 62 72 92 87 78 90 93 101 99 94 107 108 99 108 108 119 142 125 146 140 146 165 162 182 180 165 197 216 225 206 241 218 252 241 282 273 303 303 290 335 338 340 359 317 335 339 347 336 335 283 305 304 309 304 304 280 262 291 270 267 265 265 226 239 225 232 236 215 200 213 220 203 205 186 181 188 171 168 168 190 183 179 179 152 156 185 159 191 183 187 158 218 194 197 210 229 234 230 290 264 285 305 311 387 456 499 529 562 644 691 727 870 863 936 960 912 871 806 779 752 638 647 623 786 1288 1781 971 522 361 270 252 228 193 195 191 152 157 155 127 128 145 108 115 93 115 82 86 79 80 71 75 82 85 71 72 79 72 67 53 45 66 44 55 53 49 51 48 54 48</counts>
+			</dataPoints>
+		</scan>
+	</xrdMeasurement>
+</xrdMeasurements>
diff --git a/tests/data/formats/real/rigaku_nims.ras b/tests/data/formats/real/rigaku_nims.ras
new file mode 100644
index 0000000..1cab5e1
--- /dev/null
+++ b/tests/data/formats/real/rigaku_nims.ras
@@ -0,0 +1,3974 @@
+*RAS_DATA_START
+*RAS_HEADER_START
+*DISP_LINE_COLOR "4294901760"
+*FILE_COMMENT "XRD example"
+*FILE_MD5 ""
+*FILE_MEMO "Rigaku XRD memo"
+*FILE_OPERATOR "English"
+*FILE_PACKAGE_NAME ""
+*FILE_PART_ID "GeneralMeasurement(BB)"
+*FILE_SAMPLE "Test Sample"
+*FILE_TYPE "RAS_RAW"
+*FILE_USERGROUP "Academic"
+*FILE_VERSION "1"
+*HW_ATTACHMENT_ID "ATT0033"
+*HW_ATTACHMENT_NAME "ASC6_Reflection"
+*HW_COUNTER_ID-0 "CUT0041"
+*HW_COUNTER_ID-2 "CMC0020"
+*HW_COUNTER_NAME-0 "DteX250(H)"
+*HW_COUNTER_NAME-2 "None"
+*HW_COUNTER_PIXEL_SIZE "0.075"
+*HW_COUNTER_SELECT_NAME "DteX250(H)"
+*HW_GONIOMETER_ID "GON0021"
+*HW_GONIOMETER_NAME "Standard"
+*HW_GONIOMETER_RADIUS-0 "90.0"
+*HW_GONIOMETER_RADIUS-1 "114.0"
+*HW_GONIOMETER_RADIUS-2 "190.0"
+*HW_GONIOMETER_RADIUS-3 "300.0"
+*HW_GONIOMETER_RADIUS-4 "187.0"
+*HW_GONIOMETER_RADIUS-5 "300.0"
+*HW_GONIOMETER_RADIUS-6 "113.0"
+*HW_GONIOMETER_RADIUS-7 "331.0"
+*HW_I_OPT_ID-1 "CBO0029"
+*HW_I_OPT_ID-2 "ISL0021"
+*HW_R_ATTENUATER_AUTOMODE "0"
+*HW_R_OPT_ID-0 "RSS0022"
+*HW_R_OPT_ID-1 "RCR0023"
+*HW_R_OPT_ID-2 "RSO0021"
+*HW_R_OPT_ID-3 "RRS0022"
+*HW_R_OPT_ID-4 "ATN0021"
+*HW_SAMPLE_HOLDER_ID "SMP0023"
+*HW_SAMPLE_HOLDER_NAME "Z"
+*HW_XG_CURRENT_UNIT "mA"
+*HW_XG_FOCUS "0.4mm x 8mm"
+*HW_XG_FOCUS_TYPE "Fine"
+*HW_XG_TARGET_ATOMIC_NUMBER "29"
+*HW_XG_TARGET_NAME "Cu"
+*HW_XG_TYPE "Hermetic"
+*HW_XG_VOLTAGE_UNIT "kV"
+*HW_XG_WAVE_LENGTH_ALPHA1 "1.540593"
+*HW_XG_WAVE_LENGTH_ALPHA2 "1.544414"
+*HW_XG_WAVE_LENGTH_BETA "1.392246"
+*HW_XG_WAVE_LENGTH_UNIT "Angstrom"
+*MEAS_COND_AXIS_NAME_INTERNAL-0 "ThetaS"
+*MEAS_COND_AXIS_NAME_INTERNAL-1 "ThetaD"
+*MEAS_COND_AXIS_NAME_INTERNAL-10 "CBO-M"
+*MEAS_COND_AXIS_NAME_INTERNAL-11 "CBO"
+*MEAS_COND_AXIS_NAME_INTERNAL-12 "IncidentSollerSlit"
+*MEAS_COND_AXIS_NAME_INTERNAL-13 "IncidentSlitBox"
+*MEAS_COND_AXIS_NAME_INTERNAL-14 "IncidentSlitBox"
+*MEAS_COND_AXIS_NAME_INTERNAL-15 "IncidentSlitBox"
+*MEAS_COND_AXIS_NAME_INTERNAL-16 "Zs"
+*MEAS_COND_AXIS_NAME_INTERNAL-17 "IncidentAxdSlit"
+*MEAS_COND_AXIS_NAME_INTERNAL-18 "IncidentAxdSlit"
+*MEAS_COND_AXIS_NAME_INTERNAL-19 "IncidentAxdSlit"
+*MEAS_COND_AXIS_NAME_INTERNAL-2 "TwoTheta"
+*MEAS_COND_AXIS_NAME_INTERNAL-20 "Z"
+*MEAS_COND_AXIS_NAME_INTERNAL-21 "DirectBeamStop"
+*MEAS_COND_AXIS_NAME_INTERNAL-22 "KnifeEdge"
+*MEAS_COND_AXIS_NAME_INTERNAL-23 "Beta"
+*MEAS_COND_AXIS_NAME_INTERNAL-24 "Changer"
+*MEAS_COND_AXIS_NAME_INTERNAL-25 "ReceivingSlitBox1"
+*MEAS_COND_AXIS_NAME_INTERNAL-26 "ReceivingSlitBox1"
+*MEAS_COND_AXIS_NAME_INTERNAL-27 "ReceivingSlitBox1"
+*MEAS_COND_AXIS_NAME_INTERNAL-28 "Zr"
+*MEAS_COND_AXIS_NAME_INTERNAL-29 "ReceivingAxdSlit"
+*MEAS_COND_AXIS_NAME_INTERNAL-3 "Omega"
+*MEAS_COND_AXIS_NAME_INTERNAL-30 "ReceivingAxdSlit"
+*MEAS_COND_AXIS_NAME_INTERNAL-31 "ReceivingSollerSlit"
+*MEAS_COND_AXIS_NAME_INTERNAL-32 "ReceivingSlitBox2"
+*MEAS_COND_AXIS_NAME_INTERNAL-33 "ReceivingSlitBox2"
+*MEAS_COND_AXIS_NAME_INTERNAL-34 "ReceivingSlitBox2"
+*MEAS_COND_AXIS_NAME_INTERNAL-35 "Attenuator"
+*MEAS_COND_AXIS_NAME_INTERNAL-36 "PHA"
+*MEAS_COND_AXIS_NAME_INTERNAL-37 "Target_TargetTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-38 "Target_XrayOnTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-39 "Target_TMPTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-4 "TwoThetaTheta"
+*MEAS_COND_AXIS_NAME_INTERNAL-40 "Target_RPTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-41 "Target_FilamentTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-42 "Target_IG"
+*MEAS_COND_AXIS_NAME_INTERNAL-43 "Target_GP"
+*MEAS_COND_AXIS_NAME_INTERNAL-44 "Target_FC"
+*MEAS_COND_AXIS_NAME_INTERNAL-45 "HVPS_HVPSTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-46 "HVPS_Type1Time"
+*MEAS_COND_AXIS_NAME_INTERNAL-47 "HVPS_Type2Time"
+*MEAS_COND_AXIS_NAME_INTERNAL-48 "HVPS_Type3Time"
+*MEAS_COND_AXIS_NAME_INTERNAL-49 "CW_IERTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-5 "TwoThetaOmega"
+*MEAS_COND_AXIS_NAME_INTERNAL-50 "CW_ECTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-51 "CW_Flow1"
+*MEAS_COND_AXIS_NAME_INTERNAL-52 "CW_Temperature1"
+*MEAS_COND_AXIS_NAME_INTERNAL-53 "CW_Pressure1"
+*MEAS_COND_AXIS_NAME_INTERNAL-54 "CW_PressureIn"
+*MEAS_COND_AXIS_NAME_INTERNAL-55 "CW_PressureOut"
+*MEAS_COND_AXIS_NAME_INTERNAL-56 "CW_Flow2"
+*MEAS_COND_AXIS_NAME_INTERNAL-57 "CW_Temperature2"
+*MEAS_COND_AXIS_NAME_INTERNAL-58 "CW_Pressure2"
+*MEAS_COND_AXIS_NAME_INTERNAL-59 "RE_EnclosureTemp"
+*MEAS_COND_AXIS_NAME_INTERNAL-6 "OmegaTwoTheta"
+*MEAS_COND_AXIS_NAME_INTERNAL-60 "RE_EnclosureHummidity"
+*MEAS_COND_AXIS_NAME_INTERNAL-61 "RE_CabinetTemp"
+*MEAS_COND_AXIS_NAME_INTERNAL-62 "RE_RPTemp"
+*MEAS_COND_AXIS_NAME_INTERNAL-63 "RE_ShutterAXrayOnTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-64 "RE_ShutterATimes"
+*MEAS_COND_AXIS_NAME_INTERNAL-65 "RE_ShutterAOpenCloseTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-66 "RE_ShutterACloseOpenTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-67 "RE_ShutterBXrayOnTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-68 "RE_ShutterBTimes"
+*MEAS_COND_AXIS_NAME_INTERNAL-69 "RE_ShutterBOpenCloseTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-7 "Ts"
+*MEAS_COND_AXIS_NAME_INTERNAL-70 "RE_ShutterBCloseOpenTime"
+*MEAS_COND_AXIS_NAME_INTERNAL-71 "RE_XrayWarningRamp"
+*MEAS_COND_AXIS_NAME_INTERNAL-72 "RE_ShutterAInstallation"
+*MEAS_COND_AXIS_NAME_INTERNAL-73 "RE_ShutterARamp"
+*MEAS_COND_AXIS_NAME_INTERNAL-74 "RE_ShutterBInstallation"
+*MEAS_COND_AXIS_NAME_INTERNAL-75 "RE_ShutterBRamp"
+*MEAS_COND_AXIS_NAME_INTERNAL-76 "RE_ExtShutterCLS"
+*MEAS_COND_AXIS_NAME_INTERNAL-77 "RE_ExtXrayOFF"
+*MEAS_COND_AXIS_NAME_INTERNAL-78 "RE_ExtSafetyCircuit"
+*MEAS_COND_AXIS_NAME_INTERNAL-79 "Version_CPU"
+*MEAS_COND_AXIS_NAME_INTERNAL-8 "PrimaryGeometry"
+*MEAS_COND_AXIS_NAME_INTERNAL-80 "Version_RS1"
+*MEAS_COND_AXIS_NAME_INTERNAL-81 "Version_RS2"
+*MEAS_COND_AXIS_NAME_INTERNAL-82 "Version_HV"
+*MEAS_COND_AXIS_NAME_INTERNAL-83 "Version_CW"
+*MEAS_COND_AXIS_NAME_INTERNAL-84 "Version_RT"
+*MEAS_COND_AXIS_NAME_INTERNAL-85 "IncidentPrimary"
+*MEAS_COND_AXIS_NAME_INTERNAL-86 "IncidentMonochromator"
+*MEAS_COND_AXIS_NAME_INTERNAL-87 "ReceivingOptics"
+*MEAS_COND_AXIS_NAME_INTERNAL-88 "CounterMonochromatorKind"
+*MEAS_COND_AXIS_NAME_INTERNAL-9 "PrimaryMirrorType"
+*MEAS_COND_AXIS_NAME-0 "ThetaS"
+*MEAS_COND_AXIS_NAME-1 "ThetaD"
+*MEAS_COND_AXIS_NAME-10 "CBO-M"
+*MEAS_COND_AXIS_NAME-11 "CBO"
+*MEAS_COND_AXIS_NAME-12 "IncidentSollerSlit"
+*MEAS_COND_AXIS_NAME-13 "IncidentSlitBox"
+*MEAS_COND_AXIS_NAME-14 "IncidentSlitBox-_Axis"
+*MEAS_COND_AXIS_NAME-15 "SlitDS"
+*MEAS_COND_AXIS_NAME-16 "Zs"
+*MEAS_COND_AXIS_NAME-17 "IncidentAxdSlit"
+*MEAS_COND_AXIS_NAME-18 "LLS"
+*MEAS_COND_AXIS_NAME-19 "DHLSlit"
+*MEAS_COND_AXIS_NAME-2 "TwoTheta"
+*MEAS_COND_AXIS_NAME-20 "Z"
+*MEAS_COND_AXIS_NAME-21 "DirectBeamStop"
+*MEAS_COND_AXIS_NAME-22 "KnifeEdge"
+*MEAS_COND_AXIS_NAME-23 "Beta"
+*MEAS_COND_AXIS_NAME-24 "Changer"
+*MEAS_COND_AXIS_NAME-25 "ReceivingSlitBox1"
+*MEAS_COND_AXIS_NAME-26 "ReceivingSlitBox1-_Axis"
+*MEAS_COND_AXIS_NAME-27 "SlitSS"
+*MEAS_COND_AXIS_NAME-28 "Zr"
+*MEAS_COND_AXIS_NAME-29 "ReceivingAxdSlit"
+*MEAS_COND_AXIS_NAME-3 "Omega"
+*MEAS_COND_AXIS_NAME-30 "Filter"
+*MEAS_COND_AXIS_NAME-31 "ReceivingSollerSlit"
+*MEAS_COND_AXIS_NAME-32 "ReceivingSlitBox2"
+*MEAS_COND_AXIS_NAME-33 "ReceivingSlitBox2-_Axis"
+*MEAS_COND_AXIS_NAME-34 "SlitRS"
+*MEAS_COND_AXIS_NAME-35 "Attenuator"
+*MEAS_COND_AXIS_NAME-36 "PHA"
+*MEAS_COND_AXIS_NAME-37 "Target_TargetTime"
+*MEAS_COND_AXIS_NAME-38 "Target_XrayOnTime"
+*MEAS_COND_AXIS_NAME-39 "Target_TMPTime"
+*MEAS_COND_AXIS_NAME-4 "TwoThetaTheta"
+*MEAS_COND_AXIS_NAME-40 "Target_RPTime"
+*MEAS_COND_AXIS_NAME-41 "Target_FilamentTime"
+*MEAS_COND_AXIS_NAME-42 "Target_IG"
+*MEAS_COND_AXIS_NAME-43 "Target_GP"
+*MEAS_COND_AXIS_NAME-44 "Target_FC"
+*MEAS_COND_AXIS_NAME-45 "HVPS_HVPSTime"
+*MEAS_COND_AXIS_NAME-46 "HVPS_Type1Time"
+*MEAS_COND_AXIS_NAME-47 "HVPS_Type2Time"
+*MEAS_COND_AXIS_NAME-48 "HVPS_Type3Time"
+*MEAS_COND_AXIS_NAME-49 "CW_IERTime"
+*MEAS_COND_AXIS_NAME-5 "TwoThetaOmega"
+*MEAS_COND_AXIS_NAME-50 "CW_ECTime"
+*MEAS_COND_AXIS_NAME-51 "CW_Flow1"
+*MEAS_COND_AXIS_NAME-52 "CW_Temperature1"
+*MEAS_COND_AXIS_NAME-53 "CW_Pressure1"
+*MEAS_COND_AXIS_NAME-54 "CW_PressureIn"
+*MEAS_COND_AXIS_NAME-55 "CW_PressureOut"
+*MEAS_COND_AXIS_NAME-56 "CW_Flow2"
+*MEAS_COND_AXIS_NAME-57 "CW_Temperature2"
+*MEAS_COND_AXIS_NAME-58 "CW_Pressure2"
+*MEAS_COND_AXIS_NAME-59 "RE_EnclosureTemp"
+*MEAS_COND_AXIS_NAME-6 "OmegaTwoTheta"
+*MEAS_COND_AXIS_NAME-60 "RE_EnclosureHummidity"
+*MEAS_COND_AXIS_NAME-61 "RE_CabinetTemp"
+*MEAS_COND_AXIS_NAME-62 "RE_RPTemp"
+*MEAS_COND_AXIS_NAME-63 "RE_ShutterAXrayOnTime"
+*MEAS_COND_AXIS_NAME-64 "RE_ShutterATimes"
+*MEAS_COND_AXIS_NAME-65 "RE_ShutterAOpenCloseTime"
+*MEAS_COND_AXIS_NAME-66 "RE_ShutterACloseOpenTime"
+*MEAS_COND_AXIS_NAME-67 "RE_ShutterBXrayOnTime"
+*MEAS_COND_AXIS_NAME-68 "RE_ShutterBTimes"
+*MEAS_COND_AXIS_NAME-69 "RE_ShutterBOpenCloseTime"
+*MEAS_COND_AXIS_NAME-7 "Ts"
+*MEAS_COND_AXIS_NAME-70 "RE_ShutterBCloseOpenTime"
+*MEAS_COND_AXIS_NAME-71 "RE_XrayWarningRamp"
+*MEAS_COND_AXIS_NAME-72 "RE_ShutterAInstallation"
+*MEAS_COND_AXIS_NAME-73 "RE_ShutterARamp"
+*MEAS_COND_AXIS_NAME-74 "RE_ShutterBInstallation"
+*MEAS_COND_AXIS_NAME-75 "RE_ShutterBRamp"
+*MEAS_COND_AXIS_NAME-76 "RE_ExtShutterCLS"
+*MEAS_COND_AXIS_NAME-77 "RE_ExtXrayOFF"
+*MEAS_COND_AXIS_NAME-78 "RE_ExtSafetyCircuit"
+*MEAS_COND_AXIS_NAME-79 "Version_CPU"
+*MEAS_COND_AXIS_NAME-8 "PrimaryGeometry"
+*MEAS_COND_AXIS_NAME-80 "Version_RS1"
+*MEAS_COND_AXIS_NAME-81 "Version_RS2"
+*MEAS_COND_AXIS_NAME-82 "Version_HV"
+*MEAS_COND_AXIS_NAME-83 "Version_CW"
+*MEAS_COND_AXIS_NAME-84 "Version_RT"
+*MEAS_COND_AXIS_NAME-85 "IncidentPrimary"
+*MEAS_COND_AXIS_NAME-86 "IncidentMonochromator"
+*MEAS_COND_AXIS_NAME-87 "ReceivingOptics"
+*MEAS_COND_AXIS_NAME-88 "CounterMonochromatorKind"
+*MEAS_COND_AXIS_NAME-9 "PrimaryMirrorType"
+*MEAS_COND_AXIS_OFFSET-0 "0.8349"
+*MEAS_COND_AXIS_OFFSET-1 "0.2882"
+*MEAS_COND_AXIS_OFFSET-10 "0"
+*MEAS_COND_AXIS_OFFSET-11 "0"
+*MEAS_COND_AXIS_OFFSET-12 "0"
+*MEAS_COND_AXIS_OFFSET-13 "0"
+*MEAS_COND_AXIS_OFFSET-14 "0"
+*MEAS_COND_AXIS_OFFSET-15 "0"
+*MEAS_COND_AXIS_OFFSET-16 "0"
+*MEAS_COND_AXIS_OFFSET-17 "0"
+*MEAS_COND_AXIS_OFFSET-18 "0"
+*MEAS_COND_AXIS_OFFSET-19 "0"
+*MEAS_COND_AXIS_OFFSET-2 "1.1231"
+*MEAS_COND_AXIS_OFFSET-20 "0"
+*MEAS_COND_AXIS_OFFSET-21 "0"
+*MEAS_COND_AXIS_OFFSET-22 "0"
+*MEAS_COND_AXIS_OFFSET-23 "0"
+*MEAS_COND_AXIS_OFFSET-24 "0"
+*MEAS_COND_AXIS_OFFSET-25 "0"
+*MEAS_COND_AXIS_OFFSET-26 "0"
+*MEAS_COND_AXIS_OFFSET-27 "0"
+*MEAS_COND_AXIS_OFFSET-28 "0"
+*MEAS_COND_AXIS_OFFSET-29 "0"
+*MEAS_COND_AXIS_OFFSET-3 "0.8349"
+*MEAS_COND_AXIS_OFFSET-30 "0"
+*MEAS_COND_AXIS_OFFSET-31 "0"
+*MEAS_COND_AXIS_OFFSET-32 "0"
+*MEAS_COND_AXIS_OFFSET-33 "0"
+*MEAS_COND_AXIS_OFFSET-34 "0"
+*MEAS_COND_AXIS_OFFSET-35 "0"
+*MEAS_COND_AXIS_OFFSET-36 "0"
+*MEAS_COND_AXIS_OFFSET-37 "0"
+*MEAS_COND_AXIS_OFFSET-38 "0"
+*MEAS_COND_AXIS_OFFSET-39 "0"
+*MEAS_COND_AXIS_OFFSET-4 "0"
+*MEAS_COND_AXIS_OFFSET-40 "0"
+*MEAS_COND_AXIS_OFFSET-41 "0"
+*MEAS_COND_AXIS_OFFSET-42 "0"
+*MEAS_COND_AXIS_OFFSET-43 "0"
+*MEAS_COND_AXIS_OFFSET-44 "0"
+*MEAS_COND_AXIS_OFFSET-45 "0"
+*MEAS_COND_AXIS_OFFSET-46 "0"
+*MEAS_COND_AXIS_OFFSET-47 "0"
+*MEAS_COND_AXIS_OFFSET-48 "0"
+*MEAS_COND_AXIS_OFFSET-49 "0"
+*MEAS_COND_AXIS_OFFSET-5 "0"
+*MEAS_COND_AXIS_OFFSET-50 "0"
+*MEAS_COND_AXIS_OFFSET-51 "0"
+*MEAS_COND_AXIS_OFFSET-52 "0"
+*MEAS_COND_AXIS_OFFSET-53 "0"
+*MEAS_COND_AXIS_OFFSET-54 "0"
+*MEAS_COND_AXIS_OFFSET-55 "0"
+*MEAS_COND_AXIS_OFFSET-56 "0"
+*MEAS_COND_AXIS_OFFSET-57 "0"
+*MEAS_COND_AXIS_OFFSET-58 "0"
+*MEAS_COND_AXIS_OFFSET-59 "0"
+*MEAS_COND_AXIS_OFFSET-6 "0"
+*MEAS_COND_AXIS_OFFSET-60 "0"
+*MEAS_COND_AXIS_OFFSET-61 "0"
+*MEAS_COND_AXIS_OFFSET-62 "0"
+*MEAS_COND_AXIS_OFFSET-63 "0"
+*MEAS_COND_AXIS_OFFSET-64 "0"
+*MEAS_COND_AXIS_OFFSET-65 "0"
+*MEAS_COND_AXIS_OFFSET-66 "0"
+*MEAS_COND_AXIS_OFFSET-67 "0"
+*MEAS_COND_AXIS_OFFSET-68 "0"
+*MEAS_COND_AXIS_OFFSET-69 "0"
+*MEAS_COND_AXIS_OFFSET-7 "0"
+*MEAS_COND_AXIS_OFFSET-70 "0"
+*MEAS_COND_AXIS_OFFSET-71 "0"
+*MEAS_COND_AXIS_OFFSET-72 "0"
+*MEAS_COND_AXIS_OFFSET-73 "0"
+*MEAS_COND_AXIS_OFFSET-74 "0"
+*MEAS_COND_AXIS_OFFSET-75 "0"
+*MEAS_COND_AXIS_OFFSET-76 "0"
+*MEAS_COND_AXIS_OFFSET-77 "0"
+*MEAS_COND_AXIS_OFFSET-78 "0"
+*MEAS_COND_AXIS_OFFSET-79 "0"
+*MEAS_COND_AXIS_OFFSET-8 "0"
+*MEAS_COND_AXIS_OFFSET-80 "0"
+*MEAS_COND_AXIS_OFFSET-81 "0"
+*MEAS_COND_AXIS_OFFSET-82 "0"
+*MEAS_COND_AXIS_OFFSET-83 "0"
+*MEAS_COND_AXIS_OFFSET-84 "0"
+*MEAS_COND_AXIS_OFFSET-85 "0"
+*MEAS_COND_AXIS_OFFSET-86 "0"
+*MEAS_COND_AXIS_OFFSET-87 "0"
+*MEAS_COND_AXIS_OFFSET-88 "0"
+*MEAS_COND_AXIS_OFFSET-9 "0"
+*MEAS_COND_AXIS_POSITION-0 "0.0000"
+*MEAS_COND_AXIS_POSITION-1 "0.0000"
+*MEAS_COND_AXIS_POSITION-10 "0"
+*MEAS_COND_AXIS_POSITION-11 "DB"
+*MEAS_COND_AXIS_POSITION-12 "Soller_slit_2.5deg"
+*MEAS_COND_AXIS_POSITION-13 "0.300deg"
+*MEAS_COND_AXIS_POSITION-14 "0.995000"
+*MEAS_COND_AXIS_POSITION-15 "0.300deg"
+*MEAS_COND_AXIS_POSITION-16 "-1.3975000"
+*MEAS_COND_AXIS_POSITION-17 "5mm"
+*MEAS_COND_AXIS_POSITION-18 "5mm"
+*MEAS_COND_AXIS_POSITION-19 "5mm"
+*MEAS_COND_AXIS_POSITION-2 "0.0000"
+*MEAS_COND_AXIS_POSITION-20 "-0.19142"
+*MEAS_COND_AXIS_POSITION-21 "None"
+*MEAS_COND_AXIS_POSITION-22 "None"
+*MEAS_COND_AXIS_POSITION-24 "1"
+*MEAS_COND_AXIS_POSITION-25 "Open"
+*MEAS_COND_AXIS_POSITION-26 "20.000000"
+*MEAS_COND_AXIS_POSITION-27 "Open"
+*MEAS_COND_AXIS_POSITION-28 "-0.0790625"
+*MEAS_COND_AXIS_POSITION-29 "None"
+*MEAS_COND_AXIS_POSITION-3 "0.0000"
+*MEAS_COND_AXIS_POSITION-30 "None"
+*MEAS_COND_AXIS_POSITION-31 "Soller_slit_2.5deg"
+*MEAS_COND_AXIS_POSITION-32 "Open"
+*MEAS_COND_AXIS_POSITION-33 "0.000"
+*MEAS_COND_AXIS_POSITION-34 "Open"
+*MEAS_COND_AXIS_POSITION-35 "Open"
+*MEAS_COND_AXIS_POSITION-36 "44"
+*MEAS_COND_AXIS_POSITION-4 "0.0000"
+*MEAS_COND_AXIS_POSITION-5 "0.0000"
+*MEAS_COND_AXIS_POSITION-6 "0.0000"
+*MEAS_COND_AXIS_POSITION-7 "-0.8219375"
+*MEAS_COND_AXIS_POSITION-8 "Right"
+*MEAS_COND_AXIS_POSITION-85 "Standard"
+*MEAS_COND_AXIS_POSITION-86 "IPS_adaptor"
+*MEAS_COND_AXIS_POSITION-87 "No_unit"
+*MEAS_COND_AXIS_POSITION-88 "None"
+*MEAS_COND_AXIS_POSITION-9 "None"
+*MEAS_COND_AXIS_UNIT-0 "deg"
+*MEAS_COND_AXIS_UNIT-1 "deg"
+*MEAS_COND_AXIS_UNIT-10 "pulse"
+*MEAS_COND_AXIS_UNIT-11 ""
+*MEAS_COND_AXIS_UNIT-12 ""
+*MEAS_COND_AXIS_UNIT-13 ""
+*MEAS_COND_AXIS_UNIT-14 "mm"
+*MEAS_COND_AXIS_UNIT-15 ""
+*MEAS_COND_AXIS_UNIT-16 "mm"
+*MEAS_COND_AXIS_UNIT-17 ""
+*MEAS_COND_AXIS_UNIT-18 ""
+*MEAS_COND_AXIS_UNIT-19 ""
+*MEAS_COND_AXIS_UNIT-2 "deg"
+*MEAS_COND_AXIS_UNIT-20 "mm"
+*MEAS_COND_AXIS_UNIT-21 ""
+*MEAS_COND_AXIS_UNIT-22 ""
+*MEAS_COND_AXIS_UNIT-23 "deg"
+*MEAS_COND_AXIS_UNIT-24 ""
+*MEAS_COND_AXIS_UNIT-25 ""
+*MEAS_COND_AXIS_UNIT-26 "mm"
+*MEAS_COND_AXIS_UNIT-27 ""
+*MEAS_COND_AXIS_UNIT-28 "mm"
+*MEAS_COND_AXIS_UNIT-29 ""
+*MEAS_COND_AXIS_UNIT-3 "deg"
+*MEAS_COND_AXIS_UNIT-30 ""
+*MEAS_COND_AXIS_UNIT-31 ""
+*MEAS_COND_AXIS_UNIT-32 ""
+*MEAS_COND_AXIS_UNIT-33 "mm"
+*MEAS_COND_AXIS_UNIT-34 ""
+*MEAS_COND_AXIS_UNIT-35 ""
+*MEAS_COND_AXIS_UNIT-36 "div"
+*MEAS_COND_AXIS_UNIT-37 "H"
+*MEAS_COND_AXIS_UNIT-38 "H"
+*MEAS_COND_AXIS_UNIT-39 "H"
+*MEAS_COND_AXIS_UNIT-4 "deg"
+*MEAS_COND_AXIS_UNIT-40 "H"
+*MEAS_COND_AXIS_UNIT-41 "H"
+*MEAS_COND_AXIS_UNIT-42 "mV"
+*MEAS_COND_AXIS_UNIT-43 "V"
+*MEAS_COND_AXIS_UNIT-44 "V"
+*MEAS_COND_AXIS_UNIT-45 "H"
+*MEAS_COND_AXIS_UNIT-46 "H"
+*MEAS_COND_AXIS_UNIT-47 "H"
+*MEAS_COND_AXIS_UNIT-48 "H"
+*MEAS_COND_AXIS_UNIT-49 "H"
+*MEAS_COND_AXIS_UNIT-5 "deg"
+*MEAS_COND_AXIS_UNIT-50 "uS/m"
+*MEAS_COND_AXIS_UNIT-51 "L/min"
+*MEAS_COND_AXIS_UNIT-52 "degree"
+*MEAS_COND_AXIS_UNIT-53 "MPa"
+*MEAS_COND_AXIS_UNIT-54 "MPa"
+*MEAS_COND_AXIS_UNIT-55 "MPa"
+*MEAS_COND_AXIS_UNIT-56 "L/min"
+*MEAS_COND_AXIS_UNIT-57 "C"
+*MEAS_COND_AXIS_UNIT-58 "MPa"
+*MEAS_COND_AXIS_UNIT-59 "degree"
+*MEAS_COND_AXIS_UNIT-6 "deg"
+*MEAS_COND_AXIS_UNIT-60 "percent"
+*MEAS_COND_AXIS_UNIT-61 "degree"
+*MEAS_COND_AXIS_UNIT-62 "C"
+*MEAS_COND_AXIS_UNIT-63 "H"
+*MEAS_COND_AXIS_UNIT-64 "time"
+*MEAS_COND_AXIS_UNIT-65 "msec"
+*MEAS_COND_AXIS_UNIT-66 "msec"
+*MEAS_COND_AXIS_UNIT-67 "H"
+*MEAS_COND_AXIS_UNIT-68 "times"
+*MEAS_COND_AXIS_UNIT-69 "msec"
+*MEAS_COND_AXIS_UNIT-7 "mm"
+*MEAS_COND_AXIS_UNIT-70 "msec"
+*MEAS_COND_AXIS_UNIT-71 "-"
+*MEAS_COND_AXIS_UNIT-72 "-"
+*MEAS_COND_AXIS_UNIT-73 "-"
+*MEAS_COND_AXIS_UNIT-74 ""
+*MEAS_COND_AXIS_UNIT-75 "-"
+*MEAS_COND_AXIS_UNIT-76 "-"
+*MEAS_COND_AXIS_UNIT-77 "-"
+*MEAS_COND_AXIS_UNIT-78 ""
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diff --git a/tests/data/formats/real/rigaku_zno_counts.rasx b/tests/data/formats/real/rigaku_zno_counts.rasx
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diff --git a/tests/data/formats/references/11BM_LaB6_660a.csv b/tests/data/formats/references/11BM_LaB6_660a.csv
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diff --git a/tests/data/formats/references/11BM_NAC.csv b/tests/data/formats/references/11BM_NAC.csv
new file mode 100644
index 0000000..9a02479
--- /dev/null
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diff --git a/tests/data/formats/references/11BM_Si640c.csv b/tests/data/formats/references/11BM_Si640c.csv
new file mode 100644
index 0000000..9d23394
--- /dev/null
+++ b/tests/data/formats/references/11BM_Si640c.csv
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diff --git a/tests/data/formats/references/FAP.csv b/tests/data/formats/references/FAP.csv
new file mode 100644
index 0000000..d1f8200
--- /dev/null
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diff --git a/tests/data/formats/references/bruker4_diffrac_eva.csv b/tests/data/formats/references/bruker4_diffrac_eva.csv
new file mode 100644
index 0000000..2307a00
--- /dev/null
+++ b/tests/data/formats/references/bruker4_diffrac_eva.csv
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diff --git a/tests/data/formats/references/bruker4_v5converter.csv b/tests/data/formats/references/bruker4_v5converter.csv
new file mode 100644
index 0000000..871c415
--- /dev/null
+++ b/tests/data/formats/references/bruker4_v5converter.csv
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diff --git a/tests/data/formats/references/bruker_absorber.csv b/tests/data/formats/references/bruker_absorber.csv
new file mode 100644
index 0000000..a4a8b36
--- /dev/null
+++ b/tests/data/formats/references/bruker_absorber.csv
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diff --git a/tests/data/formats/references/existing_csv.csv b/tests/data/formats/references/existing_csv.csv
new file mode 100644
index 0000000..906f2cd
--- /dev/null
+++ b/tests/data/formats/references/existing_csv.csv
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diff --git a/tests/data/formats/references/existing_gsas.csv b/tests/data/formats/references/existing_gsas.csv
new file mode 100644
index 0000000..09fde1c
--- /dev/null
+++ b/tests/data/formats/references/existing_gsas.csv
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diff --git a/tests/data/formats/references/existing_rasx.csv b/tests/data/formats/references/existing_rasx.csv
new file mode 100644
index 0000000..0e309de
--- /dev/null
+++ b/tests/data/formats/references/existing_rasx.csv
@@ -0,0 +1,2335 @@
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diff --git a/tests/data/formats/references/existing_xrdml.csv b/tests/data/formats/references/existing_xrdml.csv
new file mode 100644
index 0000000..f811fce
--- /dev/null
+++ b/tests/data/formats/references/existing_xrdml.csv
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diff --git a/tests/data/formats/references/existing_xy.csv b/tests/data/formats/references/existing_xy.csv
new file mode 100644
index 0000000..aa67349
--- /dev/null
+++ b/tests/data/formats/references/existing_xy.csv
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diff --git a/tests/data/formats/references/nist_srm660c.csv b/tests/data/formats/references/nist_srm660c.csv
new file mode 100644
index 0000000..03a9b30
--- /dev/null
+++ b/tests/data/formats/references/nist_srm660c.csv
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diff --git a/tests/data/formats/references/panalytical_attenuator_0.csv b/tests/data/formats/references/panalytical_attenuator_0.csv
new file mode 100644
index 0000000..a7c94a7
--- /dev/null
+++ b/tests/data/formats/references/panalytical_attenuator_0.csv
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diff --git a/tests/data/formats/references/panalytical_mesh_0.csv b/tests/data/formats/references/panalytical_mesh_0.csv
new file mode 100644
index 0000000..0774fd4
--- /dev/null
+++ b/tests/data/formats/references/panalytical_mesh_0.csv
@@ -0,0 +1,256 @@
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diff --git a/tests/data/formats/references/panalytical_mesh_100.csv b/tests/data/formats/references/panalytical_mesh_100.csv
new file mode 100644
index 0000000..5a904bf
--- /dev/null
+++ b/tests/data/formats/references/panalytical_mesh_100.csv
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new file mode 100644
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--- /dev/null
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diff --git a/tests/data/formats/references/rigaku_nims.csv b/tests/data/formats/references/rigaku_nims.csv
new file mode 100644
index 0000000..0c41f7b
--- /dev/null
+++ b/tests/data/formats/references/rigaku_nims.csv
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diff --git a/tests/data/formats/references/rigaku_powder.csv b/tests/data/formats/references/rigaku_powder.csv
new file mode 100644
index 0000000..9740d6e
--- /dev/null
+++ b/tests/data/formats/references/rigaku_powder.csv
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diff --git a/tests/data/formats/references/rigaku_zno_counts.csv b/tests/data/formats/references/rigaku_zno_counts.csv
new file mode 100644
index 0000000..0d9045d
--- /dev/null
+++ b/tests/data/formats/references/rigaku_zno_counts.csv
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+90,15
diff --git a/tests/data/formats/references/synthetic_brml.csv b/tests/data/formats/references/synthetic_brml.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_brml.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_chi.csv b/tests/data/formats/references/synthetic_chi.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_chi.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_cif.csv b/tests/data/formats/references/synthetic_cif.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_cif.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_cif_second.csv b/tests/data/formats/references/synthetic_cif_second.csv
new file mode 100644
index 0000000..f61922c
--- /dev/null
+++ b/tests/data/formats/references/synthetic_cif_second.csv
@@ -0,0 +1,4 @@
+x,y
+20,100
+20.25,64
+20.5,25
diff --git a/tests/data/formats/references/synthetic_csv.csv b/tests/data/formats/references/synthetic_csv.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_csv.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_esd.csv b/tests/data/formats/references/synthetic_esd.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_esd.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_fxye.csv b/tests/data/formats/references/synthetic_fxye.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_fxye.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_gsas.csv b/tests/data/formats/references/synthetic_gsas.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_gsas.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_ras.csv b/tests/data/formats/references/synthetic_ras.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_ras.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_ras_second.csv b/tests/data/formats/references/synthetic_ras_second.csv
new file mode 100644
index 0000000..f61922c
--- /dev/null
+++ b/tests/data/formats/references/synthetic_ras_second.csv
@@ -0,0 +1,4 @@
+x,y
+20,100
+20.25,64
+20.5,25
diff --git a/tests/data/formats/references/synthetic_rasx.csv b/tests/data/formats/references/synthetic_rasx.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_rasx.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_raw3.csv b/tests/data/formats/references/synthetic_raw3.csv
new file mode 100644
index 0000000..c172f58
--- /dev/null
+++ b/tests/data/formats/references/synthetic_raw3.csv
@@ -0,0 +1,7 @@
+x,y
+10,12
+10.02,34.5
+10.039999999999999,90
+10.06,321.25
+10.08,87
+10.1,5
diff --git a/tests/data/formats/references/synthetic_raw4_4byte.csv b/tests/data/formats/references/synthetic_raw4_4byte.csv
new file mode 100644
index 0000000..c172f58
--- /dev/null
+++ b/tests/data/formats/references/synthetic_raw4_4byte.csv
@@ -0,0 +1,7 @@
+x,y
+10,12
+10.02,34.5
+10.039999999999999,90
+10.06,321.25
+10.08,87
+10.1,5
diff --git a/tests/data/formats/references/synthetic_raw4_8byte.csv b/tests/data/formats/references/synthetic_raw4_8byte.csv
new file mode 100644
index 0000000..c172f58
--- /dev/null
+++ b/tests/data/formats/references/synthetic_raw4_8byte.csv
@@ -0,0 +1,7 @@
+x,y
+10,12
+10.02,34.5
+10.039999999999999,90
+10.06,321.25
+10.08,87
+10.1,5
diff --git a/tests/data/formats/references/synthetic_uxd.csv b/tests/data/formats/references/synthetic_uxd.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_uxd.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_uxd_second.csv b/tests/data/formats/references/synthetic_uxd_second.csv
new file mode 100644
index 0000000..f61922c
--- /dev/null
+++ b/tests/data/formats/references/synthetic_uxd_second.csv
@@ -0,0 +1,4 @@
+x,y
+20,100
+20.25,64
+20.5,25
diff --git a/tests/data/formats/references/synthetic_xrdml.csv b/tests/data/formats/references/synthetic_xrdml.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_xrdml.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/references/synthetic_xy.csv b/tests/data/formats/references/synthetic_xy.csv
new file mode 100644
index 0000000..2f1372b
--- /dev/null
+++ b/tests/data/formats/references/synthetic_xy.csv
@@ -0,0 +1,6 @@
+x,y
+10,4
+10.125,81
+10.25,144
+10.375,9
+10.5,1
diff --git a/tests/data/formats/text/README.md b/tests/data/formats/text/README.md
new file mode 100644
index 0000000..7e71fd5
--- /dev/null
+++ b/tests/data/formats/text/README.md
@@ -0,0 +1,36 @@
+# Synthetic text profile fixtures
+
+These files were authored for Geddes, are covered by the repository's MIT
+license, and contain no measured or third-party experimental data. They encode
+the same independently specified five-point pattern:
+
+- 2theta (degrees): `[10, 10.125, 10.25, 10.375, 10.5]`
+- intensity (stored units): `[4, 81, 144, 9, 1]`
+
+The RAS, UXD, and CIF fixtures additionally contain a selectable second pattern
+with 2theta `[20, 20.25, 20.5]` and intensity `[100, 64, 25]`. The RAS file stores
+that second scan in descending order to verify paired reversal. UXD has a third
+counts-only scan with inherited start and increment metadata.
+
+`profile.gsas` stores counts-only STD records; `profile_esd.gsas` stores fixed
+eight-character intensity/esd pairs. The FXYE and ESD fixtures deliberately
+include a zero uncertainty; the CIF similarly
+includes a zero weight. Geddes preserves those x/y points because it does not
+perform uncertainty processing. The RAS attenuator column is also ignored.
+
+Format facts were checked against the Rietx format modules (retrieved 2026-09-11)
+and their documented specifications:
+
+- [GSAS](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/gsas.py):
+  CONS/CONST centidegree axis; STD, ESD, and FXYE record layouts.
+- [RAS](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/ras.py):
+  header and intensity block markers, scan-axis key, stored intensity column.
+- [UXD](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/uxd.py):
+  explicit positions or `_START`/`_STEPSIZE`, counts or cps, inherited headers.
+- [CHI](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/chi.py):
+  four-line header, including a point count which must not become a data row.
+- [pdCIF](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/pdcif.py):
+  measured-profile tag alternatives and block selection.
+
+`tests/text_formats.rs` also constructs small malformed and boundary examples
+directly, including fused full-width ESD fields and CIF quoted/multiline values.
diff --git a/tests/data/formats/text/profile.chi b/tests/data/formats/text/profile.chi
new file mode 100644
index 0000000..8bd617a
--- /dev/null
+++ b/tests/data/formats/text/profile.chi
@@ -0,0 +1,9 @@
+Synthetic five-point powder pattern
+2-Theta Angle (Degrees)
+Intensity
+5 1
+10.000 4
+10.125 81
+10.250 144
+10.375 9
+10.500 1
diff --git a/tests/data/formats/text/profile.cif b/tests/data/formats/text/profile.cif
new file mode 100644
index 0000000..251a8cb
--- /dev/null
+++ b/tests/data/formats/text/profile.cif
@@ -0,0 +1,31 @@
+data_structure_only
+_chemical_name_common 'Synthetic profile test'
+_audit_creation_method
+;
+This field contains text which is not a CIF loop:
+loop_
+_pd_meas_2theta_scan
+;
+loop_
+_atom_site_label
+_atom_site_type_symbol
+'data_fake' 'Si'
+"_pd_meas_counts_total" "O"
+
+data_profile_meas
+loop_
+_pd_meas_counts_total
+_pd_meas_2theta_scan
+_pd_proc_ls_weight
+4 10.000(2) 0.25 81 10.125(2) 0.012345679
+144 10.250(2) 0 # zero weight must not discard the measured point
+9 10.375(2) 0.111111111
+1 10.500(2) 1
+
+data_profile_other
+loop_
+_pd_proc_2theta_corrected
+_pd_proc_intensity_total
+20.0 '100(5)'
+20.25 64(4)
+20.5 25(2)
diff --git a/tests/data/formats/text/profile.csv b/tests/data/formats/text/profile.csv
new file mode 100644
index 0000000..15075a0
--- /dev/null
+++ b/tests/data/formats/text/profile.csv
@@ -0,0 +1,6 @@
+2theta,intensity,uncertainty
+10.000,4,2
+10.125,81,9
+10.250,144,12
+10.375,9,3
+10.500,1,1
diff --git a/tests/data/formats/text/profile.fxye b/tests/data/formats/text/profile.fxye
new file mode 100644
index 0000000..153435f
--- /dev/null
+++ b/tests/data/formats/text/profile.fxye
@@ -0,0 +1,7 @@
+Synthetic measured profile, centidegrees in the first column
+BANK 1 5 5 CONS 1000 12.5 0 0 FXYE
+1000.0 4 2
+1012.5 81 9
+1025.0 144 0
+1037.5 9 3
+1050.0 1 1
diff --git a/tests/data/formats/text/profile.gsas b/tests/data/formats/text/profile.gsas
new file mode 100644
index 0000000..4ab39a2
--- /dev/null
+++ b/tests/data/formats/text/profile.gsas
@@ -0,0 +1,3 @@
+Synthetic counts-only profile, default STD flag
+BANK 1 5 1 CONST 1000 12.5 0 0
+       4      81     144       9       1       0       0       0       0       0
diff --git a/tests/data/formats/text/profile.ras b/tests/data/formats/text/profile.ras
new file mode 100644
index 0000000..8c46b8c
--- /dev/null
+++ b/tests/data/formats/text/profile.ras
@@ -0,0 +1,24 @@
+*RAS_DATA_START
+*RAS_HEADER_START
+*FILE_COMMENT "Synthetic five-point powder pattern"
+*MEAS_SCAN_AXIS_X "TwoThetaTheta"
+*MEAS_SCAN_UNIT_Y "counts"
+*MEAS_DATA_COUNT "5"
+*RAS_HEADER_END
+*RAS_INT_START
+10.000 4 1
+10.125 81 2
+10.250 144 1
+10.375 9 1
+10.500 1 1
+*RAS_INT_END
+*RAS_HEADER_START
+*MEAS_SCAN_AXIS_X "TwoTheta"
+*MEAS_DATA_COUNT "3"
+*RAS_HEADER_END
+*RAS_INT_START
+20.5 25 1
+20.25 64 1
+20 100 1
+*RAS_INT_END
+*RAS_DATA_END
diff --git a/tests/data/formats/text/profile.uxd b/tests/data/formats/text/profile.uxd
new file mode 100644
index 0000000..23baf50
--- /dev/null
+++ b/tests/data/formats/text/profile.uxd
@@ -0,0 +1,15 @@
+; Synthetic DIFFRAC-AT export. Header values persist across ranges.
+_FILEVERSION=2
+_DRIVE='COUPLED'
+_START=10
+_STEPSIZE=0.125
+_COUNTS
+4 81 144
+9 1
+_START=20
+_2THETACPS
+20 100
+20.25 64
+20.5 25
+_CPS
+100 64 25
diff --git a/tests/data/formats/text/profile.xy b/tests/data/formats/text/profile.xy
new file mode 100644
index 0000000..444f02b
--- /dev/null
+++ b/tests/data/formats/text/profile.xy
@@ -0,0 +1,6 @@
+# Synthetic measured profile: 2theta, intensity, optional ignored uncertainty
+10.000 4 2
+10.125 81 9
+10.250 144 12
+10.375 9 3
+10.500 1 1
diff --git a/tests/data/formats/text/profile_esd.gsas b/tests/data/formats/text/profile_esd.gsas
new file mode 100644
index 0000000..171f0a1
--- /dev/null
+++ b/tests/data/formats/text/profile_esd.gsas
@@ -0,0 +1,3 @@
+Synthetic measured profile with fixed eight-character intensity/esd fields
+BANK 1 5 1 CONS 1000 12.5 0 0 ESD
+     4.0     2.0    81.0     9.0   144.0     0.0     9.0     3.0     1.0     1.0
diff --git a/tests/data/formats/xml/README.md b/tests/data/formats/xml/README.md
new file mode 100644
index 0000000..55f28bd
--- /dev/null
+++ b/tests/data/formats/xml/README.md
@@ -0,0 +1,17 @@
+# XML container samples
+
+`synthetic.xrdml`, `synthetic.rasx`, and `synthetic.brml` encode the entire
+five-point pattern in `expected.xy`: 2theta 10–10.5° at 0.125° intervals,
+intensities 4, 81, 144, 9, 1. These are invented values, not measured data.
+
+The XML is written directly from each self-describing container's documented
+structure: XRDML `positions`/`counts`, RASX manifest-listed profile/conditions,
+and BRML manifest-listed data with named `RawDataView` columns. The BRML
+intensity is column 1 and TwoTheta is column 4, intentionally avoiding a
+fixed-position assumption. ZIP members use uncompressed storage.
+
+Format references: Rietx's
+[XRDML](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/xrdml.py),
+[RASX](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/rasx.py), and
+[BRML](https://github.com/yue-here/rietx/blob/main/src/rietx/io/formats/brml.py)
+field descriptions. These files contain no copied measurement or reader code.
diff --git a/tests/data/formats/xml/expected.xy b/tests/data/formats/xml/expected.xy
new file mode 100644
index 0000000..51bc8cf
--- /dev/null
+++ b/tests/data/formats/xml/expected.xy
@@ -0,0 +1,5 @@
+10 4
+10.125 81
+10.25 144
+10.375 9
+10.5 1
diff --git a/tests/data/formats/xml/synthetic.brml b/tests/data/formats/xml/synthetic.brml
new file mode 100644
index 0000000..ba3aa62
Binary files /dev/null and b/tests/data/formats/xml/synthetic.brml differ
diff --git a/tests/data/formats/xml/synthetic.rasx b/tests/data/formats/xml/synthetic.rasx
new file mode 100644
index 0000000..332a891
Binary files /dev/null and b/tests/data/formats/xml/synthetic.rasx differ
diff --git a/tests/data/formats/xml/synthetic.xrdml b/tests/data/formats/xml/synthetic.xrdml
new file mode 100644
index 0000000..dba631c
--- /dev/null
+++ b/tests/data/formats/xml/synthetic.xrdml
@@ -0,0 +1 @@
+<xrdMeasurements><xrdMeasurement><scan scanAxis="Gonio"><dataPoints><positions axis="2Theta" unit="deg"><startPosition>10</startPosition><endPosition>10.5</endPosition></positions><counts unit="counts">4 81 144 9 1</counts></dataPoints></scan></xrdMeasurement></xrdMeasurements>
diff --git a/tests/dispatch.rs b/tests/dispatch.rs
new file mode 100644
index 0000000..aaa0392
--- /dev/null
+++ b/tests/dispatch.rs
@@ -0,0 +1,100 @@
+use geddes::{read_bytes, read_bytes_with_options, ReadOptions};
+
+#[test]
+fn content_wins_over_misleading_extensions() {
+    for (bytes, names) in [
+        (
+            include_bytes!("data/formats/text/profile.uxd").as_slice(),
+            vec!["wrong.raw", "wrong.cif"],
+        ),
+        (
+            include_bytes!("data/formats/text/profile.gsas").as_slice(),
+            vec!["wrong.cif", "wrong.uxd"],
+        ),
+        (
+            include_bytes!("data/formats/text/profile.chi").as_slice(),
+            vec!["wrong.raw", "wrong.xy"],
+        ),
+    ] {
+        for name in names {
+            let pattern = read_bytes(bytes, name).unwrap();
+            assert_eq!(pattern.x, [10., 10.125, 10.25, 10.375, 10.5]);
+            assert_eq!(pattern.y, [4., 81., 144., 9., 1.]);
+        }
+    }
+    let raw_title = b"RAW diffraction data\nBANK 1 2 1 CONS 1000 100 0 0 STD\n1 2\n";
+    assert_eq!(read_bytes(raw_title, "a.raw").unwrap().y, [1., 2.]);
+}
+
+#[test]
+fn a_chi_shaped_ascii_header_does_not_claim_a_false_point_count() {
+    let bytes = b"title\n2theta\nintensity\n5\n10 1\n11 2\n";
+    assert_eq!(read_bytes(bytes, "a.xy").unwrap().x, [10., 11.]);
+    assert!(read_bytes(bytes, "a.chi").is_err());
+}
+
+#[test]
+fn an_integer_xy_row_is_not_a_chi_point_count() {
+    let bytes = b"sample\n2theta\nintensity\n3 12\n4 24\n5 48\n6 96\n";
+    let pattern = read_bytes(bytes, "a.xy").unwrap();
+    assert_eq!(pattern.x, [3., 4., 5., 6.]);
+    assert_eq!(pattern.y, [12., 24., 48., 96.]);
+    assert!(read_bytes(bytes, "a.chi").is_err());
+
+    let chi = b"sample\n2theta\nintensity\n3 1\n4 24\n5 48\n6 96\n";
+    let pattern = read_bytes(chi, "a.dat").unwrap();
+    assert_eq!(pattern.x, [4., 5., 6.]);
+    assert_eq!(pattern.y, [24., 48., 96.]);
+}
+
+#[test]
+fn xrdml_markers_in_ascii_headers_do_not_select_the_xml_reader() {
+    for header in [
+        "# Exported from <xrdMeasurements>",
+        "Source: vendor:xrdMeasurements",
+        "<!-- <xrdMeasurements> -->",
+        "<note><xrdMeasurements/></note>",
+        "<xrdMeasurementsHistory/>",
+    ] {
+        let bytes = format!("{header}\n10 12\n11 24\n");
+        let pattern = read_bytes(bytes.as_bytes(), "a.xy").unwrap();
+        assert_eq!(pattern.x, [10., 11.]);
+        assert_eq!(pattern.y, [12., 24.]);
+    }
+}
+
+#[test]
+fn xrdml_root_detection_preserves_prologs_namespaces_and_parse_errors() {
+    let document = "<?xml version=\"1.0\"?>\n<!-- measured profile -->\n<?instrument export?>\n\
+        <x:xrdMeasurements xmlns:x=\"urn:xrdml\"><x:xrdMeasurement><x:scan><x:dataPoints>\
+        <x:positions axis=\"2Theta\" unit=\"deg\"><x:startPosition>10</x:startPosition>\
+        <x:endPosition>11</x:endPosition></x:positions>\
+        <x:intensities unit=\"counts\">12 24</x:intensities>\
+        </x:dataPoints></x:scan></x:xrdMeasurement></x:xrdMeasurements>";
+    let pattern = read_bytes(document.as_bytes(), "a.xy").unwrap();
+    assert_eq!(pattern.x, [10., 11.]);
+    assert_eq!(pattern.y, [12., 24.]);
+
+    let invalid = b"<xrdMeasurements>\n10 12\n11 24\n";
+    assert!(read_bytes(invalid, "a.xy").is_err());
+}
+
+#[test]
+fn peak_lists_and_unavailable_scans_are_rejected() {
+    let dif = b"2theta intensity h k l\n10 100 1 0 0\n20 10 1 1 0\n30 4 1 1 1\n";
+    assert!(read_bytes(dif, "a.dif")
+        .unwrap_err()
+        .to_string()
+        .contains("peak lists"));
+    let xy = b"10 1\n11 2\n";
+    assert_eq!(read_bytes(xy, "renamed.dif").unwrap().x, [10., 11.]);
+    assert!(read_bytes_with_options(
+        xy,
+        "a.xy",
+        &ReadOptions {
+            index: 1,
+            block: None
+        }
+    )
+    .is_err());
+}
diff --git a/tests/fixture_accuracy.rs b/tests/fixture_accuracy.rs
new file mode 100644
index 0000000..105c254
--- /dev/null
+++ b/tests/fixture_accuracy.rs
@@ -0,0 +1,70 @@
+use geddes::{read_bytes_with_options, read_with_options, ReadOptions};
+use serde::Deserialize;
+use std::path::Path;
+
+#[derive(Deserialize)]
+struct Manifest {
+    fixtures: Vec<Fixture>,
+}
+#[derive(Deserialize)]
+struct Fixture {
+    id: String,
+    path: String,
+    reference: String,
+    points: usize,
+    scan: usize,
+    block: Option<String>,
+    rtol: f64,
+    atol: f64,
+}
+
+#[test]
+fn every_fixture_matches_every_reference_point_from_path_and_bytes() {
+    let root = Path::new(env!("CARGO_MANIFEST_DIR")).join("tests/data/formats");
+    let manifest: Manifest =
+        serde_json::from_str(&std::fs::read_to_string(root.join("manifest.json")).unwrap())
+            .unwrap();
+    for fixture in manifest.fixtures {
+        let source = root.join(&fixture.path);
+        let reference = std::fs::read_to_string(root.join(&fixture.reference)).unwrap();
+        let rows: Vec<(f64, f64)> = reference
+            .lines()
+            .skip(1)
+            .map(|line| {
+                let (x, y) = line.split_once(',').unwrap();
+                (x.parse().unwrap(), y.parse().unwrap())
+            })
+            .collect();
+        assert_eq!(
+            rows.len(),
+            fixture.points,
+            "{} reference length",
+            fixture.id
+        );
+        let options = ReadOptions {
+            index: fixture.scan,
+            block: fixture.block,
+        };
+        let path_pattern = read_with_options(&source, &options)
+            .unwrap_or_else(|e| panic!("{} path: {e}", fixture.id));
+        let bytes = std::fs::read(&source).unwrap();
+        let byte_pattern = read_bytes_with_options(&bytes, source.to_str().unwrap(), &options)
+            .unwrap_or_else(|e| panic!("{} bytes: {e}", fixture.id));
+        for (mode, pattern) in [("path", path_pattern), ("bytes", byte_pattern)] {
+            assert_eq!(pattern.x.len(), rows.len(), "{} {mode} length", fixture.id);
+            assert_eq!(pattern.y.len(), rows.len());
+            for (i, ((x, y), (rx, ry))) in pattern.x.iter().zip(&pattern.y).zip(&rows).enumerate() {
+                assert!(
+                    (x - rx).abs() <= fixture.atol + fixture.rtol * rx.abs(),
+                    "{} {mode} x[{i}]: {x} != {rx}",
+                    fixture.id
+                );
+                assert!(
+                    (y - ry).abs() <= fixture.atol + fixture.rtol * ry.abs(),
+                    "{} {mode} y[{i}]: {y} != {ry}",
+                    fixture.id
+                );
+            }
+        }
+    }
+}
diff --git a/tests/release_version_cases.py b/tests/release_version_cases.py
new file mode 100644
index 0000000..642d851
--- /dev/null
+++ b/tests/release_version_cases.py
@@ -0,0 +1,68 @@
+"""Release gate regressions; run separately with Python 3.12 unittest."""
+
+from contextlib import redirect_stderr, redirect_stdout
+import io
+import json
+import os
+from pathlib import Path
+import shutil
+import sys
+import tempfile
+import unittest
+from unittest.mock import patch
+
+if sys.version_info < (3, 11):
+    raise unittest.SkipTest("Release validation runs under Python 3.12 in CI")
+
+import check_release_version as gate
+
+
+class ReleaseVersionTests(unittest.TestCase):
+    def setUp(self):
+        self.directory = tempfile.TemporaryDirectory()
+        self.addCleanup(self.directory.cleanup)
+        self.root = Path(self.directory.name)
+        for filename in ("Cargo.toml", "Cargo.lock", "node/Cargo.toml", "node/Cargo.lock", "node/package.json", "node/package-lock.json", "pyproject.toml"):
+            target = self.root / filename
+            target.parent.mkdir(parents=True, exist_ok=True)
+            shutil.copyfile(gate.ROOT / filename, target)
+        self.version = gate.check_versions(self.root)
+
+    def test_all_manifests_agree(self):
+        self.assertEqual(gate.check_versions(self.root, f"v{self.version}", f"v{self.version}"), self.version)
+
+    def test_requested_version_must_match(self):
+        with self.assertRaisesRegex(ValueError, "Requested version"):
+            gate.check_versions(self.root, requested="999.999.999")
+
+    def test_manual_tag_must_match(self):
+        with self.assertRaisesRegex(ValueError, "Tag"):
+            gate.check_versions(self.root, tag="v999.999.999")
+
+    def test_stale_node_package_is_refused(self):
+        path = self.root / "node/package.json"
+        data = json.loads(path.read_text())
+        data["version"] = "999.999.999"
+        path.write_text(json.dumps(data))
+        with self.assertRaisesRegex(ValueError, "node/package.json"):
+            gate.check_versions(self.root)
+
+    def test_stale_lockfile_is_refused(self):
+        path = self.root / "node/package-lock.json"
+        data = json.loads(path.read_text())
+        data["packages"][""]["version"] = "999.999.999"
+        path.write_text(json.dumps(data))
+        with self.assertRaisesRegex(ValueError, "packages"):
+            gate.check_versions(self.root)
+
+    def test_pr_ref_is_not_interpreted_as_a_tag(self):
+        with patch.object(gate, "ROOT", self.root), patch("sys.argv", ["check_release_version.py"]), patch.dict(os.environ, {"GITHUB_REF_TYPE": "branch", "GITHUB_REF_NAME": "123/merge", "GITHUB_OUTPUT": ""}), redirect_stdout(io.StringIO()):
+            self.assertEqual(gate.main(), 0)
+
+    def test_direct_tag_run_cannot_bypass_version_validation(self):
+        with patch.object(gate, "ROOT", self.root), patch("sys.argv", ["check_release_version.py"]), patch.dict(os.environ, {"GITHUB_REF_TYPE": "tag", "GITHUB_REF_NAME": "v999.999.999", "GITHUB_OUTPUT": ""}), redirect_stderr(io.StringIO()):
+            self.assertEqual(gate.main(), 1)
+
+
+if __name__ == "__main__":
+    unittest.main()
diff --git a/tests/test_python.py b/tests/test_python.py
index 4a33c7e..ab2d66b 100644
--- a/tests/test_python.py
+++ b/tests/test_python.py
@@ -1,4 +1,6 @@
 import math
+import csv
+import json
 from pathlib import Path
 
 import geddes
@@ -6,14 +8,74 @@
 
 ROOT = Path(__file__).resolve().parents[1]
 DATA_DIR = ROOT / "tests" / "data"
+CORPUS = DATA_DIR / "formats"
+FIXTURES = json.loads((CORPUS / "manifest.json").read_text())["fixtures"]
 FLOAT32_MIN_POSITIVE = float.fromhex("0x1.0p-126")
 
 
+@pytest.mark.parametrize("fixture", FIXTURES, ids=lambda f: f["id"])
+def test_complete_fixture_arrays_and_bytes_api(fixture):
+    path = CORPUS / fixture["path"]
+    with (CORPUS / fixture["reference"]).open() as stream:
+        reference = list(csv.DictReader(stream))
+    expected_x = [float(r["x"]) for r in reference]
+    expected_y = [float(r["y"]) for r in reference]
+    options = {"index": fixture["scan"], "block": fixture["block"]}
+    for pattern in (geddes.read(str(path), **options),
+                    geddes.read_bytes(path.read_bytes(), path.name, **options)):
+        assert not hasattr(pattern, "e")
+        assert len(pattern.x) == fixture["points"]
+        assert pattern.x == pytest.approx(expected_x, rel=fixture["rtol"], abs=fixture["atol"])
+        assert pattern.y == pytest.approx(expected_y, rel=fixture["rtol"], abs=fixture["atol"])
+
+
+@pytest.mark.parametrize("filename,data", [
+    ("banks.gsas", b"BANK 1 2 1 CONS 1000 100 STD\n4 9\nBANK 7 2 1 CONS 2000 50 STD\n25 36\n"),
+    ("ranges.uxd", b"_DRIVE='COUPLED'\n_START=10\n_STEPSIZE=1\n_COUNTS\n4 9\n_START=20\n_STEPSIZE=.5\n_COUNTS\n25 36\n"),
+])
+@pytest.mark.parametrize("from_bytes", [False, True])
+def test_index_selects_pattern_by_position(tmp_path, filename, data, from_bytes):
+    path = tmp_path / filename
+    path.write_bytes(data)
+
+    def load(**options):
+        if from_bytes:
+            return geddes.read_bytes(data, filename, **options)
+        return geddes.read(str(path), **options)
+
+    for options in ({}, {"index": 0}):
+        first = load(**options)
+        assert first.x == [10.0, 11.0]
+        assert first.y == [4.0, 9.0]
+    second = load(index=1)
+    assert second.x == [20.0, 20.5]
+    assert second.y == [25.0, 36.0]
+    with pytest.raises(ValueError, match="out of range"):
+        load(index=2)
+
+
+@pytest.mark.parametrize("from_bytes", [False, True])
+def test_index_rejects_invalid_values_and_unavailable_patterns(tmp_path, from_bytes):
+    data = b"10 4\n11 9\n"
+    path = tmp_path / "single.xy"
+    path.write_bytes(data)
+
+    def load(index):
+        if from_bytes:
+            return geddes.read_bytes(data, path.name, index=index)
+        return geddes.read(str(path), index=index)
+
+    for index in (-1, 0.5, "1"):
+        with pytest.raises((TypeError, OverflowError)):
+            load(index)
+    with pytest.raises(ValueError, match="index must be 0"):
+        load(1)
+
+
 def _assert_pattern(pattern):
     assert len(pattern.x) > 0
     assert len(pattern.x) == len(pattern.y)
-    if pattern.e is not None:
-        assert len(pattern.e) == len(pattern.x)
+    assert not hasattr(pattern, "e")
 
 
 def test_reads_gsas_raw_from_path():
@@ -132,29 +194,24 @@ def test_bruker_raw_diffrac_eva_loads_with_axis():
 
 def test_pattern_new_rejects_mismatched_xy_lengths():
     with pytest.raises(ValueError, match="x and y must have the same length"):
-        geddes.Pattern([10.0], [100.0, 101.0], None)
-
-
-def test_pattern_new_rejects_mismatched_e_length():
-    with pytest.raises(ValueError, match="e must have the same length as x and y"):
-        geddes.Pattern([10.0, 11.0], [100.0, 101.0], [1.0])
+        geddes.Pattern([10.0], [100.0, 101.0])
 
 
 def test_pattern_new_rejects_non_ascending_x():
     for x in ([20.0, 10.0], [10.0, 10.0]):
-        with pytest.raises(ValueError, match="x values must be strictly increasing"):
-            geddes.Pattern(x, [100.0, 101.0], None)
+        with pytest.raises(ValueError, match="strictly increasing"):
+            geddes.Pattern(x, [100.0, 101.0])
 
 
 def test_pattern_new_rejects_nan_x():
     nan = float("nan")
     for x in ([10.0, nan], [nan], [nan, 20.0]):
         y = [100.0] * len(x)
-        with pytest.raises(ValueError, match="x values must be strictly increasing"):
-            geddes.Pattern(x, y, None)
+        with pytest.raises(ValueError, match="strictly increasing"):
+            geddes.Pattern(x, y)
 
 
-def test_read_rejects_descending_xrdml_axis():
+def test_read_reverses_descending_xrdml_axis():
     data = b"""<?xml version="1.0" encoding="UTF-8"?>
 <xrdMeasurements xmlns="http://www.xrdml.com/XRDMeasurement/1.6">
   <xrdMeasurement>
@@ -171,5 +228,6 @@ def test_read_rejects_descending_xrdml_axis():
 </xrdMeasurements>
 """
 
-    with pytest.raises(ValueError, match="x values must be strictly increasing"):
-        geddes.read_bytes(data, "descending.xrdml")
+    pattern = geddes.read_bytes(data, "descending.xrdml")
+    assert pattern.x == [10.0, 15.0, 20.0]
+    assert pattern.y == [102.0, 101.0, 100.0]
diff --git a/tests/test_rust.rs b/tests/test_rust.rs
index 440ba94..5b232ba 100644
--- a/tests/test_rust.rs
+++ b/tests/test_rust.rs
@@ -72,11 +72,6 @@ fn reads_csv_from_path() {
     println!("IO time for csv: {:?}", start.elapsed());
     assert!(pattern.x.len() > 0);
     assert_eq!(pattern.x.len(), pattern.y.len());
-    assert!(pattern
-        .e
-        .as_ref()
-        .map(|v| v.len() == pattern.x.len())
-        .unwrap_or(true));
     println!("Loaded {} points from csv", pattern.x.len());
 }
 
@@ -96,10 +91,7 @@ fn reads_bruker_raw_from_bytes() {
     let path = PathBuf::from("tests/data/bruker_raw/bruker4_v5converter.raw");
     let start = Instant::now();
     let bytes = fs_read(&path).expect("Failed to read Bruker raw bytes");
-    println!(
-        "IO time (read bytes) for Bruker raw: {:?}",
-        start.elapsed()
-    );
+    println!("IO time (read bytes) for Bruker raw: {:?}", start.elapsed());
     let pattern = read_bytes(&bytes, "bruker4_v5converter.raw")
         .expect("Failed to load Bruker raw from bytes");
     assert!(pattern.x.len() > 0);
@@ -129,8 +121,7 @@ fn reads_xrdml_from_bytes() {
     let start = Instant::now();
     let bytes = fs_read(&path).expect("Failed to read file bytes");
     println!("IO time (read bytes) for xrdml: {:?}", start.elapsed());
-    let pattern =
-        read_bytes(&bytes, "sample.xrdml").expect("Failed to load xrdml from bytes");
+    let pattern = read_bytes(&bytes, "sample.xrdml").expect("Failed to load xrdml from bytes");
     assert!(pattern.x.len() > 0);
     assert_eq!(pattern.x.len(), pattern.y.len());
 }
@@ -155,11 +146,6 @@ fn reads_csv_from_bytes() {
     let pattern = read_bytes(&bytes, "sample.csv").expect("Failed to load csv from bytes");
     assert!(pattern.x.len() > 0);
     assert_eq!(pattern.x.len(), pattern.y.len());
-    assert!(pattern
-        .e
-        .as_ref()
-        .map(|v| v.len() == pattern.x.len())
-        .unwrap_or(true));
 }
 
 #[test]
@@ -218,7 +204,7 @@ fn bruker_raw_diffrac_eva_loads_with_axis() {
 
 #[test]
 fn pattern_new_rejects_mismatched_xy_lengths() {
-    let err = Pattern::new(vec![10.0], vec![100.0, 101.0], None)
+    let err = Pattern::new(vec![10.0], vec![100.0, 101.0])
         .expect_err("mismatched x/y lengths should be rejected");
 
     match err {
@@ -229,32 +215,15 @@ fn pattern_new_rejects_mismatched_xy_lengths() {
     }
 }
 
-#[test]
-fn pattern_new_rejects_mismatched_e_length() {
-    let err = Pattern::new(
-        vec![10.0, 11.0],
-        vec![100.0, 101.0],
-        Some(vec![1.0]),
-    )
-    .expect_err("mismatched e length should be rejected");
-
-    match err {
-        Error::Parse(message) => {
-            assert!(message.contains("e must have the same length as x and y"));
-        }
-        other => panic!("expected parse error, got {other:?}"),
-    }
-}
-
 #[test]
 fn pattern_new_rejects_non_ascending_x() {
     for x in [vec![20.0, 10.0], vec![10.0, 10.0]] {
-        let err = Pattern::new(x, vec![100.0, 101.0], None)
+        let err = Pattern::new(x, vec![100.0, 101.0])
             .expect_err("non-ascending x values should be rejected");
 
         match err {
             Error::Parse(message) => {
-                assert!(message.contains("x values must be strictly increasing"));
+                assert!(message.contains("strictly increasing"));
             }
             other => panic!("expected parse error, got {other:?}"),
         }
@@ -263,20 +232,15 @@ fn pattern_new_rejects_non_ascending_x() {
 
 #[test]
 fn pattern_new_rejects_nan_x() {
-    let cases = [
-        vec![10.0, f64::NAN],
-        vec![f64::NAN],
-        vec![f64::NAN, 20.0],
-    ];
+    let cases = [vec![10.0, f64::NAN], vec![f64::NAN], vec![f64::NAN, 20.0]];
 
     for x in cases {
         let y = vec![100.0; x.len()];
-        let err = Pattern::new(x, y, None)
-            .expect_err("NaN x values should be rejected");
+        let err = Pattern::new(x, y).expect_err("NaN x values should be rejected");
 
         match err {
             Error::Parse(message) => {
-                assert!(message.contains("x values must be strictly increasing"));
+                assert!(message.contains("strictly increasing"));
             }
             other => panic!("expected parse error, got {other:?}"),
         }
@@ -284,7 +248,7 @@ fn pattern_new_rejects_nan_x() {
 }
 
 #[test]
-fn read_rejects_descending_xrdml_axis() {
+fn read_reverses_descending_xrdml_axis() {
     let data = br#"<?xml version="1.0" encoding="UTF-8"?>
 <xrdMeasurements xmlns="http://www.xrdml.com/XRDMeasurement/1.6">
   <xrdMeasurement>
@@ -301,13 +265,7 @@ fn read_rejects_descending_xrdml_axis() {
 </xrdMeasurements>
 "#;
 
-    let err = read_bytes(data.as_slice(), "descending.xrdml")
-        .expect_err("descending XRDML 2Theta axis should be rejected");
-
-    match err {
-        Error::Parse(message) => {
-            assert!(message.contains("x values must be strictly increasing"));
-        }
-        other => panic!("expected parse error, got {other:?}"),
-    }
+    let pattern = read_bytes(data.as_slice(), "descending.xrdml").unwrap();
+    assert_eq!(pattern.x, vec![10.0, 15.0, 20.0]);
+    assert_eq!(pattern.y, vec![102.0, 101.0, 100.0]);
 }
diff --git a/tests/text_formats.rs b/tests/text_formats.rs
new file mode 100644
index 0000000..5dd8fdf
--- /dev/null
+++ b/tests/text_formats.rs
@@ -0,0 +1,498 @@
+use geddes::{read_bytes, read_bytes_with_options, ReadOptions};
+
+const X: &[f64] = &[10.0, 10.125, 10.25, 10.375, 10.5];
+const Y: &[f64] = &[4.0, 81.0, 144.0, 9.0, 1.0];
+
+fn assert_xy(bytes: &[u8], name: &str, x: &[f64], y: &[f64]) {
+    let p = read_bytes(bytes, name).unwrap_or_else(|e| panic!("{name}: {e}"));
+    assert_eq!(p.x.len(), x.len(), "{name}: point count");
+    assert_eq!(p.y, y, "{name}: intensity");
+    for (actual, expected) in p.x.iter().zip(x) {
+        assert!(
+            (actual - expected).abs() < 1e-10,
+            "{name}: {actual} != {expected}"
+        );
+    }
+}
+
+#[test]
+fn same_profile_across_all_text_formats() {
+    let fixtures: &[(&str, &[u8])] = &[
+        ("profile.xy", include_bytes!("data/formats/text/profile.xy")),
+        (
+            "profile.csv",
+            include_bytes!("data/formats/text/profile.csv"),
+        ),
+        (
+            "profile.fxye",
+            include_bytes!("data/formats/text/profile.fxye"),
+        ),
+        (
+            "profile.gsas",
+            include_bytes!("data/formats/text/profile.gsas"),
+        ),
+        (
+            "profile_esd.gsas",
+            include_bytes!("data/formats/text/profile_esd.gsas"),
+        ),
+        (
+            "profile.ras",
+            include_bytes!("data/formats/text/profile.ras"),
+        ),
+        (
+            "profile.uxd",
+            include_bytes!("data/formats/text/profile.uxd"),
+        ),
+        (
+            "profile.chi",
+            include_bytes!("data/formats/text/profile.chi"),
+        ),
+        (
+            "profile.cif",
+            include_bytes!("data/formats/text/profile.cif"),
+        ),
+    ];
+    for (name, bytes) in fixtures {
+        assert_xy(bytes, name, X, Y);
+    }
+}
+
+#[test]
+fn ascii_comments_bom_commas_and_unused_columns() {
+    let bytes = "\u{feff}# header\n! comment\n; comment\n' comment\n/ comment\n2theta,intensity\n10,4,ignored\n10.125 81 garbage\n";
+    assert_xy(bytes.as_bytes(), "pattern.xye", &X[..2], &Y[..2]);
+}
+
+#[test]
+fn ascii_utf16_bom_little_and_big_endian() {
+    let text = "# UTF-16 instrument export\n10 4\n10.125 81\n";
+    for little in [true, false] {
+        let mut bytes = if little {
+            vec![0xff, 0xfe]
+        } else {
+            vec![0xfe, 0xff]
+        };
+        for ch in text.encode_utf16() {
+            bytes.extend_from_slice(&if little {
+                ch.to_le_bytes()
+            } else {
+                ch.to_be_bytes()
+            });
+        }
+        assert_xy(&bytes, "pattern.xy", &X[..2], &Y[..2]);
+    }
+}
+
+#[test]
+fn ascii_common_extension_aliases() {
+    for name in ["pattern.dat", "pattern.prn", "pattern.txt", "pattern.XYE"] {
+        assert_xy(include_bytes!("data/formats/text/profile.xy"), name, X, Y);
+    }
+}
+
+#[test]
+fn ascii_empty_and_nonfinite_patterns_are_rejected() {
+    for text in [
+        "# no points\n",
+        "10 NaN\n",
+        "inf 10\n",
+        "10 inf\n",
+        "10 20\n10 30\n",
+    ] {
+        assert!(read_bytes(text, "pattern.xy").is_err(), "{text:?}");
+    }
+}
+
+#[test]
+fn descending_ascii_reverses_paired_values() {
+    assert_xy(
+        b"11 4\n10.5 9\n10 16\n",
+        "descending.xy",
+        &[10.0, 10.5, 11.0],
+        &[16.0, 9.0, 4.0],
+    );
+}
+
+#[test]
+fn gsas_esd_fixed_fields_keep_fused_intensities_and_zero_esd_points() {
+    let values = [
+        (2_000.0, 44.7),
+        (28_000.0, 167.3),
+        (101_641.3, 0.0),
+        (1_000_000.0, 1000.0),
+        (42.0, 6.5),
+    ];
+    let fields: String = values
+        .iter()
+        .flat_map(|(y, e)| [format!("{y:8.1}"), format!("{e:8.1}")])
+        .collect();
+    // 1_000_000.0 is wider than the 8-character format; use an integer field
+    // for this value to exercise a truly full-width fixed-format record.
+    let fields = fields.replace("1000000.0", " 1000000");
+    assert_eq!(fields.len(), 80);
+    let text = format!("BANK 1 5 1 CONS 1000 12.5 0 0 ESD\n{fields}\n");
+    assert_xy(
+        text.as_bytes(),
+        "profile.gsa",
+        X,
+        &[2_000.0, 28_000.0, 101_641.3, 1_000_000.0, 42.0],
+    );
+}
+
+#[test]
+fn gsas_esd_padding_and_short_final_record() {
+    let record = [4.0, 2.0, 81.0, 0.0, 144.0, 12.0, 0.0, 0.0, 0.0, 0.0]
+        .iter()
+        .map(|v| format!("{v:8.1}"))
+        .collect::<String>();
+    let text = format!("BANK 1 3 1 CONST 1000 12.5 0 0 ESD\n{record}\n");
+    assert_xy(text.as_bytes(), "profile.raw", &X[..3], &Y[..3]);
+    let text = "BANK 1 2 1 CONST 1000 12.5 ESD\n     4.0     2.0    81.0     0.0\n";
+    assert_xy(text.as_bytes(), "profile.gsas", &X[..2], &Y[..2]);
+}
+
+#[test]
+fn gsas_preserves_explicit_irregular_fxye_axis() {
+    let text = b"BANK 1 3 3 CONS 1000 1 0 0 FXYE\n1000 4 2\n1012.5 81 0\n1099 144 12\n";
+    assert_xy(text, "profile.fxye", &[10.0, 10.125, 10.99], &Y[..3]);
+}
+
+#[test]
+fn gsas_fxye_keeps_extra_endpoint_like_aps_11bm_exports() {
+    // The real 11BM_NAC.fxye has 59,498 complete rows but declares 59,497.
+    let text = b"BANK 1 2 2 CONS 1000 1 FXYE\n1000 4 2\n1012.5 81 0\n1025 144 12\n";
+    assert_xy(text, "profile.fxye", &X[..3], &Y[..3]);
+}
+
+#[test]
+fn gsas_bank_selection_is_zero_based() {
+    let bytes = b"BANK 1 2 1 CONS 1000 100 STD\n4 9\nBANK 7 2 1 CONS 2000 50 STD\n25 36\n";
+    let p = read_bytes_with_options(
+        bytes,
+        "pattern.gsas",
+        &ReadOptions {
+            index: 1,
+            block: None,
+        },
+    )
+    .unwrap();
+    assert_eq!(p.x, [20.0, 20.5]);
+    assert_eq!(p.y, [25.0, 36.0]);
+    assert!(read_bytes_with_options(
+        bytes,
+        "pattern.gsas",
+        &ReadOptions {
+            index: 2,
+            block: None
+        }
+    )
+    .is_err());
+}
+
+#[test]
+fn gsas_descending_constant_step_reverses_paired_values() {
+    let text = b"BANK 1 3 1 CONS 1100 -50 STD\n4 9 16\n";
+    assert_xy(text, "profile.gsas", &[10.0, 10.5, 11.0], &[16.0, 9.0, 4.0]);
+}
+
+#[test]
+fn gsas_refuses_non_angle_binning_and_unsupported_record_types() {
+    for bintype in [
+        "COND", "CONQ", "RALF", "SLOG", "TIME_MAP", "EDS", "LOG6", "LPSD", "MYSTERY",
+    ] {
+        let text = format!("BANK 1 2 2 {bintype} 1000 20 0 0 FXYE\n1000 4 2\n1020 9 3\n");
+        let err = read_bytes(text, "profile.gsas").unwrap_err().to_string();
+        assert!(err.contains(bintype), "{err}");
+    }
+    for flag in ["ALT", "FXY", "UNKNOWN"] {
+        let text = format!("BANK 1 2 2 CONS 1000 20 0 0 {flag}\n1000 4 2\n1020 9 3\n");
+        let err = read_bytes(text, "profile.gsas").unwrap_err().to_string();
+        assert!(err.contains(flag), "{err}");
+    }
+}
+
+#[test]
+fn gsas_refuses_truncated_and_corrupt_records() {
+    for text in [
+        "BANK 1 3 3 CONS 1000 20 STD\n4 9\n",
+        "BANK 1 2 2 CONS 1000 20 FXYE\n1000 4 2\n1020 9\n",
+        "BANK 1 2 2 CONS 1000 20 FXYE\n1000 4 2\n",
+        "BANK 1 2 2 CONS 1000 20 ESD\n     4.0     2.0 BADBAD!     3.0\n",
+        "BANK 1 1 1 CONS 1000 20 STD\n4 9\n",
+        "BANK 1 0 0 CONS 1000 20 STD\n",
+    ] {
+        assert!(read_bytes(text, "profile.gsas").is_err(), "{text}");
+    }
+}
+
+#[test]
+fn ras_scan_selection_and_descending_reversal() {
+    let bytes = include_bytes!("data/formats/text/profile.ras");
+    let p = read_bytes_with_options(
+        bytes,
+        "profile.ras",
+        &ReadOptions {
+            index: 1,
+            block: None,
+        },
+    )
+    .unwrap();
+    assert_eq!(p.x, [20.0, 20.25, 20.5]);
+    assert_eq!(p.y, [100.0, 64.0, 25.0]);
+    assert!(read_bytes_with_options(
+        bytes,
+        "profile.ras",
+        &ReadOptions {
+            index: 2,
+            block: None
+        }
+    )
+    .is_err());
+}
+
+#[test]
+fn ras_rejects_rocking_curves_count_mismatch_and_unclosed_blocks() {
+    let original = include_str!("data/formats/text/profile.ras");
+    assert!(read_bytes(original.replace("TwoThetaTheta", "Omega"), "profile.ras").is_err());
+    assert!(read_bytes(
+        original.replace("*MEAS_DATA_COUNT \"5\"", "*MEAS_DATA_COUNT \"6\""),
+        "profile.ras"
+    )
+    .is_err());
+    assert!(read_bytes(
+        b"*RAS_DATA_START\n*RAS_INT_START\n10 4\n11 9\n",
+        "profile.ras"
+    )
+    .is_err());
+    assert!(read_bytes(b"*RAS_DATA_START\n*RAS_INT_END\n", "profile.ras").is_err());
+}
+
+#[test]
+fn ras_ignores_legacy_encoded_comment_text() {
+    let mut bytes = b"*RAS_DATA_START\n*FILE_COMMENT \"".to_vec();
+    bytes.extend_from_slice(&[0x83, 0x65, 0x83, 0x58, 0x83, 0x67]);
+    bytes.extend_from_slice(b"\"\n*RAS_INT_START\n10 4\n11 9\n*RAS_INT_END\n");
+    assert_xy(&bytes, "profile.ras", &[10.0, 11.0], &[4.0, 9.0]);
+}
+
+#[test]
+fn uxd_selects_ranges_and_inherits_axis_parameters() {
+    let bytes = include_bytes!("data/formats/text/profile.uxd");
+    for index in [1, 2] {
+        let p = read_bytes_with_options(bytes, "profile.uxd", &ReadOptions { index, block: None })
+            .unwrap();
+        assert_eq!(
+            p.x,
+            if index == 1 {
+                vec![20.0, 20.25, 20.5]
+            } else {
+                vec![20.0, 20.125, 20.25]
+            }
+        );
+        assert_eq!(p.y, [100.0, 64.0, 25.0]);
+    }
+}
+
+#[test]
+fn uxd_all_four_markers_preserve_stored_intensity() {
+    for marker in ["_COUNTS", "_CPS", "_2THETACOUNTS", "_2THETACPS"] {
+        let data = if marker.starts_with("_2THETA") {
+            "10 4\n11 9\n"
+        } else {
+            "4 9\n"
+        };
+        let text = format!("_FILEVERSION=2\n_DRIVE='2THETA'\n_START=10\n_STEPSIZE=1\n_STEPTIME=50\n{marker}\n{data}");
+        assert_xy(text.as_bytes(), "profile.uxd", &[10.0, 11.0], &[4.0, 9.0]);
+    }
+}
+
+#[test]
+fn uxd_counts_only_descending_steps_reverse_paired_values() {
+    for (marker, values, expected) in [
+        ("_COUNTS", "9 25 49", [49.0, 25.0, 9.0]),
+        ("_CPS", "0.9 2.5 4.9", [4.9, 2.5, 0.9]),
+    ] {
+        let text = format!(
+            "_FILEVERSION=2\n_DRIVE='2THETA'\n_START=20.5\n_STEPSIZE=-0.25\n_STEPTIME=10\n{marker}\n{values}\n"
+        );
+        assert_xy(
+            text.as_bytes(),
+            "descending.uxd",
+            &[20.0, 20.25, 20.5],
+            &expected,
+        );
+    }
+}
+
+#[test]
+fn uxd_selects_descending_range_with_its_own_start_and_step() {
+    let bytes = b"_FILEVERSION=2\n_DRIVE='COUPLED'\n_START=10\n_STEPSIZE=0.5\n_COUNTS\n4 9\n_START=20.5\n_STEPSIZE=-0.25\n_CPS\n9.5 25.5 49.5\n_START=30\n_STEPSIZE=0.1\n_COUNTS\n1 2\n";
+    assert_xy(bytes, "ranges.uxd", &[10.0, 10.5], &[4.0, 9.0]);
+    let pattern = read_bytes_with_options(
+        bytes,
+        "ranges.uxd",
+        &ReadOptions {
+            index: 1,
+            block: None,
+        },
+    )
+    .unwrap();
+    assert_eq!(pattern.x, [20.0, 20.25, 20.5]);
+    assert_eq!(pattern.y, [49.5, 25.5, 9.5]);
+}
+
+#[test]
+fn uxd_counts_only_rejects_zero_and_nonfinite_steps() {
+    for marker in ["_COUNTS", "_CPS"] {
+        for step in ["0", "-0", "NaN", "inf", "-inf"] {
+            let text = format!(
+                "_FILEVERSION=2\n_DRIVE='2THETA'\n_START=20.5\n_STEPSIZE={step}\n{marker}\n9 25 49\n"
+            );
+            assert!(
+                read_bytes(text, "invalid-step.uxd").is_err(),
+                "{marker}: {step}"
+            );
+        }
+    }
+}
+
+#[test]
+fn uxd_rejects_non_diffraction_axes_and_missing_counts_axis() {
+    for text in [
+        "_FILEVERSION=2\n_DRIVE='THETA'\n_2THETACOUNTS\n10 4\n11 9\n",
+        "_FILEVERSION=2\n_COUNTS\n4 9\n",
+        "_FILEVERSION=2\n_START=10\n_STEPSIZE=0\n_COUNTS\n4 9\n",
+        "_FILEVERSION=2\n_UNKNOWN\n10 4\n11 9\n",
+        "_FILEVERSION=2\n_2THETACOUNTS\n10\n11\n",
+    ] {
+        assert!(read_bytes(text, "profile.uxd").is_err(), "{text}");
+    }
+}
+
+#[test]
+fn chi_count_header_never_becomes_a_point() {
+    assert_xy(
+        b"title\n2theta\ncounts\n2 1\n10 4\n11 9\n",
+        "pattern.chi",
+        &[10.0, 11.0],
+        &[4.0, 9.0],
+    );
+}
+
+#[test]
+fn chi_rejects_other_axes_and_invalid_headers() {
+    for label in [
+        "q (A^-1)",
+        "Q_nm^-1",
+        "d-spacing (A)",
+        "pixel radius",
+        "2theta (radians)",
+    ] {
+        let text = format!("title\n{label}\ncounts\n2 1\n10 4\n11 9\n");
+        assert!(read_bytes(text, "pattern.chi").is_err(), "{label}");
+    }
+    for text in [
+        "title\n2theta\ncounts\n3\n10 4\n11 9\n",
+        "title\n2theta\ncounts\n2\n10 4\n11\n",
+        "title\n2theta\ncounts\n2 2\n10 4\n11 9\n",
+    ] {
+        assert!(read_bytes(text, "pattern.chi").is_err(), "{text}");
+    }
+}
+
+#[test]
+fn pdcif_selects_matching_named_profile_block() {
+    let bytes = include_bytes!("data/formats/text/profile.cif");
+    let p = read_bytes_with_options(
+        bytes,
+        "profile.cif",
+        &ReadOptions {
+            index: 0,
+            block: Some("_other".into()),
+        },
+    )
+    .unwrap();
+    assert_eq!(p.x, [20.0, 20.25, 20.5]);
+    assert_eq!(p.y, [100.0, 64.0, 25.0]);
+    assert!(read_bytes_with_options(
+        bytes,
+        "profile.cif",
+        &ReadOptions {
+            index: 0,
+            block: Some("missing".into())
+        }
+    )
+    .is_err());
+}
+
+#[test]
+fn pdcif_profile_tag_priority_and_exponent_uncertainties() {
+    let text = b"data_profile\nloop_\n_PD_PROC_2THETA_CORRECTED\n_pd_meas_2theta_scan\n_pd_proc_intensity_total\n_pd_meas_counts_total\n1.00(2)e1 10.1 4(2) 40\n1.10(2)e1 11.1 9(3) 90\n";
+    assert_xy(text, "pattern.cif", &[10.0, 11.0], &[4.0, 9.0]);
+}
+
+#[test]
+fn pdcif_scalar_angular_range_builds_axis_for_counts_loop() {
+    let text = b"data_profile\n_pd_meas_2theta_range_min 10\n_pd_meas_2theta_range_max 11\n_pd_meas_2theta_range_inc .5\nloop_\n_pd_meas_intensity_total\n4 9 16\n";
+    assert_xy(text, "pattern.cif", &[10.0, 10.5, 11.0], &[4.0, 9.0, 16.0]);
+}
+
+#[test]
+fn pdcif_processed_angular_range_builds_axis_for_intensity_loop() {
+    for max in ["", "_pd_proc_2theta_range_max 11\n"] {
+        let text = format!(
+            "data_profile\n_pd_proc_2theta_range_min 10\n{max}_pd_proc_2theta_range_inc .5\nloop_\n_pd_proc_intensity_total\n4 9 16\n"
+        );
+        assert_xy(
+            text.as_bytes(),
+            "pattern.cif",
+            &[10.0, 10.5, 11.0],
+            &[4.0, 9.0, 16.0],
+        );
+    }
+}
+
+#[test]
+fn pdcif_processed_range_takes_priority_over_uncorrected_angles() {
+    let text = b"data_profile\n_pd_proc_2theta_range_min 10\n_pd_proc_2theta_range_max 11\n_pd_proc_2theta_range_inc .5\n_pd_meas_2theta_range_min 10.1\n_pd_meas_2theta_range_max 11.1\n_pd_meas_2theta_range_inc .5\nloop_\n_pd_meas_2theta_scan\n_pd_proc_intensity_total\n10.1 4\n10.6 9\n11.1 16\n";
+    assert_xy(text, "pattern.cif", &[10.0, 10.5, 11.0], &[4.0, 9.0, 16.0]);
+}
+
+#[test]
+fn pdcif_range_increment_is_not_an_angle_column() {
+    // One point is a valid profile, but an increment alone cannot locate it.
+    let text = b"data_profile\nloop_\n_pd_meas_2theta_range_inc\n_pd_meas_counts_total\n.5 4\n";
+    assert!(read_bytes(text, "pattern.cif").is_err());
+}
+
+#[test]
+fn pdcif_ranges_reject_nonpositive_steps_and_inconsistent_endpoints() {
+    for prefix in ["_pd_meas", "_pd_proc"] {
+        for (step, max) in [("0", "10"), ("-.5", "9"), (".5", "12")] {
+            let text = format!(
+                "data_profile\n{prefix}_2theta_range_min 10\n{prefix}_2theta_range_max {max}\n{prefix}_2theta_range_inc {step}\nloop_\n_pd_meas_counts_total\n4 9 16\n"
+            );
+            let err = read_bytes(text, "pattern.cif").unwrap_err().to_string();
+            let expected = if step == ".5" {
+                "angular range disagrees with point count"
+            } else {
+                "2theta increment must be positive"
+            };
+            assert!(err.contains(expected), "{prefix} {step}: {err}");
+        }
+    }
+}
+
+#[test]
+fn pdcif_rejects_incomplete_loops_missing_values_and_structure_only_cif() {
+    for text in [
+        "data_profile\nloop_\n_pd_meas_2theta_scan\n_pd_meas_counts_total\n10 4 11\n",
+        "data_profile\nloop_\n_pd_meas_2theta_scan\n_pd_meas_counts_total\n10 4\n11 ?\n",
+        "data_profile\nloop_\n_pd_meas_2theta_scan\n_pd_meas_counts_total\n10 4\n11 .\n",
+        "data_structure\n_cell_length_a 5.4\n",
+        "data_structure\n_chemical_name_common\n;never closes\n",
+        "data_structure\n_chemical_name_common 'never closes\n",
+    ] {
+        assert!(read_bytes(text, "pattern.cif").is_err(), "{text}");
+    }
+}
diff --git a/tests/xml_formats.rs b/tests/xml_formats.rs
new file mode 100644
index 0000000..089c224
--- /dev/null
+++ b/tests/xml_formats.rs
@@ -0,0 +1,324 @@
+use geddes::{read_bytes, read_bytes_with_options, ReadOptions};
+use std::io::{Cursor, Write};
+
+fn archive(members: &[(&str, &str)]) -> Vec<u8> {
+    let mut zip = zip::ZipWriter::new(Cursor::new(Vec::new()));
+    for (name, text) in members {
+        zip.start_file(*name, zip::write::SimpleFileOptions::default())
+            .unwrap();
+        zip.write_all(text.as_bytes()).unwrap();
+    }
+    zip.finish().unwrap().into_inner()
+}
+
+fn selected(bytes: &[u8], name: &str, index: usize) -> geddes::Pattern {
+    read_bytes_with_options(bytes, name, &ReadOptions { index, block: None }).unwrap()
+}
+
+fn xrdml_scan(axis: &str, positions: &str, values: &str) -> String {
+    format!("<scan scanAxis=\"{axis}\"><dataPoints><positions axis=\"2Theta\" unit=\"deg\">{positions}</positions>{values}</dataPoints></scan>")
+}
+
+fn xrdml(scans: &str) -> String {
+    format!("<xrdMeasurements><xrdMeasurement>{scans}</xrdMeasurement></xrdMeasurements>")
+}
+
+const RANGE: &str = "<startPosition>10</startPosition><endPosition>11</endPosition>";
+
+#[test]
+fn bundled_xml_containers_match_every_known_point() {
+    let expected_x = [10., 10.125, 10.25, 10.375, 10.5];
+    let expected_y = [4., 81., 144., 9., 1.];
+    for (bytes, name) in [
+        (
+            include_bytes!("data/formats/xml/synthetic.xrdml").as_slice(),
+            "synthetic.xrdml",
+        ),
+        (
+            include_bytes!("data/formats/xml/synthetic.rasx").as_slice(),
+            "synthetic.rasx",
+        ),
+        (
+            include_bytes!("data/formats/xml/synthetic.brml").as_slice(),
+            "synthetic.brml",
+        ),
+    ] {
+        let pattern = read_bytes(bytes, name).unwrap();
+        assert_eq!(pattern.x, expected_x, "{name}");
+        assert_eq!(pattern.y, expected_y, "{name}");
+    }
+}
+
+#[test]
+fn xrdml_corrects_counts_but_preserves_reported_intensities_and_cps() {
+    let factors = "<beamAttenuationFactors>100 10 1</beamAttenuationFactors><commonCountingTime>2</commonCountingTime>";
+    for (tag, unit, expected) in [
+        ("counts", "counts", vec![200., 30., 4.]),
+        ("intensities", "counts", vec![2., 3., 4.]),
+        ("intensities", "cps", vec![2., 3., 4.]),
+    ] {
+        let values = format!("{factors}<{tag} unit=\"{unit}\">2 3 4</{tag}>");
+        let source = xrdml(&xrdml_scan("Omega2Theta", RANGE, &values));
+        let p = read_bytes(source, "pattern.xrdml").unwrap();
+        assert_eq!(p.x, [10., 10.5, 11.]);
+        assert_eq!(p.y, expected);
+    }
+}
+
+#[test]
+fn xrdml_supports_position_layouts_namespaces_entities_cdata_and_bom() {
+    let source = "\u{feff}<x:xrdMeasurements xmlns:x=\"urn:test\"><x:xrdMeasurement><x:scan scanAxis=\"Gonio\"><x:dataPoints><x:positions axis=\"2Theta\" unit=\"deg\"><x:listPositions>10 10.3 11</x:listPositions></x:positions><x:counts><![CDATA[2 3]]>&#32;4</x:counts></x:dataPoints></x:scan></x:xrdMeasurement></x:xrdMeasurements>";
+    let p = read_bytes(source, "namespaced.xrdml").unwrap();
+    assert_eq!(p.x, [10., 10.3, 11.]);
+    assert_eq!(p.y, [2., 3., 4.]);
+    let single = xrdml(&xrdml_scan(
+        "2Theta",
+        "<commonPosition>&#49;0</commonPosition>",
+        "<counts>7</counts>",
+    ));
+    let p = read_bytes(single, "single.xrdml").unwrap();
+    assert_eq!(p.x, [10.]);
+    assert_eq!(p.y, [7.]);
+    let reversed = xrdml(&xrdml_scan(
+        "Gonio",
+        "<listPositions>11 10.5 10</listPositions>",
+        "<counts>2 3 4</counts>",
+    ));
+    let p = read_bytes(reversed, "reverse.xrdml").unwrap();
+    assert_eq!(p.x, [10., 10.5, 11.]);
+    assert_eq!(p.y, [4., 3., 2.]);
+}
+
+#[test]
+fn xrdml_accepts_escaped_ampersands_in_attributes() {
+    for description in [
+        "Research &amp; Development",
+        "Research &#38; Development",
+        "Research &#x26; Development",
+        "Literal &amp;custom; reference",
+    ] {
+        let source = xrdml(&xrdml_scan("&#71;onio", RANGE, "<counts>1 2</counts>")).replace(
+            "<xrdMeasurements>",
+            &format!("<xrdMeasurements description=\"{description}\">"),
+        );
+        let p = read_bytes(source, "attributes.xrdml").unwrap();
+        assert_eq!(p.x, [10., 11.]);
+        assert_eq!(p.y, [1., 2.]);
+    }
+}
+
+#[test]
+fn xrdml_selects_scans_across_measurements_without_merging() {
+    let first = xrdml_scan("Gonio", RANGE, "<counts>1 2</counts>");
+    let second = xrdml_scan("Gonio", RANGE, "<intensities>30 40</intensities>");
+    let source = format!("<xrdMeasurements><xrdMeasurement>{first}</xrdMeasurement><xrdMeasurement>{second}</xrdMeasurement></xrdMeasurements>");
+    assert_eq!(read_bytes(&source, "multi.xrdml").unwrap().y, [1., 2.]);
+    assert_eq!(selected(source.as_bytes(), "multi.xrdml", 1).y, [30., 40.]);
+    assert!(read_bytes_with_options(
+        source,
+        "multi.xrdml",
+        &ReadOptions {
+            index: 2,
+            block: None
+        }
+    )
+    .is_err());
+}
+
+#[test]
+fn xrdml_rejects_invalid_lengths_axes_units_and_truncated_xml() {
+    for scan in [
+        xrdml_scan(
+            "Gonio",
+            "<listPositions>10 11 12</listPositions>",
+            "<counts>1 2</counts>",
+        ),
+        xrdml_scan(
+            "Gonio",
+            RANGE,
+            "<counts>1 2</counts><beamAttenuationFactors>1</beamAttenuationFactors>",
+        ),
+        xrdml_scan(
+            "Gonio",
+            RANGE,
+            "<counts>1 2</counts><beamAttenuationFactors>1 0</beamAttenuationFactors>",
+        ),
+        xrdml_scan("Omega", RANGE, "<counts>1 2</counts>"),
+        xrdml_scan(
+            "Gonio",
+            "<commonPosition>10</commonPosition>",
+            "<counts>1 2</counts>",
+        ),
+        xrdml_scan("Gonio", RANGE, "<counts>1 nope</counts>"),
+        xrdml_scan("Gonio", RANGE, "<counts>1 NaN</counts>"),
+        xrdml_scan("Gonio", RANGE, "<counts/>"),
+    ] {
+        assert!(read_bytes(xrdml(&scan), "bad.xrdml").is_err(), "{scan}");
+    }
+    let valid = xrdml(&xrdml_scan("Gonio", RANGE, "<counts>1 2</counts>"));
+    assert!(read_bytes(
+        valid.replace("unit=\"deg\"", "unit=\"rad\""),
+        "radians.xrdml"
+    )
+    .is_err());
+    assert!(read_bytes(&valid[..valid.len() - 4], "truncated.xrdml").is_err());
+}
+
+#[test]
+fn rasx_follows_manifest_order_and_reads_only_the_selected_profile() {
+    let root = "<Root><Data9><ContentHashList Name=\"Profile9.txt\"/><ContentHashList Name=\"Conditions9.xml\"/></Data9><Data1><ContentHashList Name=\"Profile1.txt\"/></Data1></Root>";
+    let conditions = "<MeasurementConditions><Other><AxisName>Omega</AxisName></Other><ScanInformation><AxisName>TwoThetaOmega</AxisName></ScanInformation></MeasurementConditions>";
+    let bytes = archive(&[
+        ("Data1/Profile1.txt", "20 9\n20.1 10\n20.2 11\n"),
+        ("Data9/Conditions9.xml", conditions),
+        ("Data9/Profile9.txt", "\u{feff}10 4 100\n10.125 81 1\n"),
+        ("root.xml", root),
+    ]);
+    let first = read_bytes(&bytes, "any.dat").unwrap();
+    assert_eq!(first.x, [10., 10.125]);
+    assert_eq!(first.y, [4., 81.]); // Rigaku's third column is preserved by ignoring it.
+    let second = selected(&bytes, "any.dat", 1);
+    assert_eq!(second.x, [20., 20.1, 20.2]);
+    assert_eq!(second.y, [9., 10., 11.]);
+    assert!(read_bytes_with_options(
+        bytes,
+        "many.rasx",
+        &ReadOptions {
+            index: 2,
+            block: None
+        }
+    )
+    .is_err());
+}
+
+#[test]
+fn rasx_decodes_manifest_attributes_exactly_once() {
+    for (encoded_name, member_name) in [
+        ("Profile&amp;amp;.txt", "Data0/Profile&amp;.txt"),
+        ("Profile&amp;#49;.txt", "Data0/Profile&#49;.txt"),
+        ("Profile&amp;.txt", "Data0/Profile&.txt"),
+    ] {
+        let root =
+            format!("<Root><Data0><ContentHashList Name=\"{encoded_name}\"/></Data0></Root>");
+        let bytes = archive(&[("root.xml", &root), (member_name, "10 4\n11 5\n")]);
+        let p = read_bytes(bytes, "attributes.rasx").unwrap();
+        assert_eq!(p.x, [10., 11.]);
+        assert_eq!(p.y, [4., 5.]);
+    }
+}
+
+#[test]
+fn rasx_rejects_missing_members_bad_rows_and_non_diffraction_scans() {
+    let root = "<Root><Data0><ContentHashList Name=\"Profile0.txt\"/><ContentHashList Name=\"Conditions.xml\"/></Data0></Root>";
+    let conditions = "<MeasurementConditions><ScanInformation><AxisName>Omega</AxisName></ScanInformation></MeasurementConditions>";
+    for members in [
+        vec![("root.xml", root)],
+        vec![("Data0/Profile0.txt", "10 4\n11 5\n")],
+        vec![
+            ("root.xml", root),
+            ("Data0/Profile0.txt", "10 4\n11 5\n"),
+            ("Data0/Conditions.xml", conditions),
+        ],
+        vec![
+            (
+                "root.xml",
+                "<Root><Data0><ContentHashList Name=\"Profile0.txt\"/></Data0></Root>",
+            ),
+            ("Data0/Profile0.txt", "10 4\n11\n"),
+        ],
+    ] {
+        assert!(read_bytes(archive(&members), "bad.rasx").is_err());
+    }
+}
+
+fn brml_route(flag: &str, axis: &str, width: usize, values: &[i32]) -> String {
+    let rows: String = values
+        .iter()
+        .enumerate()
+        .map(|(i, y)| {
+            let angle = 10. + i as f64 * 0.125;
+            format!("<Datum>1,{y},0,{},{} </Datum>", angle / 2., angle)
+        })
+        .collect();
+    format!("<DataRoute RouteFlag=\"{flag}\"><DataViews><RawDataView xsi:type=\"VaryingRawDataView\" Start=\"3\" Length=\"2\"><FieldDefinitions AxisId=\"Theta\"/>{axis}</RawDataView><RawDataView xsi:type=\"RecordedRawDataView\" Start=\"1\" Length=\"{width}\"/></DataViews>{rows}</DataRoute>")
+}
+
+fn raw_data(routes: &str) -> String {
+    format!("<RawData xmlns:xsi=\"http://www.w3.org/2001/XMLSchema-instance\">{routes}</RawData>")
+}
+
+const TWO_THETA: &str = "<FieldDefinitions AxisId=\"TwoTheta\"/>";
+
+fn brml_single(routes: &str) -> Vec<u8> {
+    archive(&[
+        ("Experiment0/DataContainer.xml", "<DataContainer><RawDataReferenceList><string>Experiment0/RawData0.xml</string></RawDataReferenceList></DataContainer>"),
+        ("Experiment0/RawData0.xml", &raw_data(routes)),
+    ])
+}
+
+#[test]
+fn brml_reads_dynamic_columns_and_chooses_measured_route() {
+    let measured = brml_route(
+        "Measured",
+        "<FieldDefinitions AxisId=\"\" FieldName=\" TwoTheta \"/>",
+        1,
+        &[4, 81, 144],
+    );
+    let processed = brml_route("Processed", TWO_THETA, 1, &[999, 999, 999]);
+    let bytes = brml_single(&(processed.clone() + &measured));
+    let p = read_bytes(bytes, "channels.brml").unwrap();
+    assert_eq!(p.x, [10., 10.125, 10.25]);
+    assert_eq!(p.y, [4., 81., 144.]);
+    assert_eq!(
+        read_bytes(brml_single(&processed), "only.brml").unwrap().y,
+        [999., 999., 999.]
+    );
+    assert!(read_bytes(
+        brml_single(&(measured.clone() + &measured)),
+        "ambiguous.brml"
+    )
+    .is_err());
+}
+
+#[test]
+fn brml_scan_selection_uses_manifest_order_instead_of_zip_order() {
+    let first = raw_data(&brml_route("Measured", TWO_THETA, 1, &[4, 81]));
+    let second = raw_data(&brml_route("Measured", TWO_THETA, 1, &[144, 9, 1]));
+    let bytes = archive(&[
+        ("Experiment0/RawData1.xml", &second),
+        ("Experiment0/RawData9.xml", &first),
+        ("Experiment0/DataContainer.xml", "<DataContainer><RawDataReferenceList><string>Experiment0/RawData9.xml</string><string>Experiment0/RawData1.xml</string></RawDataReferenceList></DataContainer>"),
+    ]);
+    assert_eq!(read_bytes(&bytes, "generic.bin").unwrap().y, [4., 81.]);
+    assert_eq!(selected(&bytes, "generic.bin", 1).y, [144., 9., 1.]);
+    assert!(read_bytes_with_options(
+        bytes,
+        "many.brml",
+        &ReadOptions {
+            index: 2,
+            block: None
+        }
+    )
+    .is_err());
+}
+
+#[test]
+fn brml_rejects_detector_frames_non_two_theta_and_missing_data() {
+    for route in [
+        brml_route("Measured", TWO_THETA, 2, &[4, 81]),
+        brml_route(
+            "Measured",
+            "<FieldDefinitions AxisId=\"Chi\"/>",
+            1,
+            &[4, 81],
+        ),
+        brml_route("Measured", TWO_THETA, 1, &[]),
+        brml_route("Measured", TWO_THETA, 1, &[4, 81]).replace("Start=\"1\"", "Start=\"99\""),
+        brml_route("Measured", TWO_THETA, 1, &[4, 81])
+            .replace("<Datum>1,4,0,5,10 </Datum>", "<Datum>1,4</Datum>"),
+    ] {
+        assert!(read_bytes(brml_single(&route), "invalid.brml").is_err());
+    }
+    let missing = archive(&[("DataContainer.xml", "<DataContainer><RawDataReferenceList><string>Missing.xml</string></RawDataReferenceList></DataContainer>")]);
+    assert!(read_bytes(missing, "missing.brml").is_err());
+}
diff --git a/zensical.toml b/zensical.toml
new file mode 100644
index 0000000..11f5fe1
--- /dev/null
+++ b/zensical.toml
@@ -0,0 +1,50 @@
+[project]
+site_name = "Geddes"
+site_url = "https://jcwang587.github.io/geddes/"
+site_description = "Read XRD patterns as 2θ and intensity arrays in Rust, Python, and Node.js."
+repo_url = "https://github.com/jcwang587/geddes"
+repo_name = "jcwang587/geddes"
+docs_dir = "docs"
+site_dir = "site"
+nav = [
+  { "Getting started" = "index.md" },
+  { "Usage" = "reading-patterns.md" },
+  { "Formats" = "formats.md" },
+  { "API reference" = "api.md" },
+]
+
+[project.theme]
+custom_dir = "overrides"
+language = "en"
+features = [
+  "content.code.copy",
+  "content.tabs.link",
+  "navigation.footer",
+  "navigation.top",
+  "toc.follow",
+  "search.highlight",
+]
+
+[[project.theme.palette]]
+scheme = "default"
+primary = "indigo"
+toggle.icon = "lucide/sun"
+toggle.name = "Switch to dark mode"
+
+[[project.theme.palette]]
+scheme = "slate"
+primary = "indigo"
+toggle.icon = "lucide/moon"
+toggle.name = "Switch to light mode"
+
+[project.markdown_extensions]
+attr_list = {}
+tables = {}
+toc.permalink = true
+pymdownx.highlight.anchor_linenums = true
+pymdownx.highlight.line_spans = "__span"
+pymdownx.highlight.pygments_lang_class = true
+pymdownx.inlinehilite = {}
+pymdownx.superfences = {}
+pymdownx.tabbed.alternate_style = true
+pymdownx.tabbed.combine_header_slug = true