amino-guesser/Alanine.sdf at main · biocodeit/amino-guesser · GitHub

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ALA
  CCTOOLS-1004241126

 13 12  0  0  1  0  0  0  0  0999 V2000
   -0.9660    0.4930    1.5000 N   0  0  0  0  0
    0.2570    0.4180    0.6920 C   0  0  0  0  0
   -0.0940    0.0170   -0.7160 C   0  0  0  0  0
   -1.0560   -0.6820   -0.9230 O   0  0  0  0  0
    1.2040   -0.6200    1.2960 C   0  0  0  0  0
    0.6610    0.4390   -1.7420 O   0  0  0  0  0
   -1.3830   -0.4250    1.4820 H   0  0  0  0  0
   -0.6760    0.6610    2.4520 H   0  0  0  0  0
    0.7460    1.3920    0.6820 H   0  0  0  0  0
    1.4590   -0.3300    2.3160 H   0  0  0  0  0
    0.7150   -1.5940    1.3070 H   0  0  0  0  0
    2.1130   -0.6760    0.6970 H   0  0  0  0  0
    0.4350    0.1820   -2.6470 H   0  0  0  0  0
  1  2  1  0  0  0
  1  7  1  0  0  0
  1  8  1  0  0  0
  2  3  1  0  0  0
  2  5  1  0  0  0
  2  9  1  0  0  0
  3  4  2  0  0  0
  3  6  1  0  0  0
  5 10  1  0  0  0
  5 11  1  0  0  0
  5 12  1  0  0  0
  6 13  1  0  0  0
M  END
$$$$