@<TRIPOS>MOLECULE
FDBD00047
 17 16 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1 O          -1.7106   -1.1847    0.3581 O.3     1   UNK        -0.3861
      2 O1          0.9758   -1.6811    0.1310 O.co2   1   UNK        -0.5441
      3 O2          2.0214    0.1505   -0.7007 O.co2   1   UNK        -0.5441
      4 N           0.4053    1.8669    0.5743 N.4     1   UNK         0.2268
      5 C          -1.3544    0.1880    0.2043 C.3     1   UNK         0.1002
      6 C1          0.0664    0.4488    0.7285 C.3     1   UNK         0.0421
      7 C2         -1.5255    0.5514   -1.2654 C.3     1   UNK        -0.0333
      8 C3          1.1216   -0.3398   -0.0300 C.2     1   UNK         0.0919
      9 H          -1.6102   -1.4426    1.2878 H       1   UNK         0.2100
     10 H1         -0.2805    2.4362    1.0703 H       1   UNK         0.2001
     11 H2          0.3988    2.1123   -0.4157 H       1   UNK         0.2001
     12 H3          1.3334    2.0387    0.9611 H       1   UNK         0.2001
     13 H4         -1.9927    0.8166    0.7894 H       1   UNK         0.0651
     14 H5          0.0656    0.1462    1.7548 H       1   UNK         0.0940
     15 H6         -0.8920   -0.0706   -1.8627 H       1   UNK         0.0257
     16 H7         -1.2594    1.5773   -1.4125 H       1   UNK         0.0257
     17 H8         -2.5453    0.4027   -1.5532 H       1   UNK         0.0257
@<TRIPOS>BOND
     1     1     5    1
     2     2     8   ar
     3     3     8   ar
     4     4     6    1
     5     5     6    1
     6     5     7    1
     7     6     8    1
     8     1     9    1
     9     4    10    1
    10     4    11    1
    11     4    12    1
    12     5    13    1
    13     6    14    1
    14     7    15    1
    15     7    16    1
    16     7    17    1