@<TRIPOS>MOLECULE
FDBF01019
 17 17 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         3.1430    4.7990   -0.3250 C.3     1  FRG1       -0.0269
      2  C2         3.0020    5.9910    0.5760 C.3     1  FRG1       -0.0468
      3  C3         1.8860    5.6190   -0.3570 C.3     1  FRG1       -0.0468
      4  C1         3.0760    3.4440    0.2950 C.3     1  FRG1       -0.0592
      5  C1         4.0730    4.9050   -1.4820 C.3     1  FRG1       -0.0078
      6  O5         6.0810    3.9760   -2.2890 O.co2   1  FRG1       -0.5498
      7  C6         5.4780    4.4510   -1.1700 C.2     1  FRG1        0.0423
      8  O7         6.0170    4.4950   -0.0740 O.co2   1  FRG1       -0.5498
      9 H           2.8858    5.8536    1.6308 H       1  FRG1        0.0271
     10 H           3.5755    6.8765    0.7545 H       1  FRG1        0.0271
     11 H           0.9745    5.2164    0.0328 H       1  FRG1        0.0271
     12 H           1.3347    6.1295   -1.1188 H       1  FRG1        0.0271
     13 H           3.1912    2.6985   -0.4638 H       1  FRG1        0.0235
     14 H           2.1290    3.3188    0.7772 H       1  FRG1        0.0235
     15 H           3.8597    3.3427    1.0164 H       1  FRG1        0.0235
     16 H           3.6916    4.3018   -2.2792 H       1  FRG1        0.0330
     17 H           4.1287    5.9403   -1.7465 H       1  FRG1        0.0330
@<TRIPOS>BOND
     1     6     7   ar
     2     5     7    1
     3     5     1    1
     4     7     8   ar
     5     3     1    1
     6     3     2    1
     7     1     4    1
     8     1     2    1
     9     2     9    1
    10     2    10    1
    11     3    11    1
    12     3    12    1
    13     4    13    1
    14     4    14    1
    15     4    15    1
    16     5    16    1
    17     5    17    1