@<TRIPOS>MOLECULE
FDBF01026
 22 22 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         2.9830   -1.7730    0.1490 C.3     1  FRG1       -0.0640
      2  S1         2.3850    2.2470   -0.8630 S.3     1  FRG1       -0.1702
      3  C1         2.6360   -0.4980   -0.6420 C.3     1  FRG1       -0.0402
      4  C1         1.3280    0.7650    1.2020 C.ar    1  FRG1       -0.0347
      5  C2         0.0240    0.6170    0.7310 C.ar    1  FRG1       -0.0575
      6  C3        -1.0450    0.6130    1.6270 C.ar    1  FRG1       -0.0615
      7  C4        -0.8100    0.7560    2.9940 C.ar    1  FRG1       -0.0617
      8  C5         0.4950    0.9040    3.4650 C.ar    1  FRG1       -0.0615
      9  C6         1.5640    0.9090    2.5700 C.ar    1  FRG1       -0.0575
     10  C1         2.4710    0.7700    0.2440 C.3     1  FRG1        0.0270
     11 H           3.0794   -2.5969   -0.5269 H       1  FRG1        0.0230
     12 H           2.2043   -1.9788    0.8534 H       1  FRG1        0.0230
     13 H           3.9064   -1.6292    0.6701 H       1  FRG1        0.0230
     14 H           3.4362    2.2287   -1.7258 H       1  FRG1        0.1022
     15 H           1.7173   -0.6655   -1.1644 H       1  FRG1        0.0276
     16 H           3.4566   -0.3100   -1.3024 H       1  FRG1        0.0276
     17 H          -0.1502    0.5104   -0.2806 H       1  FRG1        0.0621
     18 H          -2.0101    0.5042    1.2781 H       1  FRG1        0.0618
     19 H          -1.6009    0.7524    3.6570 H       1  FRG1        0.0618
     20 H           0.6691    1.0099    4.4767 H       1  FRG1        0.0618
     21 H           2.5290    1.0191    2.9188 H       1  FRG1        0.0621
     22 H           3.3291    0.7932    0.8828 H       1  FRG1        0.0458
@<TRIPOS>BOND
     1     2    10    1
     2     3     1    1
     3     3    10    1
     4    10     4    1
     5     5     4   ar
     6     5     6   ar
     7     4     9   ar
     8     6     7   ar
     9     9     8   ar
    10     7     8   ar
    11     1    11    1
    12     1    12    1
    13     1    13    1
    14     2    14    1
    15     3    15    1
    16     3    16    1
    17     5    17    1
    18     6    18    1
    19     7    19    1
    20     8    20    1
    21     9    21    1
    22    10    22    1