@<TRIPOS>MOLECULE
FDBF01029
 19 19 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         3.1430    4.7990   -0.3250 C.3     1  FRG1       -0.0320
      2  C2         3.0020    5.9910    0.5760 C.3     1  FRG1       -0.0492
      3  C3         1.8860    5.6190   -0.3570 C.3     1  FRG1       -0.0492
      4  C1         3.0760    3.4440    0.2950 C.3     1  FRG1       -0.0035
      5  S1         2.3850    2.2470   -0.8630 S.3     1  FRG1       -0.1607
      6  C1         2.6360   -0.4980   -0.6420 C.3     1  FRG1       -0.0562
      7  C1         2.4710    0.7700    0.2440 C.3     1  FRG1       -0.0091
      8 H           3.8589    4.4822   -1.0544 H       1  FRG1        0.0309
      9 H           2.8858    5.8536    1.6308 H       1  FRG1        0.0268
     10 H           3.5755    6.8765    0.7545 H       1  FRG1        0.0268
     11 H           0.9745    5.2164    0.0328 H       1  FRG1        0.0268
     12 H           1.3347    6.1295   -1.1188 H       1  FRG1        0.0268
     13 H           4.0623    3.1355    0.5724 H       1  FRG1        0.0379
     14 H           2.4454    3.4913    1.1581 H       1  FRG1        0.0379
     15 H           2.6878   -1.3653   -0.0174 H       1  FRG1        0.0238
     16 H           3.5355   -0.4175   -1.2159 H       1  FRG1        0.0238
     17 H           1.7982   -0.5833   -1.3021 H       1  FRG1        0.0238
     18 H           1.5709    0.6954    0.8178 H       1  FRG1        0.0374
     19 H           3.2999    0.8606    0.9146 H       1  FRG1        0.0374
@<TRIPOS>BOND
     1     5     7    1
     2     5     4    1
     3     6     7    1
     4     3     1    1
     5     3     2    1
     6     1     4    1
     7     1     2    1
     8     1     8    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     6    15    1
    16     6    16    1
    17     6    17    1
    18     7    18    1
    19     7    19    1