@<TRIPOS>MOLECULE
FDBF01746
 13 13 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  S1        -2.2490   -0.8430    0.0000 S.2     1  FRG1       -0.0129
      2  C2        -0.6320   -0.4710   -0.0000 C.ar    1  FRG1        0.1577
      3  N3         0.0190    0.7910   -0.0000 N.ar    1  FRG1       -0.3295
      4  C4         1.3830    0.5700    0.0000 C.ar    1  FRG1        0.0225
      5  C5         1.6190   -0.7480    0.0000 C.ar    1  FRG1        0.0201
      6  N6         0.4220   -1.4170    0.0000 N.ar    1  FRG1       -0.3403
      7  C10       -0.5620    2.1180    0.0000 C.3     1  FRG1        0.0137
      8 H           2.1067    1.3057    0.0000 H       1  FRG1        0.0824
      9 H           2.5518   -1.1894    0.0000 H       1  FRG1        0.0822
     10 H           0.3130   -2.3955    0.0000 H       1  FRG1        0.1673
     11 H          -1.6292    2.0401    0.0000 H       1  FRG1        0.0456
     12 H          -0.2430    2.6470   -0.8737 H       1  FRG1        0.0456
     13 H          -0.2430    2.6470    0.8736 H       1  FRG1        0.0456
@<TRIPOS>BOND
     1     1     2    2
     2     2     3   ar
     3     2     6   ar
     4     3     4   ar
     5     3     7    1
     6     4     5   ar
     7     5     6   ar
     8     4     8    1
     9     5     9    1
    10     6    10    1
    11     7    11    1
    12     7    12    1
    13     7    13    1