@<TRIPOS>MOLECULE
FDBF00666
 27 27 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1        -3.6040    2.2470   -0.6090 C.3     1  FRG1       -0.0153
      2  C5        -3.4970    3.7420   -0.3520 C.3     1  FRG1       -0.0605
      3  C1        -2.4850    1.4810    0.0920 C.3     1  FRG1       -0.0322
      4  N1        -2.5970    0.0440   -0.1880 N.4     1  FRG1        0.2352
      5  C2        -1.4710   -0.7190    0.3830 C.3     1  FRG1       -0.0319
      6  C3        -1.6130   -2.2270    0.1330 C.3     1  FRG1       -0.0123
      7  C4        -2.9480   -2.7570    0.6370 C.3     1  FRG1       -0.0434
      8  C5        -4.0880   -1.9340    0.0560 C.3     1  FRG1       -0.0123
      9  C6        -3.8860   -0.4450    0.3340 C.3     1  FRG1       -0.0319
     10 H          -3.5411    2.0692   -1.6623 H       1  FRG1        0.0314
     11 H          -4.5409    1.9045   -0.2220 H       1  FRG1        0.0314
     12 H          -2.5647    4.1035   -0.7328 H       1  FRG1        0.0232
     13 H          -3.5484    3.9275    0.7005 H       1  FRG1        0.0232
     14 H          -4.3026    4.2468   -0.8429 H       1  FRG1        0.0232
     15 H          -2.5552    1.6413    1.1476 H       1  FRG1        0.0814
     16 H          -1.5421    1.8335   -0.2708 H       1  FRG1        0.0814
     17 H          -2.5593   -0.0965   -1.1976 H       1  FRG1        0.2033
     18 H          -1.4360   -0.5455    1.4383 H       1  FRG1        0.0814
     19 H          -0.5720   -0.3881   -0.0936 H       1  FRG1        0.0814
     20 H          -0.8225   -2.7388    0.6409 H       1  FRG1        0.0317
     21 H          -1.5632   -2.3967   -0.9223 H       1  FRG1        0.0317
     22 H          -3.0597   -3.7781    0.3373 H       1  FRG1        0.0269
     23 H          -2.9730   -2.6870    1.7044 H       1  FRG1        0.0269
     24 H          -4.1284   -2.0901   -1.0018 H       1  FRG1        0.0317
     25 H          -5.0023   -2.2456    0.5163 H       1  FRG1        0.0317
     26 H          -4.6778    0.1039   -0.1314 H       1  FRG1        0.0814
     27 H          -3.8884   -0.3034    1.3946 H       1  FRG1        0.0814
@<TRIPOS>BOND
     1     1     2    1
     2     1     3    1
     3     4     3    1
     4     4     9    1
     5     4     5    1
     6     8     9    1
     7     8     7    1
     8     6     5    1
     9     6     7    1
    10     1    10    1
    11     1    11    1
    12     2    12    1
    13     2    13    1
    14     2    14    1
    15     3    15    1
    16     3    16    1
    17     4    17    1
    18     5    18    1
    19     5    19    1
    20     6    20    1
    21     6    21    1
    22     7    22    1
    23     7    23    1
    24     8    24    1
    25     8    25    1
    26     9    26    1
    27     9    27    1