@<TRIPOS>MOLECULE
FDBF03992
 29 31 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  O1        -2.2850   -2.0870    0.2790 O.2     1  FRG1       -0.2677
      2  C2        -1.9210   -0.9190    0.1410 C.ar    1  FRG1        0.2515
      3  N3        -0.6080   -0.5140   -0.1630 N.ar    1  FRG1       -0.3115
      4  C4         0.3740   -1.5790   -0.4080 C.3     1  FRG1        0.0340
      5  C5         1.8340   -1.1480   -0.6110 C.3     1  FRG1        0.0179
      6  C6         1.8570    0.1290   -1.4410 C.3     1  FRG1       -0.0307
      7  C7         1.1720    1.2110   -0.6100 C.3     1  FRG1        0.0400
      8  C8         1.9490    1.4170    0.7080 C.3     1  FRG1       -0.0253
      9  N9         2.0330    0.1880    1.5020 N.4     1  FRG1        0.2277
     10  C10        2.5750   -0.9240    0.7210 C.3     1  FRG1       -0.0291
     11  C16       -0.2700    0.8350   -0.3220 C.ar    1  FRG1        0.0302
     12  C17       -1.2120    1.7860   -0.2000 C.ar    1  FRG1       -0.0416
     13  C18       -2.5690    1.4390    0.1140 C.ar    1  FRG1       -0.0550
     14  C19       -2.9300    0.1660    0.2910 C.ar    1  FRG1        0.0030
     15 H           0.0673   -2.1046   -1.2881 H       1  FRG1        0.0497
     16 H           0.3790   -2.1638    0.4880 H       1  FRG1        0.0497
     17 H           2.3452   -1.9387   -1.1192 H       1  FRG1        0.0370
     18 H           1.3282   -0.0195   -2.3593 H       1  FRG1        0.0278
     19 H           2.8606    0.4102   -1.6830 H       1  FRG1        0.0278
     20 H           1.1698    2.1259   -1.1648 H       1  FRG1        0.0416
     21 H           1.4520    2.1673    1.2868 H       1  FRG1        0.0820
     22 H           2.9460    1.7136    0.4573 H       1  FRG1        0.0820
     23 H           1.0985   -0.0605    1.8266 H       1  FRG1        0.2014
     24 H           2.6593    0.3595    2.2886 H       1  FRG1        0.2014
     25 H           3.6036   -0.7204    0.5079 H       1  FRG1        0.0817
     26 H           2.4538   -1.8120    1.3055 H       1  FRG1        0.0817
     27 H          -0.9567    2.7770   -0.3336 H       1  FRG1        0.0635
     28 H          -3.2764    2.1850    0.2043 H       1  FRG1        0.0620
     29 H          -3.9065   -0.0658    0.5313 H       1  FRG1        0.0672
@<TRIPOS>BOND
     1     1     2    2
     2     2     3   ar
     3     2    14   ar
     4     3     4    1
     5     3    11   ar
     6     4     5    1
     7     5     6    1
     8     5    10    1
     9     6     7    1
    10     7     8    1
    11     7    11    1
    12     8     9    1
    13     9    10    1
    14    11    12   ar
    15    12    13   ar
    16    13    14   ar
    17     4    15    1
    18     4    16    1
    19     5    17    1
    20     6    18    1
    21     6    19    1
    22     7    20    1
    23     8    21    1
    24     8    22    1
    25     9    23    1
    26     9    24    1
    27    10    25    1
    28    10    26    1
    29    12    27    1
    30    13    28    1
    31    14    29    1