@<TRIPOS>MOLECULE
FDBF00087
 21 20 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1        -3.8920   -0.3670    0.3290 C.3     1  FRG1       -0.0468
      2  C1        -3.0950    2.5860    0.7610 C.3     1  FRG1       -0.0348
      3  C1        -3.7510    2.0080   -0.4640 C.2     1  FRG1       -0.0882
      4  C2        -4.1060    0.7310   -0.6730 C.2     1  FRG1       -0.0910
      5  C1         0.7600    2.7870    0.0370 C.3     1  FRG1       -0.0653
      6  C1        -0.6520    2.2000    0.1140 C.3     1  FRG1       -0.0556
      7  C1        -1.6980    3.2040    0.6150 C.3     1  FRG1       -0.0499
      8 H          -4.2575   -1.2901   -0.0699 H       1  FRG1        0.0272
      9 H          -4.4190   -0.1346    1.2308 H       1  FRG1        0.0272
     10 H          -2.8470   -0.4586    0.5401 H       1  FRG1        0.0272
     11 H          -3.0193    1.7984    1.4813 H       1  FRG1        0.0307
     12 H          -3.7213    3.4101    1.0320 H       1  FRG1        0.0307
     13 H          -3.9506    2.6693   -1.2307 H       1  FRG1        0.0569
     14 H          -4.5509    0.4899   -1.5724 H       1  FRG1        0.0566
     15 H           1.4382    2.0393   -0.3177 H       1  FRG1        0.0230
     16 H           1.0646    3.1122    1.0098 H       1  FRG1        0.0230
     17 H           0.7639    3.6197   -0.6349 H       1  FRG1        0.0230
     18 H          -0.6366    1.3637    0.7813 H       1  FRG1        0.0263
     19 H          -0.9331    1.9172   -0.8789 H       1  FRG1        0.0263
     20 H          -1.7541    4.0148   -0.0809 H       1  FRG1        0.0268
     21 H          -1.3890    3.5334    1.5850 H       1  FRG1        0.0268
@<TRIPOS>BOND
     1     4     3    2
     2     4     1    1
     3     3     2    1
     4     5     6    1
     5     6     7    1
     6     7     2    1
     7     1     8    1
     8     1     9    1
     9     1    10    1
    10     2    11    1
    11     2    12    1
    12     3    13    1
    13     4    14    1
    14     5    15    1
    15     5    16    1
    16     5    17    1
    17     6    18    1
    18     6    19    1
    19     7    20    1
    20     7    21    1