@<TRIPOS>MOLECULE
FDBF00118
 27 26 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         7.7250   -1.1770    0.3660 C.3     1  FRG1       -0.0407
      2  C4         8.1060    0.3090    0.3500 C.3     1  FRG1       -0.0621
      3  C8         8.8690   -1.9850   -0.2640 C.3     1  FRG1       -0.0621
      4  C1         3.3700    1.0140    0.2900 C.3     1  FRG1       -0.0376
      5  C4         3.6800    2.5130    0.2830 C.3     1  FRG1       -0.0618
      6  C1         6.3710   -1.4430   -0.3520 C.3     1  FRG1       -0.0234
      7  C5         5.9880   -2.9280   -0.3500 C.3     1  FRG1       -0.0587
      8  C1         4.5040    0.2490   -0.3500 C.2     1  FRG1       -0.0879
      9  C2         5.2430   -0.6670    0.2940 C.2     1  FRG1       -0.0849
     10 H           7.5839   -1.4889    1.3797 H       1  FRG1        0.0301
     11 H           8.2492    0.6296   -0.6607 H       1  FRG1        0.0233
     12 H           9.0122    0.4508    0.9009 H       1  FRG1        0.0233
     13 H           7.3223    0.8830    0.7987 H       1  FRG1        0.0233
     14 H           9.0100   -1.6729   -1.2777 H       1  FRG1        0.0233
     15 H           8.6243   -3.0264   -0.2422 H       1  FRG1        0.0233
     16 H           9.7698   -1.8186    0.2889 H       1  FRG1        0.0233
     17 H           3.2446    0.6828    1.2997 H       1  FRG1        0.0305
     18 H           2.4714    0.8386   -0.2638 H       1  FRG1        0.0305
     19 H           4.5781    2.6941    0.8357 H       1  FRG1        0.0233
     20 H           2.8698    3.0469    0.7341 H       1  FRG1        0.0233
     21 H           3.8087    2.8459   -0.7257 H       1  FRG1        0.0233
     22 H           6.5122   -1.1197   -1.3622 H       1  FRG1        0.0343
     23 H           5.8451   -3.2581    0.6577 H       1  FRG1        0.0235
     24 H           6.7705   -3.4988   -0.8048 H       1  FRG1        0.0235
     25 H           5.0811   -3.0632   -0.9016 H       1  FRG1        0.0235
     26 H           4.7231    0.4420   -1.3398 H       1  FRG1        0.0569
     27 H           5.0304   -0.8533    1.2865 H       1  FRG1        0.0572
@<TRIPOS>BOND
     1     6     7    1
     2     6     9    1
     3     6     1    1
     4     8     4    1
     5     8     9    2
     6     3     1    1
     7     5     4    1
     8     2     1    1
     9     1    10    1
    10     2    11    1
    11     2    12    1
    12     2    13    1
    13     3    14    1
    14     3    15    1
    15     3    16    1
    16     4    17    1
    17     4    18    1
    18     5    19    1
    19     5    20    1
    20     5    21    1
    21     6    22    1
    22     7    23    1
    23     7    24    1
    24     7    25    1
    25     8    26    1
    26     9    27    1