@<TRIPOS>MOLECULE
FDBF00312
 23 23 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         1.2350    0.9040   -0.3020 C.3     1  FRG1       -0.0348
      2  C1         0.4700    0.0280    0.6900 C.3     1  FRG1        0.0775
      3  O3         0.5000    0.6270    1.9850 O.3     1  FRG1       -0.3875
      4  C1        -0.9730   -0.1530    0.2790 C.ar    1  FRG1       -0.0160
      5  C2        -1.4840   -1.4260    0.0800 C.ar    1  FRG1       -0.0559
      6  C3        -2.8180   -1.5750   -0.2990 C.ar    1  FRG1       -0.0580
      7  C4        -3.6240   -0.4500   -0.4750 C.ar    1  FRG1       -0.0199
      8  C5        -3.0950    0.8250   -0.2710 C.ar    1  FRG1        0.1204
      9  C6        -1.7610    0.9740    0.1080 C.ar    1  FRG1       -0.0143
     10  O1        -3.8820    1.9220   -0.4410 O.3     1  FRG1       -0.4951
     11  C3        -3.3030    3.1930   -0.2230 C.3     1  FRG1        0.0788
     12 H           1.2098    0.4510   -1.2711 H       1  FRG1        0.0258
     13 H           2.2509    1.0029    0.0191 H       1  FRG1        0.0258
     14 H           0.7799    1.8713   -0.3484 H       1  FRG1        0.0258
     15 H           0.9457   -0.9303    0.7048 H       1  FRG1        0.0641
     16 H           0.0648    1.4932    1.9507 H       1  FRG1        0.2102
     17 H          -0.8836   -2.2551    0.2109 H       1  FRG1        0.0621
     18 H          -3.2091   -2.5181   -0.4493 H       1  FRG1        0.0619
     19 H          -4.6108   -0.5607   -0.7559 H       1  FRG1        0.0654
     20 H          -1.3646    1.9147    0.2596 H       1  FRG1        0.0658
     21 H          -4.0366    3.9531   -0.3932 H       1  FRG1        0.0660
     22 H          -2.4830    3.3316   -0.8963 H       1  FRG1        0.0660
     23 H          -2.9511    3.2564    0.7855 H       1  FRG1        0.0660
@<TRIPOS>BOND
     1     7     6   ar
     2     7     8   ar
     3    10     8    1
     4    10    11    1
     5     1     2    1
     6     6     5   ar
     7     8     9   ar
     8     5     4   ar
     9     9     4   ar
    10     4     2    1
    11     2     3    1
    12     1    12    1
    13     1    13    1
    14     1    14    1
    15     2    15    1
    16     3    16    1
    17     5    17    1
    18     6    18    1
    19     7    19    1
    20     9    20    1
    21    11    21    1
    22    11    22    1
    23    11    23    1