@<TRIPOS>MOLECULE
FDBF02391
 22 21 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         6.2540   -1.0700    0.1360 C.3     1  FRG1       -0.0372
      2  O1         6.2200   -2.0100   -2.1620 O.3     1  FRG1       -0.3902
      3  C2         5.4700   -1.8350   -0.9560 C.3     1  FRG1        0.0705
      4  C1         4.4450    0.2810   -1.8890 C.3     1  FRG1       -0.0442
      5  O1         2.3080   -2.9320   -0.4150 O.2     1  FRG1       -0.2761
      6  C2         2.4760   -1.9230    0.2520 C.2     1  FRG1        0.2102
      7  N3         3.3640   -0.9630   -0.0640 N.am    1  FRG1       -0.3105
      8  C1         4.1510   -1.1020   -1.2740 C.3     1  FRG1        0.0459
      9  C1         1.6720   -1.6850    1.5010 C.3     1  FRG1        0.0122
     10 H           7.1664   -1.5871    0.3484 H       1  FRG1        0.0255
     11 H           5.6619   -1.0115    1.0253 H       1  FRG1        0.0255
     12 H           6.4761   -0.0822   -0.2103 H       1  FRG1        0.0255
     13 H           5.6832   -2.4934   -2.8093 H       1  FRG1        0.2098
     14 H           5.2681   -2.8090   -0.5618 H       1  FRG1        0.0609
     15 H           5.0256    0.1592   -2.7795 H       1  FRG1        0.0248
     16 H           4.9905    0.8753   -1.1860 H       1  FRG1        0.0248
     17 H           3.5229    0.7683   -2.1283 H       1  FRG1        0.0248
     18 H           3.4779   -0.1772    0.5181 H       1  FRG1        0.1490
     19 H           3.5935   -1.6753   -1.9849 H       1  FRG1        0.0521
     20 H           1.0023   -2.5050    1.6558 H       1  FRG1        0.0322
     21 H           1.1101   -0.7804    1.3965 H       1  FRG1        0.0322
     22 H           2.3317   -1.6002    2.3391 H       1  FRG1        0.0322
@<TRIPOS>BOND
     1     2     3    1
     2     4     8    1
     3     8     3    1
     4     8     7    1
     5     3     1    1
     6     5     6    2
     7     7     6   am
     8     6     9    1
     9     1    10    1
    10     1    11    1
    11     1    12    1
    12     2    13    1
    13     3    14    1
    14     4    15    1
    15     4    16    1
    16     4    17    1
    17     7    18    1
    18     8    19    1
    19     9    20    1
    20     9    21    1
    21     9    22    1