@<TRIPOS>MOLECULE
FDBF00450
 19 18 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         7.3220   -0.1930   -0.8540 C.3     1  FRG1        0.0084
      2  O3         5.3500   -1.3090   -0.1530 O.co2   1  FRG1       -0.5444
      3  C4         6.5590   -1.0590    0.1050 C.2     1  FRG1        0.0863
      4  O5         7.1670   -1.4920    1.1200 O.co2   1  FRG1       -0.5444
      5  N1         7.4480    1.1650   -0.3000 N.4     1  FRG1        0.2370
      6  C1         5.1890    1.7340    0.4640 C.3     1  FRG1       -0.0245
      7  C1         8.6400    1.8290   -0.8460 C.3     1  FRG1       -0.0427
      8  C1         6.2540    1.9570   -0.6250 C.3     1  FRG1       -0.0347
      9 H           8.2967   -0.6063   -1.0089 H       1  FRG1        0.0879
     10 H           6.7992   -0.1493   -1.7866 H       1  FRG1        0.0879
     11 H           7.5392    1.0935    0.7134 H       1  FRG1        0.2034
     12 H           4.3165    2.3086    0.2326 H       1  FRG1        0.0281
     13 H           5.5781    2.0423    1.4119 H       1  FRG1        0.0281
     14 H           4.9321    0.6961    0.5044 H       1  FRG1        0.0281
     15 H           8.5494    1.9066   -1.9093 H       1  FRG1        0.0778
     16 H           9.5103    1.2559   -0.6030 H       1  FRG1        0.0778
     17 H           8.7281    2.8079   -0.4232 H       1  FRG1        0.0778
     18 H           5.8666    1.6482   -1.5734 H       1  FRG1        0.0812
     19 H           6.5113    2.9946   -0.6701 H       1  FRG1        0.0812
@<TRIPOS>BOND
     1     1     5    1
     2     1     3    1
     3     7     5    1
     4     8     5    1
     5     8     6    1
     6     2     3   ar
     7     3     4   ar
     8     1     9    1
     9     1    10    1
    10     5    11    1
    11     6    12    1
    12     6    13    1
    13     6    14    1
    14     7    15    1
    15     7    16    1
    16     7    17    1
    17     8    18    1
    18     8    19    1