@<TRIPOS>MOLECULE
FDBF02597
 18 18 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  O1         4.0810   -0.4330    2.1910 O.2     1  FRG1       -0.2450
      2  C2         4.0070   -0.7970    1.0260 C.ar    1  FRG1        0.3439
      3  N3         3.4250   -1.9780    0.5400 N.ar    1  FRG1       -0.2134
      4  N4         3.5350   -2.0380   -0.8240 N.ar    1  FRG1       -0.1574
      5  C5         4.1540   -0.9390   -1.1430 C.ar    1  FRG1        0.1179
      6  N6         4.4750   -0.1440   -0.1000 N.ar    1  FRG1       -0.2960
      7  C1         2.7880   -3.0250    1.2910 C.3     1  FRG1        0.0465
      8  C1         1.2890   -2.7880    1.4690 C.3     1  FRG1       -0.0360
      9  C1         0.5080   -2.6640    0.1570 C.3     1  FRG1       -0.0636
     10 H           4.3823   -0.6936   -2.1191 H       1  FRG1        0.1046
     11 H           4.9445    0.7207   -0.1339 H       1  FRG1        0.1714
     12 H           3.2439   -3.0803    2.2574 H       1  FRG1        0.0510
     13 H           2.9106   -3.9374    0.7456 H       1  FRG1        0.0510
     14 H           0.8839   -3.6086    2.0234 H       1  FRG1        0.0280
     15 H           1.1859   -1.8512    1.9756 H       1  FRG1        0.0280
     16 H           0.5808   -3.5811   -0.3895 H       1  FRG1        0.0230
     17 H           0.9173   -1.8669   -0.4278 H       1  FRG1        0.0230
     18 H          -0.5197   -2.4574    0.3718 H       1  FRG1        0.0230
@<TRIPOS>BOND
     1     5     4   ar
     2     5     6   ar
     3     4     3   ar
     4     6     2   ar
     5     9     8    1
     6     3     2   ar
     7     3     7    1
     8     2     1    2
     9     7     8    1
    10     5    10    1
    11     6    11    1
    12     7    12    1
    13     7    13    1
    14     8    14    1
    15     8    15    1
    16     9    16    1
    17     9    17    1
    18     9    18    1