@<TRIPOS>MOLECULE
FDBF01618
 12 12 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1         2.3850    1.1700    0.1000 C.3     1  FRG1       -0.0064
      2  O1         4.2460    0.0890   -0.9670 O.2     1  FRG1       -0.4681
      3  C2         3.8490    0.8230    0.0860 C.ar    1  FRG1        0.1018
      4  C3         4.8560    1.1110    0.9400 C.ar    1  FRG1       -0.0210
      5  C4         6.0010    0.5010    0.3750 C.ar    1  FRG1       -0.0237
      6  C5         5.5780   -0.1080   -0.7830 C.ar    1  FRG1        0.0921
      7 H           1.9113    0.7527   -0.7639 H       1  FRG1        0.0308
      8 H           2.2705    2.2338    0.0907 H       1  FRG1        0.0308
      9 H           1.9321    0.7703    0.9832 H       1  FRG1        0.0308
     10 H           4.8017    1.6570    1.8140 H       1  FRG1        0.0652
     11 H           6.9603    0.5111    0.7554 H       1  FRG1        0.0649
     12 H           6.1873   -0.6406   -1.4234 H       1  FRG1        0.1029
@<TRIPOS>BOND
     1     2     6   ar
     2     2     3   ar
     3     6     5   ar
     4     3     1    1
     5     3     4   ar
     6     5     4   ar
     7     1     7    1
     8     1     8    1
     9     1     9    1
    10     4    10    1
    11     5    11    1
    12     6    12    1