@<TRIPOS>MOLECULE
FDBF00639
 18 18 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  O1        23.0320   -0.2760   -0.0480 O.3     1  FRG1       -0.3747
      2  C2        21.8890    0.4550    0.4170 C.3     1  FRG1        0.0738
      3  C3        22.0930    1.9550    0.1280 C.3     1  FRG1        0.0809
      4  O4        20.9430    2.6910    0.5520 O.3     1  FRG1       -0.3894
      5  C5        23.3390    2.4580    0.8800 C.3     1  FRG1        0.0036
      6  C6        24.5390    1.5850    0.4510 C.3     1  FRG1        0.0809
      7  O7        25.7170    1.9400    1.1810 O.3     1  FRG1       -0.3894
      8  C8        24.2060    0.0950    0.6850 C.3     1  FRG1        0.0738
      9 H          21.7736    0.3062    1.4703 H       1  FRG1        0.0585
     10 H          21.0116    0.1083   -0.0878 H       1  FRG1        0.0585
     11 H          22.2309    2.0975   -0.9235 H       1  FRG1        0.0617
     12 H          20.8123    2.5659    1.5050 H       1  FRG1        0.2099
     13 H          23.1858    2.3716    1.9354 H       1  FRG1        0.0316
     14 H          23.5245    3.4858    0.6472 H       1  FRG1        0.0316
     15 H          24.7261    1.7526   -0.5891 H       1  FRG1        0.0617
     16 H          25.5665    1.7946    2.1282 H       1  FRG1        0.2099
     17 H          25.0294   -0.5056    0.3592 H       1  FRG1        0.0585
     18 H          24.0272   -0.0608    1.7284 H       1  FRG1        0.0585
@<TRIPOS>BOND
     1     1     2    1
     2     1     8    1
     3     2     3    1
     4     3     4    1
     5     3     5    1
     6     5     6    1
     7     6     7    1
     8     6     8    1
     9     2     9    1
    10     2    10    1
    11     3    11    1
    12     4    12    1
    13     5    13    1
    14     5    14    1
    15     6    15    1
    16     7    16    1
    17     8    17    1
    18     8    18    1