@<TRIPOS>MOLECULE
FDBF00454
 24 25 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  O1         0.3480    0.0110    0.0160 O.3     1  FRG1       -0.3463
      2  C2         1.6690    0.5810    0.0670 C.3     1  FRG1        0.1701
      3  O3         1.5670    2.0050    0.2380 O.3     1  FRG1       -0.3463
      4  C4         0.1940    2.3040   -0.0190 C.3     1  FRG1        0.0744
      5  C5        -0.5190    1.0610    0.4510 C.3     1  FRG1        0.0744
      6  C9         2.4340   -0.0020    1.2580 C.3     1  FRG1        0.0014
      7  C10        2.7200   -1.4920    1.0860 C.3     1  FRG1       -0.0482
      8  C11        3.4380   -1.7760   -0.2310 C.3     1  FRG1       -0.0527
      9  C12        2.6760   -1.2100   -1.4250 C.3     1  FRG1       -0.0482
     10  C13        2.3880    0.2800   -1.2520 C.3     1  FRG1        0.0014
     11 H           0.0260    2.4722   -1.0623 H       1  FRG1        0.0584
     12 H          -0.1423    3.1934    0.4717 H       1  FRG1        0.0584
     13 H          -0.6241    1.0570    1.5158 H       1  FRG1        0.0584
     14 H          -1.5137    0.9738    0.0665 H       1  FRG1        0.0584
     15 H           1.8502    0.1368    2.1439 H       1  FRG1        0.0317
     16 H           3.3727    0.5070    1.3266 H       1  FRG1        0.0317
     17 H           1.7938   -2.0276    1.0995 H       1  FRG1        0.0267
     18 H           3.3540   -1.8068    1.8884 H       1  FRG1        0.0267
     19 H           3.5341   -2.8348   -0.3518 H       1  FRG1        0.0265
     20 H           4.3978   -1.3044   -0.1950 H       1  FRG1        0.0265
     21 H           1.7484   -1.7338   -1.5251 H       1  FRG1        0.0267
     22 H           3.2812   -1.3351   -2.2985 H       1  FRG1        0.0267
     23 H           3.3148    0.8144   -1.2690 H       1  FRG1        0.0317
     24 H           1.7474    0.5859   -2.0526 H       1  FRG1        0.0317
@<TRIPOS>BOND
     1     1     2    1
     2     1     5    1
     3     2     3    1
     4     2     6    1
     5     2    10    1
     6     3     4    1
     7     4     5    1
     8     6     7    1
     9     7     8    1
    10     8     9    1
    11     9    10    1
    12     4    11    1
    13     4    12    1
    14     5    13    1
    15     5    14    1
    16     6    15    1
    17     6    16    1
    18     7    17    1
    19     7    18    1
    20     8    19    1
    21     8    20    1
    22     9    21    1
    23     9    22    1
    24    10    23    1
    25    10    24    1