@<TRIPOS>MOLECULE
FDBF00150
 37 38 0 0 0
SMALL
GASTEIGER

@<TRIPOS>ATOM
      1  C1        -0.2820   -1.3080   -1.0620 C.3     1  FRG1       -0.0519
      2  O1         2.0720    1.0510   -0.1760 O.3     1  FRG1       -0.4628
      3  C2         2.3560    2.2770   -0.7140 C.2     1  FRG1        0.2945
      4  O3         2.4490    2.5280   -1.9080 O.2     1  FRG1       -0.2546
      5  C4         2.1530   -1.4100   -0.2370 C.3     1  FRG1        0.0244
      6  C5         0.6470   -1.5440    0.1350 C.3     1  FRG1       -0.0251
      7  C6         0.3540   -2.9090    0.8250 C.3     1  FRG1       -0.0219
      8  C7         1.3680   -3.2020    1.9000 C.2     1  FRG1       -0.0806
      9  C8         2.5700   -2.6170    1.9660 C.2     1  FRG1       -0.0621
     10  C9         3.0400   -1.6580    0.9830 C.2     1  FRG1       -0.0423
     11  C10        4.2120   -1.0220    1.1620 C.2     1  FRG1       -0.0522
     12  C11        4.7710   -0.0090    0.2040 C.3     1  FRG1        0.0773
     13  C12        4.0220    0.0360   -1.1300 C.3     1  FRG1        0.0146
     14  C13        2.5100   -0.0730   -0.9350 C.3     1  FRG1        0.1125
     15  O24        6.1390   -0.3040   -0.0680 O.3     1  FRG1       -0.3876
     16  C27        0.2820   -4.1040   -0.1310 C.3     1  FRG1       -0.0587
     17  C1        -1.7430   -1.2620   -0.6170 C.3     1  FRG1       -0.0650
     18 H          -0.0273   -0.3777   -1.5251 H       1  FRG1        0.0266
     19 H          -0.1604   -2.1152   -1.7537 H       1  FRG1        0.0266
     20 H           2.5046    3.0576   -0.0555 H       1  FRG1        0.1512
     21 H           2.3470   -2.1710   -0.9637 H       1  FRG1        0.0388
     22 H           0.4354   -0.7665    0.8390 H       1  FRG1        0.0313
     23 H          -0.6216   -2.7916    1.2486 H       1  FRG1        0.0343
     24 H           1.1220   -3.8926    2.6263 H       1  FRG1        0.0575
     25 H           3.1921   -2.8592    2.7530 H       1  FRG1        0.0617
     26 H           4.7598   -1.2434    2.0082 H       1  FRG1        0.0600
     27 H           4.6613    0.9436    0.6788 H       1  FRG1        0.0639
     28 H           4.2424    0.9613   -1.6201 H       1  FRG1        0.0329
     29 H           4.3425   -0.7971   -1.7201 H       1  FRG1        0.0329
     30 H           2.0104   -0.0700   -1.8812 H       1  FRG1        0.0741
     31 H           6.2036   -1.1715   -0.4971 H       1  FRG1        0.2102
     32 H           1.2406   -4.2596   -0.5802 H       1  FRG1        0.0235
     33 H          -0.4418   -3.9072   -0.8941 H       1  FRG1        0.0235
     34 H          -0.0031   -4.9798    0.4136 H       1  FRG1        0.0235
     35 H          -1.8796   -0.4583    0.0760 H       1  FRG1        0.0230
     36 H          -2.0016   -2.1872   -0.1457 H       1  FRG1        0.0230
     37 H          -2.3709   -1.1083   -1.4697 H       1  FRG1        0.0230
@<TRIPOS>BOND
     1     4     3    2
     2    13    14    1
     3    13    12    1
     4     1    17    1
     5     1     6    1
     6    14     5    1
     7    14     2    1
     8     3     2    1
     9     5     6    1
    10     5    10    1
    11    16     7    1
    12    15    12    1
    13     6     7    1
    14    12    11    1
    15     7     8    1
    16    10    11    2
    17    10     9    1
    18     8     9    2
    19     1    18    1
    20     1    19    1
    21     3    20    1
    22     5    21    1
    23     6    22    1
    24     7    23    1
    25     8    24    1
    26     9    25    1
    27    11    26    1
    28    12    27    1
    29    13    28    1
    30    13    29    1
    31    14    30    1
    32    15    31    1
    33    16    32    1
    34    16    33    1
    35    16    34    1
    36    17    35    1
    37    17    36    1
    38    17    37    1