@<TRIPOS>MOLECULE
BindingDB_12014
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -7.6576    7.8844   12.2046  C     
2    C        -8.0844    7.4718   13.4814  C     
3    C        -7.4674    7.9980   14.6293  C     
4    C        -6.4278    8.9352   14.4997  C     
5    C        -6.0013    9.3579   13.2255  C     
6    C        -6.6137    8.8301   12.0559  C     
7    C        -6.1795    9.2179   10.6853  C     
8    N        -7.2167    9.9443   10.0067  N     
9    C        -8.1216    9.4621    9.1574  C     
10   O        -8.1660    8.2484    8.9708  O     
11   C        -9.0387   10.3049    8.5256  C     
12   C       -10.2805    9.7929    8.0651  C     
13   C        -8.7718   11.6809    8.3036  C     
14   C        -9.6926   12.5041    7.6297  C     
15   C       -10.9176   11.9810    7.1771  C     
16   C       -11.2038   10.6211    7.4024  C     
17   S       -12.0484   12.9907    6.3078  S     
18   O       -11.2729   13.4758    5.0028  O     
19   O       -13.3398   12.1907    5.8330  O     
20   N       -12.5085   14.3818    7.1313  N     
21   F        -5.0659   10.2623   13.1573  F     
22   H        -8.1203    7.4980   11.3706  H     
23   H        -8.8396    6.7872   13.5677  H     
24   H        -7.7865    7.7103   15.5581  H     
25   H        -5.9932    9.3202   15.3395  H     
26   H        -5.2965    9.8628   10.7102  H     
27   H        -5.8808    8.3114   10.1442  H     
28   H        -7.2729   10.8887   10.2238  H     
29   H       -10.5286    8.8153    8.2158  H     
30   H        -7.8851   12.0951    8.6062  H     
31   H        -9.4614   13.4872    7.4693  H     
32   H       -12.0890   10.2209    7.0905  H     
33   H       -12.8279   15.1572    6.6330  H     
34   H       -12.5847   14.3727    8.0998  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    3    4 2
     5    4    5 1
     6    5    6 2
     7    5   21 1
     8    6    7 1
     9    7    8 1
    10    8    9 am
    11    9   10 2
    12    9   11 1
    13   11   12 1
    14   11   13 2
    15   12   16 2
    16   13   14 1
    17   14   15 2
    18   15   16 1
    19   15   17 1
    20   17   18 2
    21   17   19 2
    22   17   20 am
    23    1   22 1
    24    2   23 1
    25    3   24 1
    26    4   25 1
    27    7   26 1
    28    7   27 1
    29    8   28 1
    30   12   29 1
    31   13   30 1
    32   14   31 1
    33   16   32 1
    34   20   33 1
    35   20   34 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 3.7839
  Crash		| -0.5818
  Polar		| 1.3868
  FragIndex	| 1
  FragRMSD	| 0.164