@<TRIPOS>MOLECULE
BindingDB_12021
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -1.7455    7.7084   15.0386  C     
2    C        -1.0787    8.5102   15.9813  C     
3    C        -1.0742    9.9102   15.8459  C     
4    C        -1.7568   10.5161   14.7780  C     
5    C        -2.4470    9.7174   13.8437  C     
6    C        -2.4589    8.2995   13.9627  C     
7    C        -3.2065    7.4435   12.9916  C     
8    N        -3.8189    6.2787   13.5606  N     
9    C        -4.5507    6.2190   14.6695  C     
10   O        -4.7780    7.2584   15.2993  O     
11   C        -4.9467    5.0008   15.2244  C     
12   C        -6.2529    4.8253   15.7519  C     
13   C        -4.0532    3.9017   15.3068  C     
14   C        -4.4533    2.6742   15.8622  C     
15   C        -5.7612    2.5083   16.3587  C     
16   C        -6.6564    3.5995   16.3082  C     
17   S        -6.2452    0.9888   17.0610  S     
18   O        -5.9277   -0.1812   16.0351  O     
19   O        -5.4432    0.7184   18.4031  O     
20   N        -7.8954    0.8911   17.3410  N     
21   F        -3.0722   10.3338   12.8782  F     
22   F        -0.4336   10.6451   16.7094  F     
23   F        -1.6927    6.4121   15.1958  F     
24   H        -0.5921    8.0713   16.7632  H     
25   H        -1.7625   11.5404   14.6930  H     
26   H        -3.9917    8.0075   12.4840  H     
27   H        -2.4989    7.1010   12.2343  H     
28   H        -3.6536    5.4390   13.0980  H     
29   H        -6.9373    5.5871   15.7161  H     
30   H        -3.0864    3.9894   14.9819  H     
31   H        -3.7802    1.9084   15.9217  H     
32   H        -7.6079    3.5156   16.6674  H     
33   H        -8.3164    0.0241   17.3554  H     
34   H        -8.4446    1.6864   17.2543  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    1   23 1
     4    2    3 1
     5    3    4 2
     6    3   22 1
     7    4    5 1
     8    5    6 2
     9    5   21 1
    10    6    7 1
    11    7    8 1
    12    8    9 am
    13    9   10 2
    14    9   11 1
    15   11   12 1
    16   11   13 2
    17   12   16 2
    18   13   14 1
    19   14   15 2
    20   15   16 1
    21   15   17 1
    22   17   18 2
    23   17   19 2
    24   17   20 am
    25    2   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	| 5.5828
  Crash		| -1.4526
  Polar		| 2.7182
  FragIndex	| 1
  FragRMSD	| 0.864