@<TRIPOS>MOLECULE
BindingDB_12015
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -2.4492    8.4945   15.3002  C     
2    C        -1.6573    9.3220   16.1173  C     
3    C        -0.3543    9.6723   15.7179  C     
4    C         0.1588    9.1690   14.5013  C     
5    C        -0.6264    8.3266   13.6977  C     
6    F         0.3679   10.4644   16.4573  F     
7    C        -1.9493    7.9901   14.0720  C     
8    C        -2.8103    7.1826   13.1828  C     
9    N        -3.2907    6.0206   13.8646  N     
10   C        -4.5586    5.7072   14.1229  C     
11   O        -5.4420    6.4635   13.7266  O     
12   C        -4.9262    4.5698   14.8559  C     
13   C        -6.2887    4.3399   15.2107  C     
14   C        -3.9831    3.5903   15.2722  C     
15   C        -4.3700    2.4507   15.9999  C     
16   C        -5.7217    2.2524   16.3279  C     
17   C        -6.6752    3.2125   15.9446  C     
18   S        -6.2060    0.8237   17.2041  S     
19   O        -5.8809   -0.4122   16.2564  O     
20   O        -5.3875    0.6662   18.5587  O     
21   N        -7.8561    0.7086   17.4900  N     
22   H        -3.4011    8.2676   15.6107  H     
23   H        -2.0291    9.6617   17.0124  H     
24   H         1.1094    9.4160   14.2137  H     
25   H        -0.2285    7.9727   12.8269  H     
26   H        -3.6131    7.8246   12.8191  H     
27   H        -2.2584    6.8331   12.3017  H     
28   H        -2.6227    5.3994   14.1769  H     
29   H        -7.0234    5.0052   14.9449  H     
30   H        -2.9912    3.6940   15.0477  H     
31   H        -3.6553    1.7700   16.2813  H     
32   H        -7.6601    3.0973   16.1925  H     
33   H        -8.2541   -0.1763   17.6211  H     
34   H        -8.4268    1.4871   17.3738  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    7 1
     3    2    3 1
     4    3    4 2
     5    3    6 1
     6    4    5 1
     7    5    7 2
     8    7    8 1
     9    8    9 1
    10    9   10 am
    11   10   11 2
    12   10   12 1
    13   12   13 1
    14   12   14 2
    15   13   17 2
    16   14   15 1
    17   15   16 2
    18   16   17 1
    19   16   18 1
    20   18   19 2
    21   18   20 2
    22   18   21 am
    23    1   22 1
    24    2   23 1
    25    4   24 1
    26    5   25 1
    27    8   26 1
    28    8   27 1
    29    9   28 1
    30   13   29 1
    31   14   30 1
    32   15   31 1
    33   17   32 1
    34   21   33 1
    35   21   34 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 5.5199
  Crash		| -1.2982
  Polar		| 2.5488
  FragIndex	| 1
  FragRMSD	| 0.884