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


@<TRIPOS>ATOM
1    C        -2.2848    9.7066   13.8482  C     
2    C        -1.5685   10.5656   14.6963  C     
3    C        -0.9189   10.0626   15.8421  C     
4    C        -0.9628    8.6826   16.1148  C     
5    C        -1.6596    7.8161   15.2482  C     
6    F        -0.2364   10.8671   16.6122  F     
7    C        -2.3454    8.3172   14.1096  C     
8    C        -3.0541    7.4220   13.1535  C     
9    N        -3.6016    6.2309   13.7308  N     
10   C        -4.6291    6.1527   14.5712  C     
11   O        -5.2638    7.1715   14.8246  O     
12   C        -4.9902    4.9422   15.1718  C     
13   C        -4.1308    3.8111   15.1599  C     
14   C        -6.2481    4.7859   15.8094  C     
15   C        -6.6296    3.5686   16.4012  C     
16   C        -5.7665    2.4550   16.3690  C     
17   C        -4.5064    2.5939   15.7547  C     
18   S        -6.2434    0.9512   17.1064  S     
19   O        -5.9434   -0.2372   16.0930  O     
20   O        -5.4307    0.7022   18.4522  O     
21   N        -7.8951    0.8425   17.3896  N     
22   H        -2.7372   10.0918   13.0217  H     
23   H        -1.5146   11.5662   14.4790  H     
24   H        -0.4939    8.3045   16.9400  H     
25   H        -1.6400    6.8144   15.4526  H     
26   H        -3.8650    7.9616   12.6527  H     
27   H        -2.3254    7.1196   12.3990  H     
28   H        -3.1906    5.3862   13.4571  H     
29   H        -3.1981    3.8695   14.7517  H     
30   H        -6.9073    5.5671   15.8643  H     
31   H        -7.5354    3.5117   16.8748  H     
32   H        -3.8441    1.8124   15.7545  H     
33   H        -8.3110   -0.0425   17.3708  H     
34   H        -8.4522    1.6342   17.3002  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	| 5.8962
  Crash		| -1.2839
  Polar		| 2.7420
  FragIndex	| 1
  FragRMSD	| 0.862