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


@<TRIPOS>ATOM
1    C        -1.7177    8.0827   15.4869  C     
2    C        -1.4113    9.1389   16.3721  C     
3    C        -0.2846    9.9478   16.1366  C     
4    C         0.5334    9.7009   15.0234  C     
5    C         0.2263    8.6430   14.1499  C     
6    F        -0.0047   10.9407   16.9416  F     
7    C        -0.8966    7.8130   14.3635  C     
8    C        -1.1827    6.7208   13.3918  C     
9    N        -1.9629    5.6608   13.9456  N     
10   C        -3.2763    5.4979   13.8500  C     
11   O        -3.9127    6.2761   13.1443  O     
12   C        -3.9465    4.4985   14.5690  C     
13   C        -5.3657    4.4453   14.5779  C     
14   C        -3.2578    3.5128   15.3300  C     
15   C        -3.9515    2.5220   16.0509  C     
16   C        -5.3565    2.5045   16.0489  C     
17   C        -6.0632    3.4664   15.3063  C     
18   S        -6.1993    1.2805   16.9540  S     
19   O        -6.1793   -0.0053   16.0189  O     
20   O        -5.3860    0.9247   18.2745  O     
21   N        -7.7986    1.6703   17.2779  N     
22   H        -2.5452    7.5186   15.6706  H     
23   H        -2.0116    9.3211   17.1804  H     
24   H         1.3521   10.2850   14.8458  H     
25   H         0.8417    8.4811   13.3489  H     
26   H        -1.6342    7.1560   12.4994  H     
27   H        -0.2441    6.2628   13.0762  H     
28   H        -1.4855    5.0510   14.5224  H     
29   H        -5.9161    5.1352   14.0706  H     
30   H        -2.2371    3.4989   15.3859  H     
31   H        -3.4253    1.8233   16.5777  H     
32   H        -7.0863    3.4650   15.2849  H     
33   H        -8.4328    0.9683   17.4999  H     
34   H        -8.0823    2.6016   17.2734  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	| 5.0412
  Crash		| -1.0638
  Polar		| 2.6163
  FragIndex	| 1
  FragRMSD	| 0.932