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


@<TRIPOS>ATOM
1    C        -1.2903    6.8095   15.2447  C     
2    C        -1.3536    8.1196   15.7562  C     
3    C        -1.9102    9.1530   14.9779  C     
4    C        -2.4092    8.8739   13.6936  C     
5    C        -2.3406    7.5662   13.1823  C     
6    F        -1.9704   10.3708   15.4357  F     
7    C        -1.7797    6.5167   13.9479  C     
8    C        -1.7343    5.1323   13.4152  C     
9    N        -2.7628    4.3566   14.0277  N     
10   C        -3.1901    3.1633   13.6330  C     
11   O        -2.6694    2.6301   12.6589  O     
12   C        -4.1929    2.4978   14.3430  C     
13   C        -5.1143    3.2014   15.1643  C     
14   C        -4.3081    1.0843   14.2890  C     
15   C        -5.2578    0.3991   15.0679  C     
16   C        -6.1372    1.1133   15.9063  C     
17   C        -6.0726    2.5204   15.9339  C     
18   S        -7.2427    0.2665   16.9493  S     
19   O        -8.5859    1.0842   17.1735  O     
20   O        -7.5446   -1.1467   16.2931  O     
21   N        -6.5203   -0.0475   18.4285  N     
22   H        -0.8834    6.0690   15.8244  H     
23   H        -0.9968    8.3159   16.6960  H     
24   H        -2.8206    9.6208   13.1276  H     
25   H        -2.7114    7.3831   12.2465  H     
26   H        -1.8876    5.1217   12.3307  H     
27   H        -0.7541    4.6915   13.6183  H     
28   H        -3.1833    4.7360   14.8161  H     
29   H        -5.0948    4.2221   15.2212  H     
30   H        -3.6682    0.5293   13.7144  H     
31   H        -5.2901   -0.6228   15.0279  H     
32   H        -6.7051    3.0599   16.5304  H     
33   H        -6.9507   -0.6555   19.0522  H     
34   H        -5.8140    0.5412   18.7404  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	| 2.9033
  Crash		| -1.6260
  Polar		| 1.6388
  FragIndex	| 1
  FragRMSD	| 1.006