@<TRIPOS>MOLECULE
BindingDB_12017
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -2.3144    8.0958   15.4591  C     
2    C        -1.2191    8.7037   16.0953  C     
3    C        -0.8846   10.0395   15.7978  C     
4    C        -1.6587   10.7622   14.8694  C     
5    C        -2.7369   10.1491   14.2103  C     
6    F         0.1436   10.6096   16.3678  F     
7    C        -3.0759    8.8018   14.4924  C     
8    C        -4.2031    8.1738   13.7474  C     
9    N        -4.7013    6.9240   14.2438  N     
10   C        -4.0519    5.7650   14.2812  C     
11   O        -2.9298    5.7150   13.7789  O     
12   C        -4.5696    4.6550   14.9586  C     
13   C        -5.9422    4.5637   15.3170  C     
14   C        -3.7263    3.5778   15.3374  C     
15   C        -4.2292    2.4566   16.0194  C     
16   C        -5.5994    2.3683   16.3306  C     
17   C        -6.4471    3.4412   15.9931  C     
18   S        -6.2215    0.9498   17.1306  S     
19   O        -5.9498   -0.2810   16.1666  O     
20   O        -5.4522    0.6878   18.4936  O     
21   N        -7.8801    0.9749   17.3952  N     
22   F        -3.4006   10.8544   13.3336  F     
23   H        -2.5407    7.1269   15.7001  H     
24   H        -0.6647    8.1676   16.7740  H     
25   H        -1.4221   11.7367   14.6670  H     
26   H        -5.0498    8.8691   13.7655  H     
27   H        -3.9043    8.0462   12.7028  H     
28   H        -5.5902    6.9403   14.6252  H     
29   H        -6.5986    5.3122   15.0826  H     
30   H        -2.7233    3.6076   15.1375  H     
31   H        -3.5851    1.7074   16.2882  H     
32   H        -7.4399    3.4141   16.2347  H     
33   H        -8.3720    0.1431   17.4066  H     
34   H        -8.3576    1.8157   17.3530  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    5   22 1
     9    7    8 1
    10    8    9 1
    11    9   10 am
    12   10   11 2
    13   10   12 1
    14   12   13 1
    15   12   14 2
    16   13   17 2
    17   14   15 1
    18   15   16 2
    19   16   17 1
    20   16   18 1
    21   18   19 2
    22   18   20 2
    23   18   21 am
    24    1   23 1
    25    2   24 1
    26    4   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	| 6.0579
  Crash		| -1.0179
  Polar		| 2.7478
  FragIndex	| 1
  FragRMSD	| 1.232