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


@<TRIPOS>ATOM
1    C        -2.4466    7.5633   13.0594  C     
2    C        -2.6849    8.8039   13.6758  C     
3    C        -2.2683    9.0206   15.0040  C     
4    C        -1.6352    7.9888   15.7149  C     
5    C        -1.3766    6.7529   15.0902  C     
6    F        -2.4689   10.1763   15.5737  F     
7    C        -1.7633    6.5296   13.7427  C     
8    C        -1.4832    5.2523   13.0304  C     
9    N        -2.2463    4.2002   13.6204  N     
10   C        -3.2017    3.4679   13.0603  C     
11   O        -3.5501    3.6772   11.9013  O     
12   C        -3.9057    2.5576   13.8448  C     
13   C        -3.2817    1.8999   14.9331  C     
14   C        -5.2831    2.3103   13.6238  C     
15   C        -6.0283    1.5239   14.5204  C     
16   C        -5.4079    0.9431   15.6434  C     
17   C        -4.0196    1.0929   15.8131  C     
18   S        -6.3524    0.1550   16.8729  S     
19   O        -7.0445   -1.1128   16.2170  O     
20   O        -5.5061   -0.4090   18.1005  O     
21   N        -7.6283    1.0970   17.4125  N     
22   F        -0.7845    5.8222   15.7935  F     
23   H        -2.7545    7.4280   12.0918  H     
24   H        -3.1423    9.5479   13.1524  H     
25   H        -1.3396    8.1443   16.6844  H     
26   H        -1.6917    5.3795   11.9637  H     
27   H        -0.4309    4.9684   13.1109  H     
28   H        -2.0624    4.0266   14.5588  H     
29   H        -2.2795    2.0083   15.1069  H     
30   H        -5.7754    2.7572   12.8456  H     
31   H        -7.0324    1.4173   14.3686  H     
32   H        -3.5402    0.6499   16.5996  H     
33   H        -8.5403    0.8324   17.2221  H     
34   H        -7.4527    1.8937   17.9354  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	| 3.5534
  Crash		| -1.6623
  Polar		| 2.4343
  FragIndex	| 1
  FragRMSD	| 1.253