@<TRIPOS>MOLECULE
BindingDB_12023
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -1.8027    8.1168   15.5422  C     
2    C        -1.4167    9.1482   16.4023  C     
3    C        -0.2955    9.9456   16.1014  C     
4    C         0.4410    9.6982   14.9290  C     
5    C         0.0713    8.6431   14.0708  C     
6    C        -1.0472    7.8147   14.3719  C     
7    C        -1.4278    6.7424   13.4061  C     
8    N        -2.1528    5.6169   13.9242  N     
9    C        -3.4713    5.3882   13.8126  C     
10   O        -4.1454    6.1622   13.1376  O     
11   C        -4.1001    4.3941   14.5555  C     
12   C        -5.5160    4.3387   14.6473  C     
13   C        -3.3590    3.4096   15.2733  C     
14   C        -4.0081    2.4189   16.0245  C     
15   C        -5.4100    2.3817   16.0962  C     
16   C        -6.1634    3.3537   15.4125  C     
17   S        -6.1940    1.1357   17.0235  S     
18   O        -6.1018   -0.1535   16.1053  O     
19   O        -5.3906    0.8493   18.3627  O     
20   N        -7.8170    1.3704   17.3439  N     
21   F         0.7729    8.4566   12.9781  F     
22   F        -2.9064    7.4976   15.8754  F     
23   F         1.4756   10.4539   14.6445  F     
24   F         0.0421   10.9148   16.9079  F     
25   F        -2.1025    9.3882   17.4889  F     
26   H        -1.9527    7.2085   12.5728  H     
27   H        -0.5253    6.2792   13.0028  H     
28   H        -1.6426    5.0100   14.4736  H     
29   H        -6.1012    5.0232   14.1569  H     
30   H        -2.3405    3.3935   15.2416  H     
31   H        -3.4362    1.7280   16.5235  H     
32   H        -7.1852    3.3645   15.4614  H     
33   H        -8.3551    0.6280   17.6568  H     
34   H        -8.2282    2.2413   17.2053  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    1   22 1
     4    2    3 1
     5    2   25 1
     6    3    4 2
     7    3   24 1
     8    4    5 1
     9    4   23 1
    10    5    6 2
    11    5   21 1
    12    6    7 1
    13    7    8 1
    14    8    9 am
    15    9   10 2
    16    9   11 1
    17   11   12 1
    18   11   13 2
    19   12   16 2
    20   13   14 1
    21   14   15 2
    22   15   16 1
    23   15   17 1
    24   17   18 2
    25   17   19 2
    26   17   20 am
    27    7   26 1
    28    7   27 1
    29    8   28 1
    30   12   29 1
    31   13   30 1
    32   14   31 1
    33   16   32 1
    34   20   33 1
    35   20   34 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 4.6155
  Crash		| -1.3020
  Polar		| 2.2487
  FragIndex	| 1
  FragRMSD	| 0.891