@<TRIPOS>MOLECULE
BindingDB_12022
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -5.7703    9.4730   12.9741  C     
2    C        -6.0976    9.0356   14.2734  C     
3    C        -7.1149    8.0785   14.4636  C     
4    C        -7.7937    7.5550   13.3447  C     
5    C        -7.4606    7.9889   12.0494  C     
6    C        -6.4489    8.9535   11.8442  C     
7    C        -6.0963    9.3659   10.4611  C     
8    N        -7.1783   10.0746    9.8425  N     
9    C        -8.1321    9.5636    9.0650  C     
10   O        -8.1862    8.3473    8.9055  O     
11   C        -9.0887   10.3764    8.4513  C     
12   C        -8.8375   11.7479    8.1899  C     
13   C       -10.3415    9.8539    8.0415  C     
14   C       -11.2885   10.6571    7.3798  C     
15   C       -11.0112   12.0107    7.1075  C     
16   C        -9.7829   12.5523    7.5294  C     
17   S       -12.1461   13.0042    6.2338  S     
18   O       -11.3786   13.4714    4.9225  O     
19   O       -13.4562   12.2295    5.7742  O     
20   N       -12.5480   14.4134    7.0548  N     
21   F        -7.4208    7.6754   15.6703  F     
22   F        -8.7264    6.6564   13.4857  F     
23   F        -5.4500    9.5252   15.2953  F     
24   H        -5.0237   10.1623   12.8565  H     
25   H        -7.9574    7.5908   11.2480  H     
26   H        -5.2321   10.0320   10.4565  H     
27   H        -5.8025    8.4790    9.8894  H     
28   H        -7.2168   11.0305   10.0130  H     
29   H        -7.9471   12.1774    8.4580  H     
30   H       -10.5814    8.8742    8.2178  H     
31   H       -12.1791   10.2447    7.0976  H     
32   H        -9.5590   13.5322    7.3381  H     
33   H       -12.7655   15.2256    6.5605  H     
34   H       -12.6321   14.3995    8.0203  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2   23 1
     5    3    4 2
     6    3   21 1
     7    4    5 1
     8    4   22 1
     9    5    6 2
    10    6    7 1
    11    7    8 1
    12    8    9 am
    13    9   10 2
    14    9   11 1
    15   11   12 1
    16   11   13 2
    17   12   16 2
    18   13   14 1
    19   14   15 2
    20   15   16 1
    21   15   17 1
    22   17   18 2
    23   17   19 2
    24   17   20 am
    25    1   24 1
    26    5   25 1
    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	| 3.3428
  Crash		| -0.5410
  Polar		| 1.4194
  FragIndex	| 1
  FragRMSD	| 0.143