@<TRIPOS>MOLECULE
BindingDB_12021
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -1.7441    8.2550   15.3585  C     
2    C        -1.2830    9.3302   16.1518  C     
3    C        -0.1879   10.1060   15.7296  C     
4    C         0.4817    9.7891   14.5322  C     
5    C         0.0900    8.6508   13.7893  C     
6    C        -1.0181    7.8440   14.2082  C     
7    C        -1.4805    6.6583   13.4133  C     
8    N        -2.1908    5.6676   14.1775  N     
9    C        -3.5061    5.4416   14.1571  C     
10   O        -4.2015    6.1638   13.4546  O     
11   C        -4.1401    4.4134   14.8904  C     
12   C        -3.4048    3.3922   15.5374  C     
13   C        -5.5616    4.3136   14.9728  C     
14   C        -6.1989    3.2673   15.6460  C     
15   C        -5.4396    2.2598   16.2793  C     
16   C        -4.0342    2.3346   16.2134  C     
17   S        -6.2349    0.9465   17.0866  S     
18   O        -6.2521   -0.3923   16.2358  O     
19   O        -5.3711    0.5932   18.3671  O     
20   N        -7.7781    1.2222   17.6666  N     
21   F         0.7393    8.4085   12.6779  F     
22   F         0.2147   11.1241   16.4425  F     
23   F        -2.8868    7.6963   15.6905  F     
24   H        -1.7783    9.5769   17.0154  H     
25   H         1.2579   10.3741   14.1976  H     
26   H        -2.0751    7.0317   12.5682  H     
27   H        -0.6161    6.1215   12.9805  H     
28   H        -1.6416    5.0741   14.7156  H     
29   H        -2.3866    3.4003   15.5230  H     
30   H        -6.1544    5.0252   14.5409  H     
31   H        -7.2244    3.2456   15.6809  H     
32   H        -3.4564    1.6266   16.6689  H     
33   H        -7.9436    1.1320   18.6073  H     
34   H        -8.5148    1.3118   17.0516  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    1   23 1
     4    2    3 1
     5    3    4 2
     6    3   22 1
     7    4    5 1
     8    5    6 2
     9    5   21 1
    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    2   24 1
    26    4   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	| 5.7847
  Crash		| -1.5225
  Polar		| 2.5296
  FragIndex	| 1
  FragRMSD	| 0.861