@<TRIPOS>MOLECULE
BindingDB_12014
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -1.6304    7.7770   15.2542  C     
2    C        -1.0031    8.6252   16.1867  C     
3    C        -1.0116   10.0177   15.9814  C     
4    C        -1.6796   10.5608   14.8688  C     
5    C        -2.3337    9.7095   13.9557  C     
6    C        -2.3247    8.3040   14.1374  C     
7    C        -2.9347    7.3729   13.1392  C     
8    N        -3.5160    6.1991   13.7109  N     
9    C        -4.5840    6.1192   14.4968  C     
10   O        -5.2303    7.1438   14.7132  O     
11   C        -4.9695    4.9065   15.0817  C     
12   C        -6.2807    4.7394   15.5988  C     
13   C        -4.0730    3.8129   15.2227  C     
14   C        -4.4741    2.6115   15.8282  C     
15   C        -5.7863    2.4635   16.3120  C     
16   C        -6.6875    3.5347   16.1959  C     
17   S        -6.2475    0.9756   17.0854  S     
18   O        -5.9644   -0.2357   16.0955  O     
19   O        -5.4107    0.7431   18.4141  O     
20   N        -7.8927    0.8430   17.3854  N     
21   F        -2.9259   10.2633   12.9356  F     
22   H        -1.5966    6.7648   15.4043  H     
23   H        -0.5277    8.2382   17.0056  H     
24   H        -0.5362   10.6361   16.6394  H     
25   H        -1.6858   11.5701   14.7256  H     
26   H        -3.6827    7.8658   12.5197  H     
27   H        -2.1327    7.0498   12.4766  H     
28   H        -3.0500    5.3713   13.5176  H     
29   H        -6.9641    5.4935   15.5193  H     
30   H        -3.1065    3.8765   14.8982  H     
31   H        -3.8062    1.8424   15.9144  H     
32   H        -7.6493    3.4478   16.5377  H     
33   H        -8.3048   -0.0319   17.3422  H     
34   H        -8.4509    1.6295   17.3891  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    3    4 2
     5    4    5 1
     6    5    6 2
     7    5   21 1
     8    6    7 1
     9    7    8 1
    10    8    9 am
    11    9   10 2
    12    9   11 1
    13   11   12 1
    14   11   13 2
    15   12   16 2
    16   13   14 1
    17   14   15 2
    18   15   16 1
    19   15   17 1
    20   17   18 2
    21   17   19 2
    22   17   20 am
    23    1   22 1
    24    2   23 1
    25    3   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	| 6.1748
  Crash		| -1.3026
  Polar		| 2.8467
  FragIndex	| 1
  FragRMSD	| 0.836