@<TRIPOS>MOLECULE
BindingDB_12020
 34 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -1.7990    7.9413   15.3558  C     
2    C        -1.4635    9.0311   16.1822  C     
3    C        -0.4090    9.8906   15.8237  C     
4    C         0.2913    9.6688   14.6216  C     
5    C        -0.0542    8.5882   13.7844  C     
6    C        -1.1013    7.6970   14.1429  C     
7    C        -1.4307    6.5397   13.2503  C     
8    N        -2.2201    5.5189   13.8626  N     
9    C        -3.5466    5.4075   13.9077  C     
10   O        -4.2183    6.2794   13.3694  O     
11   C        -4.1863    4.3650   14.6030  C     
12   C        -5.6029    4.2281   14.6156  C     
13   C        -3.4443    3.4134   15.3541  C     
14   C        -4.0750    2.3931   16.0861  C     
15   C        -5.4783    2.2954   16.1037  C     
16   C        -6.2403    3.2167   15.3620  C     
17   S        -6.2232    1.0321   17.0351  S     
18   O        -5.9405   -0.2893   16.2036  O     
19   O        -5.5276    0.7982   18.4447  O     
20   N        -7.8975    1.0527   17.1318  N     
21   F         0.6241    8.4157   12.6760  F     
22   F        -0.0781   10.8870   16.6066  F     
23   F         1.2697   10.4716   14.2908  F     
24   H        -2.5653    7.3345   15.6543  H     
25   H        -1.9917    9.1899   17.0460  H     
26   H        -1.8981    6.9072   12.3362  H     
27   H        -0.5000    6.0520   12.9626  H     
28   H        -1.7144    4.8085   14.2858  H     
29   H        -6.1952    4.8673   14.0766  H     
30   H        -2.4245    3.4464   15.3904  H     
31   H        -3.4991    1.7262   16.6063  H     
32   H        -7.2613    3.1582   15.3576  H     
33   H        -8.4009    0.2666   16.8607  H     
34   H        -8.3622    1.8820   17.3201  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    3    4 2
     5    3   22 1
     6    4    5 1
     7    4   23 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    1   24 1
    26    2   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	| 6.0130
  Crash		| -1.0162
  Polar		| 2.3365
  FragIndex	| 1
  FragRMSD	| 0.844