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


@<TRIPOS>ATOM
1    C        -2.3957    8.2437   15.1755  C     
2    C        -1.6209    9.0502   16.0302  C     
3    C        -0.3510    9.4977   15.6252  C     
4    C         0.1667    9.0952   14.3805  C     
5    C        -0.5908    8.2514   13.5377  C     
6    C        -1.8846    7.8098   13.9243  C     
7    C        -2.7251    6.9656   13.0235  C     
8    N        -3.2528    5.8225   13.7114  N     
9    C        -4.5128    5.6168   14.0875  C     
10   O        -5.3562    6.4593   13.7948  O     
11   C        -4.8885    4.4945   14.8352  C     
12   C        -3.9573    3.5085   15.2578  C     
13   C        -6.2427    4.3059   15.2091  C     
14   C        -6.6548    3.1856   15.9446  C     
15   C        -5.7209    2.2095   16.3304  C     
16   C        -4.3666    2.3794   15.9893  C     
17   S        -6.2236    0.8002   17.2096  S     
18   O        -5.9279   -0.4562   16.2843  O     
19   O        -5.4034    0.6707   18.5634  O     
20   N        -7.8717    0.7384   17.5237  N     
21   F        -0.0844    7.9279   12.3764  F     
22   F        -3.5997    7.9206   15.5701  F     
23   F         1.3482    9.5161   14.0102  F     
24   F         0.3418   10.2875   16.4039  F     
25   F        -2.0791    9.3860   17.2063  F     
26   H        -3.5137    7.6058   12.6197  H     
27   H        -2.1699    6.5845   12.1732  H     
28   H        -2.6059    5.1420   13.9485  H     
29   H        -2.9627    3.5908   15.0417  H     
30   H        -6.9597    4.9872   14.9483  H     
31   H        -7.6394    3.0910   16.1911  H     
32   H        -3.6711    1.6820   16.2640  H     
33   H        -8.2989   -0.1259   17.6594  H     
34   H        -8.4160    1.5327   17.4190  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	| 5.0905
  Crash		| -1.6697
  Polar		| 2.5845
  FragIndex	| 1
  FragRMSD	| 0.865