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


@<TRIPOS>ATOM
1    C        -4.5380    8.9872   12.8991  C     
2    C        -4.8346   10.2693   13.4123  C     
3    C        -3.9509   10.8840   14.3187  C     
4    C        -2.7811   10.2187   14.7272  C     
5    C        -2.4820    8.9389   14.2162  C     
6    C        -3.3536    8.3101   13.2869  C     
7    C        -3.0700    6.9575   12.7420  C     
8    N        -3.5904    5.9481   13.6203  N     
9    C        -4.7704    5.3352   13.5493  C     
10   O        -5.6062    5.7302   12.7382  O     
11   C        -5.0803    4.2601   14.3896  C     
12   C        -6.4212    3.9880   14.7794  C     
13   C        -4.0731    3.3786   14.8764  C     
14   C        -4.3996    2.2528   15.6570  C     
15   C        -5.7363    1.9935   16.0192  C     
16   C        -6.7392    2.8853   15.5926  C     
17   S        -6.1513    0.5669   16.9390  S     
18   O        -5.3773    0.6872   18.3191  O     
19   O        -7.7131    0.4517   17.2075  O     
20   N        -5.5568   -0.8149   16.1881  N     
21   F        -1.3874    8.3377   14.6259  F     
22   F        -5.3768    8.4508   12.0564  F     
23   F        -1.9635   10.7862   15.5857  F     
24   F        -4.2123   12.0793   14.7728  F     
25   F        -5.9271   10.8911   13.0470  F     
26   H        -3.4461    6.8760   11.7194  H     
27   H        -1.9881    6.7859   12.6892  H     
28   H        -3.0038    5.6624   14.3244  H     
29   H        -7.1865    4.6036   14.4782  H     
30   H        -3.0863    3.5111   14.6335  H     
31   H        -3.6506    1.6199   15.9600  H     
32   H        -7.7203    2.7375   15.8622  H     
33   H        -5.2594   -1.5510   16.7526  H     
34   H        -5.2742   -0.7876   15.2589  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	| 5.1723
  Crash		| -0.8707
  Polar		| 2.8357
  FragIndex	| 1
  FragRMSD	| 0.228