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


@<TRIPOS>ATOM
1    C        -1.3242    6.9409   15.2649  C     
2    C        -1.3601    8.2597   15.7546  C     
3    C        -1.9427    9.2843   14.9860  C     
4    C        -2.5119    8.9843   13.7376  C     
5    C        -2.4769    7.6677   13.2420  C     
6    C        -1.8611    6.6290   13.9879  C     
7    C        -1.8082    5.2362   13.4577  C     
8    N        -2.8538    4.4577   14.0362  N     
9    C        -3.1765    3.2118   13.7064  C     
10   O        -2.5486    2.6441   12.8175  O     
11   C        -4.1812    2.5255   14.3960  C     
12   C        -5.2123    3.2135   15.0889  C     
13   C        -4.1822    1.1080   14.4562  C     
14   C        -5.1316    0.4121   15.2247  C     
15   C        -6.1229    1.1163   15.9374  C     
16   C        -6.1724    2.5203   15.8464  C     
17   S        -7.2240    0.2694   16.9828  S     
18   O        -8.5832    1.0606   17.2029  O     
19   O        -7.5194   -1.1412   16.3178  O     
20   N        -6.5104   -0.0580   18.4663  N     
21   F        -3.0453    7.4398   12.0881  F     
22   F        -1.9738   10.5091   15.4315  F     
23   F        -0.7930    6.0212   16.0279  F     
24   H        -0.9665    8.4761   16.6749  H     
25   H        -2.9564    9.7271   13.1904  H     
26   H        -1.9144    5.2227   12.3712  H     
27   H        -0.8386    4.7883   13.6899  H     
28   H        -3.3551    4.8737   14.7546  H     
29   H        -5.2801    4.2332   15.0541  H     
30   H        -3.4609    0.5631   13.9749  H     
31   H        -5.0772   -0.6087   15.2778  H     
32   H        -6.8861    3.0517   16.3524  H     
33   H        -6.8572   -0.7848   19.0091  H     
34   H        -5.9279    0.6063   18.8693  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	| 2.6462
  Crash		| -1.7694
  Polar		| 1.7090
  FragIndex	| 1
  FragRMSD	| 1.017

