@<TRIPOS>MOLECULE
BindingDB_11932
 34 36 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -3.6368    6.9322   11.4929  C     
2    C        -2.6762    6.7570   10.4870  C     
3    C        -3.2017    6.4314    9.2228  C     
4    C        -4.6001    6.3189    9.1882  C     
5    S        -5.1803    6.6372   10.7787  S     
6    C        -3.3799    7.2467   12.9033  C     
7    C        -2.8756    3.7712   14.5590  C     
8    C        -2.5333    5.2596   14.2147  C     
9    N        -3.6148    6.0878   13.7337  N     
10   S        -5.0754    6.0455   14.5879  S     
11   O        -5.0783    7.0855   15.7876  O     
12   O        -6.3593    6.1242   13.6520  O     
13   O        -2.8976    2.9898   13.3685  O     
14   C        -4.1612    3.5407   15.2713  C     
15   C        -5.1753    4.4949   15.3213  C     
16   C        -4.5202    2.3257   15.9023  C     
17   C        -5.8072    2.3209   16.4573  C     
18   S        -6.5273    3.8494   16.1588  S     
19   O        -8.1956    1.2835   17.3415  O     
20   O        -6.3964   -0.3331   16.5624  O     
21   S        -6.6197    1.0536   17.3108  S     
22   N        -6.0711    0.8372   18.8771  N     
23   H        -1.6709    6.8593   10.6590  H     
24   H        -2.6059    6.2735    8.3980  H     
25   H        -5.1559    6.0707    8.3738  H     
26   H        -2.3545    7.6064   13.0038  H     
27   H        -4.0224    8.0802   13.2067  H     
28   H        -2.0646    3.3873   15.1809  H     
29   H        -2.1355    5.7382   15.1158  H     
30   H        -1.7196    5.2439   13.4809  H     
31   H        -2.4633    2.1375   13.6191  H     
32   H        -3.9007    1.5153   15.9539  H     
33   H        -5.5379    0.0512   19.1010  H     
34   H        -6.3125    1.4806   19.5741  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    5 1
     3    1    6 1
     4    2    3 1
     5    3    4 2
     6    4    5 1
     7    6    9 1
     8    7    8 1
     9    7   13 1
    10    7   14 1
    11    8    9 1
    12    9   10 1
    13   10   11 2
    14   10   12 2
    15   10   15 1
    16   14   15 2
    17   14   16 1
    18   15   18 1
    19   16   17 2
    20   17   18 1
    21   17   21 1
    22   19   21 2
    23   20   21 2
    24   21   22 am
    25    2   23 1
    26    3   24 1
    27    4   25 1
    28    6   26 1
    29    6   27 1
    30    7   28 1
    31    8   29 1
    32    8   30 1
    33   13   31 1
    34   16   32 1
    35   22   33 1
    36   22   34 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 4.3243
  Crash		| -1.8556
  Polar		| 3.6907
  FragIndex	| 1
  FragRMSD	| 1.211