@<TRIPOS>MOLECULE
BindingDB_7683
 38 40 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        -7.9132   49.5788   15.3522  C     
2    C        -7.5887   50.1185   16.6134  C     
3    C        -7.9110   51.4548   16.9191  C     
4    C        -8.5821   52.2507   15.9721  C     
5    C        -8.5526   50.3843   14.3804  C     
6    C        -9.0090   50.1712   13.0836  C     
7    C        -8.9028   51.6897   14.7261  C     
8    N        -9.5836   52.2158   13.7110  N     
9    C        -9.6951   51.3142   12.7625  C     
10   O       -10.2806   51.5934   11.7252  O     
11   N        -9.4287   48.9832   11.1123  N     
12   C        -9.5328   47.9458   10.2370  C     
13   C        -9.6786   45.9853    8.1762  C     
14   C       -10.2092   47.2738    7.9773  C     
15   C       -10.1315   48.2426    8.9929  C     
16   C        -9.1001   46.6160   10.4638  C     
17   C        -9.1490   45.6532    9.4391  C     
18   O        -8.9045   45.5837    5.6800  O     
19   S        -9.6624   44.8403    6.8644  S     
20   O        -8.8239   43.5186    7.1503  O     
21   N       -11.1943   44.4734    6.2770  N     
22   C        -8.7493   49.1110   12.2725  C     
23   C        -7.5493   48.2925   12.4812  C     
24   H        -7.7024   48.5981   15.1762  H     
25   H        -7.1265   49.5341   17.3145  H     
26   H        -7.6733   51.8363   17.8350  H     
27   H        -8.8388   53.2126   16.1856  H     
28   H        -9.9572   53.1144   13.6848  H     
29   H        -9.9124   49.7729   10.8327  H     
30   H       -10.6389   47.5250    7.0857  H     
31   H       -10.4900   49.1825    8.8017  H     
32   H        -8.7458   46.3273   11.3756  H     
33   H        -8.7866   44.7140    9.6202  H     
34   H       -11.4490   44.7622    5.3867  H     
35   H       -11.8599   44.0900    6.8704  H     
36   H        -6.7237   48.8880   12.8791  H     
37   H        -7.1786   47.8675   11.5462  H     
38   H        -7.7667   47.4733   13.1668  H     
@<TRIPOS>BOND
     1    1    2 1
     2    1    5 2
     3    2    3 2
     4    3    4 1
     5    4    7 2
     6    5    6 1
     7    5    7 1
     8    6    9 1
     9    6   22 2
    10    7    8 1
    11    8    9 1
    12    9   10 2
    13   11   12 1
    14   11   22 1
    15   12   15 2
    16   12   16 1
    17   13   14 2
    18   13   17 1
    19   13   19 1
    20   14   15 1
    21   16   17 2
    22   18   19 2
    23   19   20 2
    24   19   21 am
    25   22   23 1
    26    1   24 1
    27    2   25 1
    28    3   26 1
    29    4   27 1
    30    8   28 1
    31   11   29 1
    32   14   30 1
    33   15   31 1
    34   16   32 1
    35   17   33 1
    36   21   34 1
    37   21   35 1
    38   23   36 1
    39   23   37 1
    40   23   38 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 5.9190
  Crash		| -1.3259
  Polar		| 1.9255
  FragIndex	| 1
  FragRMSD	| 0.215