@<TRIPOS>MOLECULE
BindingDB_7155
 37 39 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C       -12.7627  205.5767  110.4458  C     
2    C       -11.9110  206.0765  111.4242  C     
3    C       -10.7473  206.4676  110.7660  C     
4    N       -12.1017  205.6837  109.2838  N     
5    N       -10.9303  206.2052  109.4605  N     
6    N        -9.5975  207.0216  111.2205  N     
7    C        -9.2462  207.3226  112.4618  C     
8    O        -9.9648  207.0867  113.4252  O     
9    C       -14.1360  205.0450  110.5631  C     
10   C       -14.3214  203.8719  111.5399  C     
11   C       -14.9774  205.2260  111.8356  C     
12   C        -7.9421  207.9163  112.7075  C     
13   C        -6.9078  206.8678  112.9423  C     
14   C        -4.9787  204.8615  113.4408  C     
15   C        -5.2895  205.1962  112.0923  C     
16   C        -6.2618  206.2001  111.8687  C     
17   C        -6.5643  206.5077  114.2633  C     
18   C        -5.6068  205.5055  114.5033  C     
19   O        -4.7289  204.6190  110.9709  O     
20   C        -3.8704  203.4593  111.0406  C     
21   H       -12.1102  206.1468  112.4219  H     
22   H       -12.4620  205.4222  108.4213  H     
23   H        -8.9437  207.2324  110.5358  H     
24   H       -14.7004  204.9054  109.6369  H     
25   H       -15.0187  203.0875  111.2374  H     
26   H       -13.4915  203.6169  112.2037  H     
27   H       -14.5346  205.8026  112.6495  H     
28   H       -16.0573  205.2728  111.6807  H     
29   H        -7.6423  208.5531  111.8701  H     
30   H        -8.0163  208.5869  113.5720  H     
31   H        -4.2887  204.1359  113.6532  H     
32   H        -6.5011  206.4500  110.9049  H     
33   H        -7.0154  206.9605  115.0598  H     
34   H        -5.3759  205.2440  115.4666  H     
35   H        -2.9529  203.6882  111.5922  H     
36   H        -3.6016  203.1681  110.0349  H     
37   H        -4.3875  202.6211  111.5211  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    4 1
     3    1    9 1
     4    2    3 1
     5    3    5 2
     6    3    6 1
     7    4    5 1
     8    6    7 am
     9    7    8 2
    10    7   12 1
    11    9   10 1
    12    9   11 1
    13   10   11 1
    14   12   13 1
    15   13   16 1
    16   13   17 2
    17   14   15 1
    18   14   18 2
    19   15   16 2
    20   15   19 1
    21   17   18 1
    22   19   20 1
    23    2   21 1
    24    4   22 1
    25    6   23 1
    26    9   24 1
    27   10   25 1
    28   10   26 1
    29   11   27 1
    30   11   28 1
    31   12   29 1
    32   12   30 1
    33   14   31 1
    34   16   32 1
    35   17   33 1
    36   18   34 1
    37   20   35 1
    38   20   36 1
    39   20   37 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 8.1075
  Crash		| -0.6399
  Polar		| 3.1968
  FragIndex	| 1
  FragRMSD	| 0.085