@<TRIPOS>MOLECULE
BindingDB_7095
 36 38 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C       -12.8980  205.5849  110.4788  C     
2    C       -12.0438  206.0216  111.4794  C     
3    C       -10.9012  206.4966  110.8383  C     
4    N       -12.2540  205.7933  109.3176  N     
5    N       -11.0907  206.3290  109.5155  N     
6    N        -9.7604  207.0423  111.3240  N     
7    C        -9.3866  207.2185  112.5871  C     
8    O       -10.0777  206.8267  113.5209  O     
9    C        -8.0934  207.8261  112.8839  C     
10   C        -6.9978  206.8104  112.9420  C     
11   C        -4.8718  204.9201  112.9454  C     
12   C        -5.4339  205.3515  111.7298  C     
13   C        -6.4845  206.2867  111.7301  C     
14   C        -6.4104  206.3791  114.1596  C     
15   C        -5.3573  205.4422  114.1600  C     
16   C       -14.2563  205.0166  110.5820  C     
17   C       -14.4174  203.8939  111.6190  C     
18   C       -15.1357  205.2285  111.8254  C     
19   N        -8.2276  208.6464  114.1016  N     
20   H       -12.2302  206.0044  112.4796  H     
21   H       -12.6140  205.5727  108.4422  H     
22   H        -9.1251  207.3305  110.6493  H     
23   H        -7.8335  208.5341  112.0902  H     
24   H        -4.0976  204.2420  112.9442  H     
25   H        -5.0711  204.9920  110.8434  H     
26   H        -6.8684  206.5901  110.8342  H     
27   H        -6.7343  206.7486  115.0589  H     
28   H        -4.9296  205.1459  115.0392  H     
29   H       -14.7857  204.8045  109.6496  H     
30   H       -15.0679  203.0624  111.3478  H     
31   H       -13.5860  203.7124  112.3003  H     
32   H       -14.7355  205.8564  112.6231  H     
33   H       -16.2125  205.2053  111.6529  H     
34   H        -8.9702  209.3412  113.9483  H     
35   H        -7.3554  209.1321  114.2981  H     
36   H        -8.4856  208.0636  114.9015  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    4 1
     3    1   16 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    9 1
    11    9   10 1
    12    9   19 1
    13   10   13 1
    14   10   14 2
    15   11   12 1
    16   11   15 2
    17   12   13 2
    18   14   15 1
    19   16   17 1
    20   16   18 1
    21   17   18 1
    22    2   20 1
    23    4   21 1
    24    6   22 1
    25    9   23 1
    26   11   24 1
    27   12   25 1
    28   13   26 1
    29   14   27 1
    30   15   28 1
    31   16   29 1
    32   17   30 1
    33   17   31 1
    34   18   32 1
    35   18   33 1
    36   19   34 1
    37   19   35 1
    38   19   36 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 7.3488
  Crash		| -0.9353
  Polar		| 3.5312
  FragIndex	| 1
  FragRMSD	| 0.223