@<TRIPOS>MOLECULE
BindingDB_50337286
 38 39 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        23.6604  -29.7853   62.5596  C     
2    C        24.2725  -30.9221   61.9831  C     
3    C        25.5562  -30.8347   61.4186  C     
4    C        26.2490  -29.6175   61.4203  C     
5    C        25.6732  -28.4669   62.0009  C     
6    C        24.3719  -28.5620   62.5463  C     
7    N        26.4105  -27.3284   61.9609  N     
8    C        26.0847  -26.1245   62.4853  C     
9    C        26.0427  -25.8774   63.8697  C     
10   C        25.7099  -24.5984   64.3530  C     
11   C        25.4526  -23.5037   63.4701  C     
12   C        25.4612  -23.8057   62.0844  C     
13   C        25.7909  -25.0773   61.5975  C     
14   C        22.3989  -29.8852   63.1961  C     
15   O        21.7770  -28.8066   63.7243  O     
16   O        21.7992  -31.0810   63.4015  O     
17   C        25.0969  -22.1102   63.9785  C     
18   C        25.8816  -21.7849   65.3033  C     
19   C        25.4287  -20.9272   62.9866  C     
20   C        23.5556  -22.0971   64.2168  C     
21   H        23.8063  -31.8318   61.9921  H     
22   H        25.9992  -31.6690   61.0270  H     
23   H        27.1854  -29.5797   61.0143  H     
24   H        23.9364  -27.7251   62.9413  H     
25   H        27.1982  -27.3429   61.3917  H     
26   H        26.2691  -26.6248   64.5344  H     
27   H        25.6628  -24.4750   65.3679  H     
28   H        25.2004  -23.1075   61.3912  H     
29   H        25.7803  -25.2464   60.5908  H     
30   H        25.5259  -22.3639   66.1559  H     
31   H        25.7980  -20.7296   65.5817  H     
32   H        26.9429  -22.0065   65.1759  H     
33   H        26.4785  -20.9725   62.6855  H     
34   H        25.2585  -19.9427   63.4483  H     
35   H        24.8095  -20.9505   62.0858  H     
36   H        23.0144  -22.3294   63.2919  H     
37   H        23.2235  -21.1163   64.5566  H     
38   H        23.2773  -22.8404   64.9678  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    1   14 1
     4    2    3 1
     5    3    4 2
     6    4    5 1
     7    5    6 2
     8    5    7 1
     9    7    8 1
    10    8    9 2
    11    8   13 1
    12    9   10 1
    13   10   11 2
    14   11   12 1
    15   11   17 1
    16   12   13 2
    17   14   15 2
    18   14   16 1
    19   17   18 1
    20   17   19 1
    21   17   20 1
    22    2   21 1
    23    3   22 1
    24    4   23 1
    25    6   24 1
    26    7   25 1
    27    9   26 1
    28   10   27 1
    29   12   28 1
    30   13   29 1
    31   18   30 1
    32   18   31 1
    33   18   32 1
    34   19   33 1
    35   19   34 1
    36   19   35 1
    37   20   36 1
    38   20   37 1
    39   20   38 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 1.5229
  Crash		| -3.9780
  Polar		| 0.0049
  FragIndex	| 1
  FragRMSD	| 1.357