@<TRIPOS>MOLECULE
BindingDB_50310540
 33 34 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        37.5313    1.4064   13.1545  C     
2    C        38.5194    0.2391   13.4394  C     
3    C        39.4008   -0.1994   12.2427  C     
4    C        38.6157   -1.3839   11.6721  C     
5    C        37.9898   -1.9972   12.9408  C     
6    O        37.7313   -0.9021   13.8321  O     
7    N        36.8052   -2.8144   12.7002  N     
8    C        35.8177   -2.4327   11.8584  C     
9    O        35.7941   -1.3721   11.2524  O     
10   N        34.7841   -3.2285   11.6228  N     
11   C        34.6667   -4.4408   12.2182  C     
12   C        35.6336   -4.8396   13.1255  C     
13   C        36.6807   -4.0209   13.3387  C     
14   P        38.8765    3.4635   12.3313  P     
15   O        40.0733    3.2859   11.5497  O     
16   O        37.8695    2.3068   12.0892  O     
17   O        40.7080   -0.5833   12.6850  O     
18   O        39.4342   -2.3016   10.9534  O     
19   N        33.6376   -5.2325   11.8784  N     
20   O        38.1377    4.7036   11.7993  O     
21   O        39.2332    3.7231   13.8068  O     
22   H        36.5788    0.9799   12.8459  H     
23   H        37.3364    1.9559   14.0794  H     
24   H        39.1543    0.5304   14.2806  H     
25   H        39.5179    0.5804   11.4885  H     
26   H        37.8432   -1.0072   10.9982  H     
27   H        38.7766   -2.5826   13.4343  H     
28   H        35.5682   -5.7154   13.5897  H     
29   H        37.3782   -4.3308   13.9769  H     
30   H        40.5700   -1.2104   13.4252  H     
31   H        39.3173   -2.0338   10.0177  H     
32   H        33.5407   -6.1127   12.2781  H     
33   H        33.0413   -4.9526   11.1676  H     
@<TRIPOS>BOND
     1    2    1 1
     2    1   16 1
     3    2    3 1
     4    2    6 1
     5    3    4 1
     6    3   17 1
     7    4    5 1
     8    4   18 1
     9    5    6 1
    10    5    7 1
    11    7    8 1
    12    7   13 1
    13    8    9 2
    14    8   10 1
    15   10   11 2
    16   11   12 1
    17   11   19 1
    18   12   13 2
    19   14   15 2
    20   14   16 1
    21   14   20 1
    22   14   21 1
    23    1   22 1
    24    1   23 1
    25    2   24 1
    26    3   25 1
    27    4   26 1
    28    5   27 1
    29   12   28 1
    30   13   29 1
    31   17   30 1
    32   18   31 1
    33   19   32 1
    34   19   33 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 2.8388
  Crash		| -0.8856
  Polar		| 5.0695
  FragIndex	| 1
  FragRMSD	| 1.368