@<TRIPOS>MOLECULE
BindingDB_50075304
 32 33 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    P        39.0293   12.1779   96.5742  P     
2    C        39.2420   10.7717   95.7029  C     
3    C        38.1938   10.5819   94.6459  C     
4    O        37.7821   12.1586   97.2958  O     
5    C        35.2649   10.1041   91.5990  C     
6    C        34.2702   10.9484   91.2791  C     
7    F        39.2788    9.7464   96.6225  F     
8    F        40.4945   10.7884   95.1276  F     
9    O        40.1598   12.3486   97.6083  O     
10   O        39.0459   13.4285   95.6748  O     
11   C        38.2387   11.3474   93.4523  C     
12   C        37.1235    9.6641   94.7877  C     
13   C        36.1804   10.3103   92.6174  C     
14   C        33.3634   10.7982   90.2186  C     
15   C        36.1492    9.5180   93.7828  C     
16   C        37.2475   11.2241   92.4612  C     
17   C        32.1561   11.5404   90.2148  C     
18   C        33.6041    9.9388   89.1102  C     
19   C        32.6553    9.7965   88.0770  C     
20   C        31.2068   11.3986   89.1873  C     
21   C        31.4525   10.5205   88.1213  C     
22   H        35.3375    9.2320   91.1309  H     
23   H        34.1341   11.7323   91.8874  H     
24   H        39.0143   11.9942   93.2836  H     
25   H        37.0552    9.0795   95.6235  H     
26   H        35.4085    8.8250   93.9130  H     
27   H        37.3372   11.7732   91.6038  H     
28   H        31.9388   12.1809   90.9776  H     
29   H        34.4790    9.4156   89.0403  H     
30   H        32.8386    9.1631   87.2968  H     
31   H        30.3333   11.9290   89.2119  H     
32   H        30.7686   10.4161   87.3676  H     
@<TRIPOS>BOND
     1    1    2 1
     2    1    4 2
     3    1    9 1
     4    1   10 1
     5    2    3 1
     6    2    7 1
     7    2    8 1
     8    3   11 2
     9    3   12 1
    10    5    6 2
    11    5   13 1
    12    6   14 1
    13   11   16 1
    14   12   15 2
    15   13   15 1
    16   13   16 2
    17   14   17 2
    18   14   18 1
    19   17   20 1
    20   18   19 2
    21   19   21 1
    22   20   21 2
    23    5   22 1
    24    6   23 1
    25   11   24 1
    26   12   25 1
    27   15   26 1
    28   16   27 1
    29   17   28 1
    30   18   29 1
    31   19   30 1
    32   20   31 1
    33   21   32 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 2.1841
  Crash		| -0.5761
  Polar		| 0.0000
  FragIndex	| 1
  FragRMSD	| 0.821