@<TRIPOS>MOLECULE
BindingDB_50070003
 30 31 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    P        27.3014   22.5810   -2.9649  P     
2    C        26.6765   21.1932   -2.2665  C     
3    C        22.7010   19.7103    4.5217  C     
4    P        23.5297   18.8889    5.7226  P     
5    C        23.4565   19.8236    3.2365  C     
6    C        26.0199   21.2045   -0.9356  C     
7    C        24.0243   21.0421    2.7780  C     
8    C        25.5174   20.0323   -0.4664  C     
9    O        26.4626   23.8176   -2.5966  O     
10   C        24.8507   19.9419    0.7586  C     
11   C        24.7233   21.1131    1.5511  C     
12   O        28.6652   22.8270   -2.5733  O     
13   O        24.9117   18.5844    5.4533  O     
14   C        23.5983   18.6736    2.4262  C     
15   C        25.8992   22.3289   -0.1253  C     
16   F        27.7257   20.3009   -2.2097  F     
17   F        25.7774   20.7215   -3.2015  F     
18   F        22.3276   20.9418    5.0063  F     
19   F        21.5155   19.0541    4.2874  F     
20   O        27.2883   22.4739   -4.5038  O     
21   O        23.6044   19.7504    6.9975  O     
22   O        22.8528   17.5785    6.1850  O     
23   C        25.2819   22.2997    1.0744  C     
24   C        24.2761   18.7321    1.2014  C     
25   H        23.9247   21.8912    3.3399  H     
26   H        25.6052   19.2054   -1.0121  H     
27   H        23.1890   17.7802    2.7138  H     
28   H        26.2787   23.1995   -0.4071  H     
29   H        25.2272   23.1317    1.6127  H     
30   H        24.3192   17.8866    0.6271  H     
@<TRIPOS>BOND
     1    1    2 1
     2    1    9 1
     3    1   12 2
     4    1   20 1
     5    2    6 1
     6    2   16 1
     7    2   17 1
     8    3    4 1
     9    3    5 1
    10    3   18 1
    11    3   19 1
    12    4   13 2
    13    4   21 1
    14    4   22 1
    15    5    7 1
    16    5   14 2
    17    6    8 2
    18    6   15 1
    19    7   11 2
    20    8   10 1
    21   10   11 1
    22   10   24 2
    23   11   23 1
    24   14   24 1
    25   15   23 2
    26    7   25 1
    27    8   26 1
    28   14   27 1
    29   15   28 1
    30   23   29 1
    31   24   30 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 7.1955
  Crash		| -2.8912
  Polar		| 5.2653
  FragIndex	| 1
  FragRMSD	| 1.186