@<TRIPOS>MOLECULE
BindingDB_50070000
 30 31 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    P        46.6861    8.5798   -0.4823  P     
2    P        45.5873   15.8396    5.3763  P     
3    C        46.3575   15.6553    3.9093  C     
4    C        45.8965    8.7736    0.9695  C     
5    C        45.3767   10.1633    1.1491  C     
6    C        45.7173   14.6525    3.0506  C     
7    C        45.5621   12.4282    2.1195  C     
8    C        46.1916   13.3793    2.9419  C     
9    C        46.0554   11.1116    1.9547  C     
10   O        45.6591    8.4957   -1.6333  O     
11   O        47.6470    9.7526   -0.7994  O     
12   O        46.1775   17.0160    6.1734  O     
13   O        44.0783   16.1208    5.2129  O     
14   O        47.4540    7.3518   -0.5070  O     
15   O        45.7171   14.6811    6.2225  O     
16   C        44.3821   12.8163    1.4230  C     
17   C        44.5929   15.0030    2.3234  C     
18   C        44.1928   10.5651    0.4915  C     
19   C        43.9251   14.1239    1.5549  C     
20   C        43.7077   11.8779    0.6096  C     
21   F        46.7241    8.4035    2.0014  F     
22   F        47.6868   15.4097    4.1540  F     
23   H        46.3370   16.6287    3.4184  H     
24   H        45.0722    8.0614    0.9795  H     
25   H        46.9891   13.1012    3.4664  H     
26   H        46.9292   10.8441    2.4192  H     
27   H        44.2468   15.9314    2.3706  H     
28   H        43.6743    9.9052   -0.0931  H     
29   H        43.1080   14.4222    1.0693  H     
30   H        42.8662   12.1507    0.0946  H     
@<TRIPOS>BOND
     1    1    4 1
     2    1   10 1
     3    1   11 1
     4    1   14 2
     5    2    3 1
     6    2   12 1
     7    2   13 1
     8    2   15 2
     9    3    6 1
    10    3   22 1
    11    4    5 1
    12    4   21 1
    13    5    9 1
    14    5   18 2
    15    6    8 2
    16    6   17 1
    17    7    8 1
    18    7    9 2
    19    7   16 1
    20   16   19 1
    21   16   20 2
    22   17   19 2
    23   18   20 1
    24    3   23 1
    25    4   24 1
    26    8   25 1
    27    9   26 1
    28   17   27 1
    29   18   28 1
    30   19   29 1
    31   20   30 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 9.5421
  Crash		| -0.5793
  Polar		| 5.5390
  FragIndex	| 1
  FragRMSD	| 0.848