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


@<TRIPOS>ATOM
1    C       -13.6640   51.8969    7.3665  C     
2    C       -13.2649   52.5594    6.0211  C     
3    C       -12.9776   51.5460    4.8975  C     
4    C       -11.4459   51.4081    4.9662  C     
5    C       -10.9841   52.8323    5.3614  C     
6    O       -12.0733   53.3462    6.1634  O     
7    N        -9.6667   52.9863    5.9845  N     
8    C        -8.6154   52.2039    5.6409  C     
9    O        -8.6824   51.2246    4.9153  O     
10   N        -7.3850   52.4931    6.0499  N     
11   C        -7.1293   53.5674    6.8329  C     
12   C        -8.1840   54.3605    7.2502  C     
13   C        -9.4221   54.0445    6.8279  C     
14   P       -13.4893   49.5806    8.4410  P     
15   O       -14.6133   48.9983    7.7549  O     
16   O       -12.8578   50.7271    7.6019  O     
17   O       -13.4343   52.0661    3.6453  O     
18   O       -10.9306   50.9219    3.7337  O     
19   N        -5.8597   53.8436    7.1709  N     
20   O       -13.9203   50.0448    9.8487  O     
21   O       -12.4229   48.4736    8.5473  O     
22   H       -13.5190   52.6179    8.1765  H     
23   H       -14.7303   51.6507    7.3090  H     
24   H       -14.0775   53.2316    5.7289  H     
25   H       -13.4656   50.5810    5.0593  H     
26   H       -11.1601   50.6974    5.7447  H     
27   H       -10.9685   53.4411    4.4520  H     
28   H        -8.0306   55.1425    7.8465  H     
29   H       -10.1579   54.6351    7.1378  H     
30   H       -12.9517   52.9081    3.5108  H     
31   H       -10.4920   51.6868    3.3094  H     
32   H        -5.6569   54.6266    7.7066  H     
33   H        -5.1409   53.2706    6.8606  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	| 4.0446
  Crash		| -1.0381
  Polar		| 5.9051
  FragIndex	| 1
  FragRMSD	| 1.414