@<TRIPOS>MOLECULE
BindingDB_7094
 33 35 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C       -12.9097  205.5631  110.4556  C     
2    C       -12.0615  206.0133  111.4607  C     
3    C       -10.9120  206.4631  110.8159  C     
4    N       -12.2534  205.7311  109.2995  N     
5    N       -11.0895  206.2632  109.4987  N     
6    N        -9.7728  207.0305  111.2793  N     
7    C        -9.4165  207.2978  112.5292  C     
8    O       -10.1076  206.9757  113.4896  O     
9    C        -8.1535  207.9707  112.7939  C     
10   C        -7.0358  206.9939  112.8979  C     
11   C        -4.9974  205.0404  113.1459  C     
12   C        -5.5599  205.6225  114.2949  C     
13   C        -6.5661  206.5966  114.1722  C     
14   C        -6.4558  206.4052  111.7458  C     
15   C        -5.4433  205.4346  111.8699  C     
16   C       -14.2857  205.0342  110.5188  C     
17   C       -14.5142  203.9100  111.5437  C     
18   C       -15.2209  205.2584  111.7204  C     
19   F        -7.8701  208.9115  111.8298  F     
20   H       -12.2661  206.0369  112.4586  H     
21   H       -12.6089  205.5015  108.4252  H     
22   H        -9.1421  207.3080  110.5944  H     
23   H        -8.2467  208.5468  113.7229  H     
24   H        -4.2794  204.3215  113.2387  H     
25   H        -5.2552  205.3221  115.2214  H     
26   H        -6.9800  206.9909  115.0240  H     
27   H        -6.7781  206.6630  110.8087  H     
28   H        -5.0487  204.9959  111.0336  H     
29   H       -14.7911  204.8367  109.5681  H     
30   H       -15.1628  203.0951  111.2204  H     
31   H       -13.7242  203.7119  112.2720  H     
32   H       -14.8459  205.9117  112.5100  H     
33   H       -16.2845  205.2765  111.4787  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    4 1
     3    1   16 1
     4    2    3 1
     5    3    5 2
     6    3    6 1
     7    4    5 1
     8    6    7 am
     9    7    8 2
    10    7    9 1
    11    9   10 1
    12    9   19 1
    13   10   13 1
    14   10   14 2
    15   11   12 1
    16   11   15 2
    17   12   13 2
    18   14   15 1
    19   16   17 1
    20   16   18 1
    21   17   18 1
    22    2   20 1
    23    4   21 1
    24    6   22 1
    25    9   23 1
    26   11   24 1
    27   12   25 1
    28   13   26 1
    29   14   27 1
    30   15   28 1
    31   16   29 1
    32   17   30 1
    33   17   31 1
    34   18   32 1
    35   18   33 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 7.1777
  Crash		| -0.5249
  Polar		| 3.3558
  FragIndex	| 1
  FragRMSD	| 0.209