@<TRIPOS>MOLECULE
BindingDB_15696
 40 42 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C         5.5765   29.5085   58.9379  C     
2    C         4.2620   29.8573   58.5750  C     
3    C         3.9629   31.2179   58.3480  C     
4    C         4.9475   32.2097   58.5297  C     
5    C         6.2576   31.8732   58.9469  C     
6    C         6.5615   30.5009   59.1242  C     
7    C         8.5490   32.8416   58.7917  C     
8    C         6.9579   33.9393   59.9707  C     
9    C         8.1122   34.7609   60.1909  C     
10   C         9.2737   33.8525   59.7277  C     
11   N         7.1907   32.8512   59.2415  N     
12   O         5.8836   34.2446   60.4729  O     
13   C         9.9711   33.2219   60.8483  C     
14   O         9.4044   32.3141   61.4581  O     
15   N        11.2136   33.6135   61.1446  N     
16   C        12.1356   33.1359   62.0421  C     
17   C        12.0299   31.9461   62.8081  C     
18   C        13.0960   31.4994   63.6164  C     
19   C        14.2816   32.2528   63.6877  C     
20   C        14.3944   33.4522   62.9632  C     
21   C        13.3333   33.8840   62.1452  C     
22   Cl       12.9631   30.0403   64.4646  Cl    
23   C         3.2175   28.8078   58.4700  C     
24   H         5.8202   28.5315   59.1056  H     
25   H         3.0224   31.5037   58.0715  H     
26   H         4.6994   33.1839   58.3657  H     
27   H         7.4877   30.2156   59.4379  H     
28   H         8.5776   33.1848   57.7555  H     
29   H         9.0136   31.8522   58.8389  H     
30   H         8.0442   35.6610   59.5776  H     
31   H         8.2067   35.0525   61.2419  H     
32   H         9.9785   34.4474   59.1384  H     
33   H        11.5251   34.3657   60.6086  H     
34   H        11.1947   31.3674   62.7616  H     
35   H        15.0695   31.9280   64.2508  H     
36   H        15.2577   34.0007   63.0190  H     
37   H        13.4560   34.7497   61.6079  H     
38   H         3.5036   28.0628   57.7279  H     
39   H         2.2466   29.2178   58.1809  H     
40   H         3.1004   28.3064   59.4334  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    6 1
     3    2    3 1
     4    2   23 1
     5    3    4 2
     6    4    5 1
     7    5    6 2
     8    5   11 1
     9    7   10 1
    10    7   11 1
    11    8    9 1
    12    8   11 1
    13    8   12 2
    14    9   10 1
    15   10   13 1
    16   13   14 2
    17   13   15 am
    18   15   16 1
    19   16   17 2
    20   16   21 1
    21   17   18 1
    22   18   19 2
    23   18   22 1
    24   19   20 1
    25   20   21 2
    26    1   24 1
    27    3   25 1
    28    4   26 1
    29    6   27 1
    30    7   28 1
    31    7   29 1
    32    9   30 1
    33    9   31 1
    34   10   32 1
    35   15   33 1
    36   17   34 1
    37   19   35 1
    38   20   36 1
    39   21   37 1
    40   23   38 1
    41   23   39 1
    42   23   40 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 1.8256
  Crash		| -1.0872
  Polar		| 0.0776
  FragIndex	| 1
  FragRMSD	| 1.284