@<TRIPOS>MOLECULE
BindingDB_7134
 30 32 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C        13.3990   45.7603   22.2060  C     
2    C        12.5938   45.6409   23.3321  C     
3    C        11.5512   46.5541   23.1648  C     
4    N        12.8137   46.6849   21.4280  N     
5    N        11.7459   47.1636   21.9816  N     
6    N        10.4952   46.9006   23.9429  N     
7    C        10.1275   46.4332   25.1382  C     
8    O        10.7686   45.5154   25.6364  O     
9    C        14.6452   45.0571   21.8380  C     
10   C        15.8455   45.3422   22.7619  C     
11   C        15.2548   43.9280   22.6882  C     
12   C         9.0299   46.9503   25.8551  C     
13   C         8.5068   46.2662   26.9901  C     
14   C         8.4083   48.1837   25.5059  C     
15   C         7.3336   48.7032   26.2536  C     
16   C         6.8412   48.0122   27.3670  C     
17   C         7.4358   46.7890   27.7390  C     
18   Cl        6.8595   45.9614   29.1033  Cl    
19   H        12.7558   45.0235   24.1323  H     
20   H        13.1595   46.9693   20.5716  H     
21   H         9.9304   47.5896   23.5670  H     
22   H        14.9315   45.0643   20.7782  H     
23   H        16.8214   45.4467   22.2824  H     
24   H        15.6729   45.8457   23.7143  H     
25   H        14.6750   43.6053   23.5565  H     
26   H        15.8500   43.1973   22.1357  H     
27   H         8.9057   45.3718   27.2843  H     
28   H         8.7391   48.7391   24.7142  H     
29   H         6.9155   49.5992   25.9795  H     
30   H         6.0665   48.4023   27.9058  H     
@<TRIPOS>BOND
     1    1    2 2
     2    1    4 1
     3    1    9 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   12 1
    11    9   10 1
    12    9   11 1
    13   10   11 1
    14   12   13 2
    15   12   14 1
    16   13   17 1
    17   14   15 2
    18   15   16 1
    19   16   17 2
    20   17   18 1
    21    2   19 1
    22    4   20 1
    23    6   21 1
    24    9   22 1
    25   10   23 1
    26   10   24 1
    27   11   25 1
    28   11   26 1
    29   13   27 1
    30   14   28 1
    31   15   29 1
    32   16   30 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 6.2890
  Crash		| -0.8021
  Polar		| 3.3761
  FragIndex	| 1
  FragRMSD	| 0.238