@<TRIPOS>MOLECULE
BindingDB_19812
 73 74 0 0 0
SMALL
NO_CHARGES


@<TRIPOS>ATOM
1    C       -15.7150  -26.6091   59.0226  C     
2    C       -14.9673  -26.2235   60.1466  C     
3    C       -14.0647  -25.1505   60.0594  C     
4    C       -13.9192  -24.4539   58.8391  C     
5    C       -14.6876  -24.8243   57.7193  C     
6    C       -15.5997  -25.8973   57.7990  C     
7    C       -16.4455  -26.2389   56.6353  C     
8    O       -17.7466  -25.6371   56.6973  O     
9    C       -18.6412  -25.7080   57.7196  C     
10   O       -18.3298  -26.3564   58.8586  O     
11   N       -19.8686  -25.1458   57.6555  N     
12   C       -20.4825  -24.5639   56.5010  C     
13   C       -21.7569  -25.3771   56.0963  C     
14   C       -22.9007  -25.5310   57.1660  C     
15   C       -24.1458  -24.6624   56.8332  C     
16   C       -23.3394  -27.0095   57.3574  C     
17   C       -20.7275  -23.1439   56.7281  C     
18   O       -21.3727  -22.7790   57.7035  O     
19   N       -20.2255  -22.2520   55.8755  N     
20   C       -20.4263  -20.8358   55.8270  C     
21   C       -21.8922  -20.4109   55.6058  C     
22   C       -20.9266  -18.9628   57.2126  C     
23   C       -20.0351  -20.0582   56.9706  C     
24   O       -18.8951  -20.0703   57.4238  O     
25   N       -22.0105  -19.1544   56.2817  N     
26   C       -23.0346  -18.2846   56.1765  C     
27   O       -23.0938  -17.3811   57.0220  O     
28   C       -24.1443  -18.3966   55.1980  C     
29   N       -25.3014  -17.5090   55.5410  N     
30   C       -25.2742  -16.0848   55.1024  C     
31   C       -23.7159  -18.2573   53.6849  C     
32   C       -24.5993  -19.0312   52.6432  C     
33   C       -26.0147  -18.4124   52.4445  C     
34   C       -23.8736  -19.1359   51.2716  C     
35   H       -16.3655  -27.3922   59.1019  H     
36   H       -15.0853  -26.7244   61.0317  H     
37   H       -13.5313  -24.8661   60.8789  H     
38   H       -13.2611  -23.6805   58.7705  H     
39   H       -14.5839  -24.2908   56.8484  H     
40   H       -15.9537  -25.9041   55.7190  H     
41   H       -16.5810  -27.3174   56.5481  H     
42   H       -20.4154  -25.2164   58.4510  H     
43   H       -19.7996  -24.6508   55.6442  H     
44   H       -22.1620  -24.9362   55.1801  H     
45   H       -21.3988  -26.3643   55.8097  H     
46   H       -22.5263  -25.1912   58.1359  H     
47   H       -23.8674  -23.6103   56.7102  H     
48   H       -24.8751  -24.7201   57.6472  H     
49   H       -24.6206  -25.0039   55.9127  H     
50   H       -23.7440  -27.4235   56.4284  H     
51   H       -24.1027  -27.0824   58.1341  H     
52   H       -22.4893  -27.6198   57.6665  H     
53   H       -19.6890  -22.6130   55.1513  H     
54   H       -19.8314  -20.4623   54.9853  H     
55   H       -22.0950  -20.3602   54.5407  H     
56   H       -22.5866  -21.1125   56.0642  H     
57   H       -21.2663  -18.9920   58.2534  H     
58   H       -20.4146  -18.0160   57.0104  H     
59   H       -24.5441  -19.4007   55.3431  H     
60   H       -26.1506  -17.9215   55.1440  H     
61   H       -25.4035  -17.5255   56.5617  H     
62   H       -24.2551  -15.6696   55.1703  H     
63   H       -25.9354  -15.5101   55.7471  H     
64   H       -25.6368  -15.9915   54.0734  H     
65   H       -23.6752  -17.2012   53.3986  H     
66   H       -22.6857  -18.6141   53.5828  H     
67   H       -24.7355  -20.0508   53.0086  H     
68   H       -26.6204  -18.5493   53.3402  H     
69   H       -26.5464  -18.9149   51.6261  H     
70   H       -25.9481  -17.3473   52.2143  H     
71   H       -23.7029  -18.1419   50.8468  H     
72   H       -24.4663  -19.7207   50.5671  H     
73   H       -22.9068  -19.6307   51.3885  H     
@<TRIPOS>BOND
     1    1    2 1
     2    1    6 2
     3    2    3 2
     4    3    4 1
     5    4    5 2
     6    5    6 1
     7    6    7 1
     8    7    8 1
     9    8    9 1
    10    9   10 2
    11    9   11 am
    12   11   12 1
    13   12   13 1
    14   12   17 1
    15   13   14 1
    16   14   15 1
    17   14   16 1
    18   17   18 2
    19   17   19 am
    20   19   20 1
    21   20   21 1
    22   20   23 1
    23   21   25 1
    24   22   23 1
    25   22   25 1
    26   23   24 2
    27   25   26 am
    28   26   27 2
    29   26   28 1
    30   28   29 1
    31   28   31 1
    32   29   30 1
    33   31   32 1
    34   32   33 1
    35   32   34 1
    36    1   35 1
    37    2   36 1
    38    3   37 1
    39    4   38 1
    40    5   39 1
    41    7   40 1
    42    7   41 1
    43   11   42 1
    44   12   43 1
    45   13   44 1
    46   13   45 1
    47   14   46 1
    48   15   47 1
    49   15   48 1
    50   15   49 1
    51   16   50 1
    52   16   51 1
    53   16   52 1
    54   19   53 1
    55   20   54 1
    56   21   55 1
    57   21   56 1
    58   22   57 1
    59   22   58 1
    60   28   59 1
    61   29   60 1
    62   29   61 1
    63   30   62 1
    64   30   63 1
    65   30   64 1
    66   31   65 1
    67   31   66 1
    68   32   67 1
    69   33   68 1
    70   33   69 1
    71   33   70 1
    72   34   71 1
    73   34   72 1
    74   34   73 1
@<TRIPOS>PROPERTY_DATA
  Total_Score	| 5.0608
  Crash		| -2.3893
  Polar		| 0.8815
  FragIndex	| 1
  FragRMSD	| 1.439