COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       8.716  -0.151  -2.266  1.00  0.00           O  
HETATM    2  C   UNL     1       7.806   0.643  -2.222  1.00  0.00           C  
HETATM    3  C   UNL     1       7.437   1.435  -3.450  1.00  0.00           C  
HETATM    4  O   UNL     1       7.124   0.820  -1.080  1.00  0.00           O  
HETATM    5  C   UNL     1       7.480   0.058   0.104  1.00  0.00           C  
HETATM    6  C   UNL     1       8.459   0.854   1.001  1.00  0.00           C  
HETATM    7  O   UNL     1       9.129   1.860   0.239  1.00  0.00           O  
HETATM    8  C   UNL     1       7.554   1.496   2.070  1.00  0.00           C  
HETATM    9  O   UNL     1       7.697   2.918   2.036  1.00  0.00           O  
HETATM   10  O   UNL     1       6.199   1.131   1.759  1.00  0.00           O  
HETATM   11  C   UNL     1       6.254  -0.119   1.036  1.00  0.00           C  
HETATM   12  C   UNL     1       4.977  -0.327   0.221  1.00  0.00           C  
HETATM   13  O   UNL     1       3.869  -0.500   1.107  1.00  0.00           O  
HETATM   14  P   UNL     1       2.565  -0.712   0.186  1.00  0.00           P  
HETATM   15  O   UNL     1       2.277   0.631  -0.654  1.00  0.00           O  
HETATM   16  O   UNL     1       2.799  -1.836  -0.748  1.00  0.00           O  
HETATM   17  O   UNL     1       1.297  -1.044   1.120  1.00  0.00           O  
HETATM   18  P   UNL     1       0.199  -1.752   0.179  1.00  0.00           P  
HETATM   19  O   UNL     1       0.582  -3.303  -0.020  1.00  0.00           O  
HETATM   20  O   UNL     1       0.170  -1.078  -1.139  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.251  -1.641   0.870  1.00  0.00           O  
HETATM   22  C   UNL     1      -2.194  -2.178  -0.061  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.600  -2.102   0.537  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.609  -2.784  -0.407  1.00  0.00           C  
HETATM   25  O   UNL     1      -5.257  -3.877   0.247  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.631  -1.665  -0.738  1.00  0.00           C  
HETATM   27  O   UNL     1      -6.964  -2.179  -0.744  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.424  -0.678   0.439  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.000  -0.728   0.674  1.00  0.00           O  
HETATM   30  N   UNL     1      -5.837   0.675   0.061  1.00  0.00           N  
HETATM   31  C   UNL     1      -7.095   1.207   0.194  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.013   2.522  -0.295  1.00  0.00           C  
HETATM   33  N   UNL     1      -5.736   2.718  -0.702  1.00  0.00           N  
HETATM   34  C   UNL     1      -5.044   1.635  -0.494  1.00  0.00           C  
HETATM   35  N   UNL     1      -8.256   0.764   0.665  1.00  0.00           N  
HETATM   36  C   UNL     1      -9.320   1.540   0.665  1.00  0.00           C  
HETATM   37  N   UNL     1      -9.293   2.780   0.211  1.00  0.00           N  
HETATM   38  C   UNL     1      -8.175   3.311  -0.274  1.00  0.00           C  
HETATM   39  N   UNL     1      -8.157   4.611  -0.748  1.00  0.00           N  
HETATM   40  H   UNL     1       8.097   1.157  -4.273  1.00  0.00           H  
HETATM   41  H   UNL     1       6.404   1.220  -3.724  1.00  0.00           H  
HETATM   42  H   UNL     1       7.544   2.499  -3.242  1.00  0.00           H  
HETATM   43  H   UNL     1       7.902  -0.909  -0.171  1.00  0.00           H  
HETATM   44  H   UNL     1       9.182   0.183   1.465  1.00  0.00           H  
HETATM   45  H   UNL     1       9.723   2.321   0.847  1.00  0.00           H  
HETATM   46  H   UNL     1       7.822   1.120   3.057  1.00  0.00           H  
HETATM   47  H   UNL     1       7.113   3.273   2.721  1.00  0.00           H  
HETATM   48  H   UNL     1       6.410  -0.952   1.722  1.00  0.00           H  
HETATM   49  H   UNL     1       4.804   0.544  -0.412  1.00  0.00           H  
HETATM   50  H   UNL     1       5.084  -1.214  -0.404  1.00  0.00           H  
HETATM   51  H   UNL     1       2.131   1.337  -0.009  1.00  0.00           H  
HETATM   52  H   UNL     1       0.589  -3.704   0.860  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.161  -1.601  -0.985  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.944  -3.217  -0.272  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.615  -2.592   1.511  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.110  -3.126  -1.315  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.916  -4.222  -0.372  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.395  -1.190  -1.690  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.028  -2.784  -1.496  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.970  -1.013   1.321  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.996   1.515  -0.726  1.00  0.00           H  
HETATM   62  H   UNL     1     -10.249   1.148   1.051  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.335   4.988  -1.100  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.966   5.146  -0.728  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   40   41   42                                       
CONECT    4    2    5                                                 
CONECT    5    4    6   11   43                                       
CONECT    6    5    7    8   44                                       
CONECT    7    6   45                                                 
CONECT    8    6    9   10   46                                       
CONECT    9    8   47                                                 
CONECT   10    8   11                                                 
CONECT   11    5   10   12   48                                       
CONECT   12   11   13   49   50                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   16   16                                       
CONECT   14   17                                                      
CONECT   15   14   51                                                 
CONECT   16   14   14                                                 
CONECT   17   14   18                                                 
CONECT   18   17   19   20   20                                       
CONECT   18   21                                                      
CONECT   19   18   52                                                 
CONECT   20   18   18                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   53   54                                       
CONECT   23   22   24   29   55                                       
CONECT   24   23   25   26   56                                       
CONECT   25   24   57                                                 
CONECT   26   24   27   28   58                                       
CONECT   27   26   59                                                 
CONECT   28   26   29   30   60                                       
CONECT   29   23   28                                                 
CONECT   30   28   31   34                                            
CONECT   31   30   32   32   35                                       
CONECT   32   31   31   33   38                                       
CONECT   33   32   34   34                                            
CONECT   34   30   33   33   61                                       
CONECT   35   31   36   36                                            
CONECT   36   35   35   37   62                                       
CONECT   37   36   38   38                                            
CONECT   38   32   37   37   39                                       
CONECT   39   38   63   64                                            
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   15                                                      
CONECT   52   19                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   34                                                      
CONECT   62   36                                                      
CONECT   63   39                                                      
CONECT   64   39                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
