COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.559   1.435  -2.699  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.711   2.172  -1.953  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.504   0.979  -4.019  1.00  0.00           C  
HETATM    4  C   UNL     1       5.542   1.052  -0.040  1.00  0.00           C  
HETATM    5  C   UNL     1       3.884  -3.934  -1.375  1.00  0.00           C  
HETATM    6  C   UNL     1       6.103  -3.758  -0.495  1.00  0.00           C  
HETATM    7  C   UNL     1       4.262  -2.807   0.703  1.00  0.00           C  
HETATM    8  C   UNL     1       1.607  -1.615  -0.839  1.00  0.00           C  
HETATM    9  C   UNL     1       0.095  -1.383  -0.834  1.00  0.00           C  
HETATM   10  C   UNL     1       1.921  -2.954  -0.170  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.228  -0.106  -1.612  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.746   0.059  -1.714  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.603  -0.203  -0.158  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.192  -0.111   1.225  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.069   1.336  -2.492  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.345   2.081  -1.763  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.291   1.616  -3.078  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.138   0.884  -3.826  1.00  0.00           C  
HETATM   19  C   UNL     1       3.552  -0.222  -0.373  1.00  0.00           C  
HETATM   20  C   UNL     1       3.396  -3.240  -0.284  1.00  0.00           C  
HETATM   21  C   UNL     1       5.237  -4.195  -1.480  1.00  0.00           C  
HETATM   22  C   UNL     1       5.616  -3.059   0.593  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.458  -0.102   2.123  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.402  -1.012   2.177  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.849  -1.059   3.640  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.108  -2.256   2.721  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.620   0.016   3.126  1.00  0.00           C  
HETATM   28  C   UNL     1       5.624   2.198  -1.071  1.00  0.00           C  
HETATM   29  C   UNL     1       6.695   3.043   0.788  1.00  0.00           C  
HETATM   30  C   UNL     1       6.303   1.593   1.186  1.00  0.00           C  
HETATM   31  C   UNL     1       5.902   3.095   3.003  1.00  0.00           C  
HETATM   32  C   UNL     1       5.298   1.831   2.342  1.00  0.00           C  
HETATM   33  N   UNL     1       2.269  -0.535  -0.103  1.00  0.00           N  
HETATM   34  N   UNL     1      -2.319   0.148  -0.369  1.00  0.00           N  
HETATM   35  N   UNL     1      -5.591  -0.545   1.191  1.00  0.00           N  
HETATM   36  O   UNL     1       0.328   1.020  -0.931  1.00  0.00           O  
HETATM   37  O   UNL     1      -4.284  -0.593  -1.083  1.00  0.00           O  
HETATM   38  O   UNL     1       4.160  -0.837  -1.227  1.00  0.00           O  
HETATM   39  O   UNL     1       4.160   0.770   0.304  1.00  0.00           O  
HETATM   40  O   UNL     1      -7.743  -0.501   2.091  1.00  0.00           O  
HETATM   41  O   UNL     1      -6.079   0.658   2.992  1.00  0.00           O  
HETATM   42  O   UNL     1       5.788   3.393  -0.280  1.00  0.00           O  
HETATM   43  O   UNL     1       6.429   3.879   1.922  1.00  0.00           O  
HETATM   44  H   UNL     1      -6.326   2.677  -1.222  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.957   0.545  -4.898  1.00  0.00           H  
HETATM   46  H   UNL     1       6.029   0.156  -0.426  1.00  0.00           H  
HETATM   47  H   UNL     1       3.207  -4.275  -2.145  1.00  0.00           H  
HETATM   48  H   UNL     1       7.161  -3.963  -0.576  1.00  0.00           H  
HETATM   49  H   UNL     1       3.881  -2.261   1.554  1.00  0.00           H  
HETATM   50  H   UNL     1       1.969  -1.628  -1.867  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.404  -2.231  -1.304  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.254  -1.281   0.193  1.00  0.00           H  
HETATM   53  H   UNL     1       1.639  -2.910   0.882  1.00  0.00           H  
HETATM   54  H   UNL     1       1.358  -3.747  -0.663  1.00  0.00           H  
HETATM   55  H   UNL     1       0.198  -0.173  -2.613  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.171  -0.800  -2.234  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.141   0.920   1.575  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.569   1.308  -3.460  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.722   2.202  -1.929  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.892   2.515  -0.884  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.360   1.679  -3.221  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.524   0.379  -4.557  1.00  0.00           H  
HETATM   63  H   UNL     1       5.617  -4.741  -2.330  1.00  0.00           H  
HETATM   64  H   UNL     1       6.294  -2.710   1.358  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.334  -1.087   1.975  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.075  -1.165   4.399  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.706  -0.448   3.924  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.135  -2.432   2.401  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.503  -3.149   2.877  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.650   1.104   3.067  1.00  0.00           H  
HETATM   71  H   UNL     1      -9.625  -0.383   2.984  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.245  -0.285   4.104  1.00  0.00           H  
HETATM   73  H   UNL     1       6.482   2.057  -1.728  1.00  0.00           H  
HETATM   74  H   UNL     1       4.704   2.250  -1.654  1.00  0.00           H  
HETATM   75  H   UNL     1       7.736   3.110   0.472  1.00  0.00           H  
HETATM   76  H   UNL     1       7.157   0.976   1.466  1.00  0.00           H  
HETATM   77  H   UNL     1       5.130   3.646   3.540  1.00  0.00           H  
HETATM   78  H   UNL     1       6.710   2.818   3.680  1.00  0.00           H  
HETATM   79  H   UNL     1       4.297   2.029   1.957  1.00  0.00           H  
HETATM   80  H   UNL     1       5.291   0.990   3.035  1.00  0.00           H  
HETATM   81  H   UNL     1       1.783  -0.044   0.579  1.00  0.00           H  
HETATM   82  H   UNL     1      -1.774   0.460   0.371  1.00  0.00           H  
HETATM   83  H   UNL     1      -5.893  -1.152   0.497  1.00  0.00           H  
HETATM   84  H   UNL     1      -0.007   1.141  -0.032  1.00  0.00           H  
CONECT    1   18   15   16   16                                       
CONECT    2   17   17   16   44                                       
CONECT    3   18   18   17   45                                       
CONECT    4   39   28   30   46                                       
CONECT    5   20   21   21   47                                       
CONECT    6   22   22   21   48                                       
CONECT    7   20   20   22   49                                       
CONECT    8    9   33   10   50                                       
CONECT    9   11    8   51   52                                       
CONECT   10    8   20   53   54                                       
CONECT   11   36   12    9   55                                       
CONECT   12   34   15   11   56                                       
CONECT   13   34   14   37   37                                       
CONECT   14   35   13   24   57                                       
CONECT   15    1   12   58   59                                       
CONECT   16    1    1    2   60                                       
CONECT   17    3    2    2   61                                       
CONECT   18    3    3    1   62                                       
CONECT   19   33   39   38   38                                       
CONECT   20   10    7    7    5                                       
CONECT   21    5    5    6   63                                       
CONECT   22    7    6    6   64                                       
CONECT   23   41   41   40   35                                       
CONECT   24   26   14   25   65                                       
CONECT   25   26   24   66   67                                       
CONECT   26   25   24   68   69                                       
CONECT   27   40   70   71   72                                       
CONECT   28   42    4   73   74                                       
CONECT   29   42   43   30   75                                       
CONECT   30    4   29   32   76                                       
CONECT   31   43   32   77   78                                       
CONECT   32   31   30   79   80                                       
CONECT   33    8   19   81                                            
CONECT   34   12   13   82                                            
CONECT   35   23   14   83                                            
CONECT   36   11   84                                                 
CONECT   37   13   13                                                 
CONECT   38   19   19                                                 
CONECT   39   19    4                                                 
CONECT   40   27   23                                                 
CONECT   41   23   23                                                 
CONECT   42   28   29                                                 
CONECT   43   31   29                                                 
CONECT   44    2                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   10                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   14                                                      
CONECT   58   15                                                      
CONECT   59   15                                                      
CONECT   60   16                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   21                                                      
CONECT   64   22                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   26                                                      
CONECT   70   27                                                      
CONECT   71   27                                                      
CONECT   72   27                                                      
CONECT   73   28                                                      
CONECT   74   28                                                      
CONECT   75   29                                                      
CONECT   76   30                                                      
CONECT   77   31                                                      
CONECT   78   31                                                      
CONECT   79   32                                                      
CONECT   80   32                                                      
CONECT   81   33                                                      
CONECT   82   34                                                      
CONECT   83   35                                                      
CONECT   84   36                                                      
MASTER        0    0    0    0    0    0    0    0   84    0   84    0
END
