COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.478  -3.201  -2.454  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.663   2.078   0.516  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.008   0.851   1.389  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.708   0.573   2.176  1.00  0.00           C  
HETATM    5  C   UNL     1       2.922   0.870  -0.284  1.00  0.00           C  
HETATM    6  O   UNL     1       0.693   1.775  -0.053  1.00  0.00           O  
HETATM    7  C   UNL     1       2.482   3.311  -0.583  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.195   2.396   0.878  1.00  0.00           C  
HETATM    9  O   UNL     1       2.541  -0.305   0.434  1.00  0.00           O  
HETATM   10  C   UNL     1       6.640   0.265  -0.211  1.00  0.00           C  
HETATM   11  C   UNL     1       1.474  -1.037  -0.172  1.00  0.00           C  
HETATM   12  C   UNL     1       2.074   2.053   0.187  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.034   0.119   3.600  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.745  -0.374   0.282  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.028  -1.724  -0.384  1.00  0.00           C  
HETATM   16  C   UNL     1       0.953  -2.088   0.812  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.515  -1.805  -0.742  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.877  -0.623  -1.647  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.522   0.683  -0.933  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.825   1.867  -1.854  1.00  0.00           C  
HETATM   21  C   UNL     1       2.076  -3.081   1.129  1.00  0.00           C  
HETATM   22  C   UNL     1       2.575  -3.704  -0.178  1.00  0.00           C  
HETATM   23  C   UNL     1       3.034  -2.591  -1.123  1.00  0.00           C  
HETATM   24  C   UNL     1       3.960   3.609  -0.326  1.00  0.00           C  
HETATM   25  C   UNL     1       4.808   2.426  -0.797  1.00  0.00           C  
HETATM   26  C   UNL     1       4.401   1.168  -0.028  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.485   3.121  -1.168  1.00  0.00           N  
HETATM   28  N   UNL     1      -0.180  -2.805   0.210  1.00  0.00           N  
HETATM   29  N   UNL     1      -3.686  -2.810   0.543  1.00  0.00           N  
HETATM   30  N   UNL     1       4.057  -2.153  -3.305  1.00  0.00           N  
HETATM   31  N   UNL     1       4.352   4.817  -1.065  1.00  0.00           N  
HETATM   32  N   UNL     1       5.215   0.032  -0.480  1.00  0.00           N  
HETATM   33  O   UNL     1       1.690   4.416  -0.143  1.00  0.00           O  
HETATM   34  O   UNL     1      -2.510   3.181   0.845  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.012   1.838   2.198  1.00  0.00           O  
HETATM   36  O   UNL     1       0.173  -0.244   4.273  1.00  0.00           O  
HETATM   37  O   UNL     1      -2.349  -0.268   0.568  1.00  0.00           O  
HETATM   38  O   UNL     1      -6.298  -1.751   0.452  1.00  0.00           O  
HETATM   39  O   UNL     1      -5.141  -0.715  -2.869  1.00  0.00           O  
HETATM   40  O   UNL     1      -4.132   0.681  -0.600  1.00  0.00           O  
HETATM   41  O   UNL     1       1.577  -4.108   1.989  1.00  0.00           O  
HETATM   42  O   UNL     1       3.671  -4.579   0.098  1.00  0.00           O  
HETATM   43  O   UNL     1       1.952  -1.686  -1.352  1.00  0.00           O  
HETATM   44  H   UNL     1       4.226  -3.973  -2.268  1.00  0.00           H  
HETATM   45  H   UNL     1       2.618  -3.644  -2.956  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.752   1.832  -0.542  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.825   1.086   2.072  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.110  -0.182   1.666  1.00  0.00           H  
HETATM   49  H   UNL     1       2.763   0.711  -1.351  1.00  0.00           H  
HETATM   50  H   UNL     1       2.323   3.152  -1.649  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.032   3.474   0.896  1.00  0.00           H  
HETATM   52  H   UNL     1       7.228  -0.544  -0.642  1.00  0.00           H  
HETATM   53  H   UNL     1       6.944   1.212  -0.657  1.00  0.00           H  
HETATM   54  H   UNL     1       6.805   0.301   0.866  1.00  0.00           H  
HETATM   55  H   UNL     1       0.667  -0.353  -0.434  1.00  0.00           H  
HETATM   56  H   UNL     1       2.233   2.212   1.253  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.519   0.934   4.139  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.702  -0.741   3.564  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.313  -0.300   1.209  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.429  -1.815  -1.291  1.00  0.00           H  
HETATM   61  H   UNL     1       0.628  -1.599   1.730  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.713  -2.740  -1.267  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.945  -0.644  -1.863  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.114   0.771  -0.021  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.234   1.779  -2.765  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.885   1.867  -2.107  1.00  0.00           H  
HETATM   67  H   UNL     1       2.896  -2.558   1.622  1.00  0.00           H  
HETATM   68  H   UNL     1       1.768  -4.268  -0.645  1.00  0.00           H  
HETATM   69  H   UNL     1       3.868  -2.053  -0.673  1.00  0.00           H  
HETATM   70  H   UNL     1       4.119   3.768   0.740  1.00  0.00           H  
HETATM   71  H   UNL     1       4.649   2.267  -1.864  1.00  0.00           H  
HETATM   72  H   UNL     1       5.861   2.638  -0.615  1.00  0.00           H  
HETATM   73  H   UNL     1       4.560   1.327   1.039  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.676   3.918  -1.756  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.973   3.195  -0.288  1.00  0.00           H  
HETATM   76  H   UNL     1      -0.932  -2.170  -0.013  1.00  0.00           H  
HETATM   77  H   UNL     1       0.112  -3.321  -0.607  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.709  -2.777   0.794  1.00  0.00           H  
HETATM   79  H   UNL     1      -4.271  -2.782   1.365  1.00  0.00           H  
HETATM   80  H   UNL     1       4.444  -2.546  -4.149  1.00  0.00           H  
HETATM   81  H   UNL     1       3.374  -1.442  -3.517  1.00  0.00           H  
HETATM   82  H   UNL     1       5.325   5.035  -0.912  1.00  0.00           H  
HETATM   83  H   UNL     1       4.154   4.719  -2.049  1.00  0.00           H  
HETATM   84  H   UNL     1       5.058  -0.158  -1.459  1.00  0.00           H  
HETATM   85  H   UNL     1       1.894   5.249  -0.589  1.00  0.00           H  
HETATM   86  H   UNL     1      -2.336   3.979   0.326  1.00  0.00           H  
HETATM   87  H   UNL     1       0.042  -0.542   5.183  1.00  0.00           H  
HETATM   88  H   UNL     1      -7.252  -1.798   0.299  1.00  0.00           H  
HETATM   89  H   UNL     1      -5.313  -1.522  -3.372  1.00  0.00           H  
HETATM   90  H   UNL     1       2.237  -4.772   2.231  1.00  0.00           H  
HETATM   91  H   UNL     1       3.452  -5.307   0.696  1.00  0.00           H  
CONECT    1   30   23   44   45                                       
CONECT    2    8    3   34   46                                       
CONECT    3    4    2   37   47                                       
CONECT    4   35   13    3   48                                       
CONECT    5   26    9   12   49                                       
CONECT    6   12    8                                                 
CONECT    7   24   12   33   50                                       
CONECT    8    6   35    2   51                                       
CONECT    9    5   11                                                 
CONECT   10   32   52   53   54                                       
CONECT   11   43    9   16   55                                       
CONECT   12    5    7    6   56                                       
CONECT   13   36    4   57   58                                       
CONECT   14   15   37   40   59                                       
CONECT   15   29   17   14   60                                       
CONECT   16   21   11   28   61                                       
CONECT   17   15   38   18   62                                       
CONECT   18   17   39   19   63                                       
CONECT   19   20   18   40   64                                       
CONECT   20   27   19   65   66                                       
CONECT   21   22   41   16   67                                       
CONECT   22   42   23   21   68                                       
CONECT   23    1   22   43   69                                       
CONECT   24   25   31    7   70                                       
CONECT   25   26   24   71   72                                       
CONECT   26   32   25    5   73                                       
CONECT   27   20   74   75                                            
CONECT   28   16   76   77                                            
CONECT   29   15   78   79                                            
CONECT   30    1   80   81                                            
CONECT   31   24   82   83                                            
CONECT   32   10   26   84                                            
CONECT   33    7   85                                                 
CONECT   34    2   86                                                 
CONECT   35    8    4                                                 
CONECT   36   13   87                                                 
CONECT   37    3   14                                                 
CONECT   38   17   88                                                 
CONECT   39   18   89                                                 
CONECT   40   14   19                                                 
CONECT   41   21   90                                                 
CONECT   42   22   91                                                 
CONECT   43   23   11                                                 
CONECT   44    1                                                      
CONECT   45    1                                                      
CONECT   46    2                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    7                                                      
CONECT   51    8                                                      
CONECT   52   10                                                      
CONECT   53   10                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   13                                                      
CONECT   58   13                                                      
CONECT   59   14                                                      
CONECT   60   15                                                      
CONECT   61   16                                                      
CONECT   62   17                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   20                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   22                                                      
CONECT   69   23                                                      
CONECT   70   24                                                      
CONECT   71   25                                                      
CONECT   72   25                                                      
CONECT   73   26                                                      
CONECT   74   27                                                      
CONECT   75   27                                                      
CONECT   76   28                                                      
CONECT   77   28                                                      
CONECT   78   29                                                      
CONECT   79   29                                                      
CONECT   80   30                                                      
CONECT   81   30                                                      
CONECT   82   31                                                      
CONECT   83   31                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   34                                                      
CONECT   87   36                                                      
CONECT   88   38                                                      
CONECT   89   39                                                      
CONECT   90   41                                                      
CONECT   91   42                                                      
MASTER        0    0    0    0    0    0    0    0   91    0   91    0
END
