COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.853   0.045   0.245  1.00  0.00           C  
HETATM    2  C   UNL     1       1.267  -1.078   1.198  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.247   0.887   0.896  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.457   0.000   1.196  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.043  -1.123   2.149  1.00  0.00           C  
HETATM    6  C   UNL     1       0.057  -1.964   1.498  1.00  0.00           C  
HETATM    7  C   UNL     1       1.952   1.480  -1.329  1.00  0.00           C  
HETATM    8  C   UNL     1       3.562   3.240  -0.592  1.00  0.00           C  
HETATM    9  C   UNL     1       3.307   2.132  -1.619  1.00  0.00           C  
HETATM   10  C   UNL     1       2.409   4.246  -0.645  1.00  0.00           C  
HETATM   11  C   UNL     1       1.089   3.513  -0.393  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.543   1.147   0.914  1.00  0.00           C  
HETATM   13  C   UNL     1       2.614   5.316   0.429  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.428   2.216   1.570  1.00  0.00           C  
HETATM   15  C   UNL     1       3.182  -2.577   1.345  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.517   2.615   0.568  1.00  0.00           C  
HETATM   17  C   UNL     1       4.265  -3.406   0.704  1.00  0.00           C  
HETATM   18  C   UNL     1       5.969   3.206  -0.327  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.544   0.207   0.032  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.127   1.376  -0.029  1.00  0.00           C  
HETATM   21  C   UNL     1       3.630  -4.548  -0.092  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.234  -0.970  -0.607  1.00  0.00           C  
HETATM   23  C   UNL     1       4.721  -5.314  -0.843  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.070  -2.610  -2.380  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.201  -3.091  -3.544  1.00  0.00           C  
HETATM   26  N   UNL     1       2.320  -1.884   0.575  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.205  -1.974   2.437  1.00  0.00           N  
HETATM   28  N   UNL     1       4.824   3.921  -0.908  1.00  0.00           N  
HETATM   29  N   UNL     1      -5.047   1.670   2.785  1.00  0.00           N  
HETATM   30  N   UNL     1      -5.426  -1.460  -1.732  1.00  0.00           N  
HETATM   31  N   UNL     1       4.111  -6.411  -1.607  1.00  0.00           N  
HETATM   32  O   UNL     1       1.983   0.873  -0.036  1.00  0.00           O  
HETATM   33  O   UNL     1      -2.484   0.786   1.804  1.00  0.00           O  
HETATM   34  O   UNL     1       0.928   2.476  -1.363  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.634   1.935   0.005  1.00  0.00           O  
HETATM   36  O   UNL     1       4.339   1.149  -1.528  1.00  0.00           O  
HETATM   37  O   UNL     1       2.373   4.863  -1.934  1.00  0.00           O  
HETATM   38  O   UNL     1      -4.353   0.002   0.637  1.00  0.00           O  
HETATM   39  O   UNL     1       3.086  -2.535   2.553  1.00  0.00           O  
HETATM   40  O   UNL     1       5.114  -3.947   1.719  1.00  0.00           O  
HETATM   41  O   UNL     1      -3.960  -3.588  -3.039  1.00  0.00           O  
HETATM   42  H   UNL     1       0.479  -0.386  -0.684  1.00  0.00           H  
HETATM   43  H   UNL     1       1.641  -0.647   2.127  1.00  0.00           H  
HETATM   44  H   UNL     1       0.127   1.318   1.824  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.831  -0.431   0.267  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.669  -0.692   3.078  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.317  -2.396   0.570  1.00  0.00           H  
HETATM   48  H   UNL     1       0.352  -2.764   2.178  1.00  0.00           H  
HETATM   49  H   UNL     1       1.746   0.720  -2.082  1.00  0.00           H  
HETATM   50  H   UNL     1       3.622   2.805   0.406  1.00  0.00           H  
HETATM   51  H   UNL     1       3.297   2.560  -2.621  1.00  0.00           H  
HETATM   52  H   UNL     1       1.101   3.076   0.606  1.00  0.00           H  
HETATM   53  H   UNL     1       0.261   4.217  -0.472  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.125   1.535  -0.015  1.00  0.00           H  
HETATM   55  H   UNL     1       1.792   6.031   0.391  1.00  0.00           H  
HETATM   56  H   UNL     1       2.641   4.845   1.411  1.00  0.00           H  
HETATM   57  H   UNL     1       3.556   5.836   0.249  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.825   3.088   1.824  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.289   3.190   1.080  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.078   3.221  -0.224  1.00  0.00           H  
HETATM   61  H   UNL     1       4.854  -2.780   0.034  1.00  0.00           H  
HETATM   62  H   UNL     1       6.890   3.732  -0.576  1.00  0.00           H  
HETATM   63  H   UNL     1       5.857   3.161   0.757  1.00  0.00           H  
HETATM   64  H   UNL     1       6.007   2.194  -0.730  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.082   1.454  -0.525  1.00  0.00           H  
HETATM   66  H   UNL     1       3.115  -5.224   0.590  1.00  0.00           H  
HETATM   67  H   UNL     1       2.915  -4.139  -0.806  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.353  -1.765   0.129  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.215  -0.662  -0.971  1.00  0.00           H  
HETATM   70  H   UNL     1       5.236  -4.638  -1.525  1.00  0.00           H  
HETATM   71  H   UNL     1       5.435  -5.723  -0.128  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.049  -2.314  -2.756  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.187  -3.417  -1.657  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.719  -3.886  -4.080  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.010  -2.260  -4.223  1.00  0.00           H  
HETATM   76  H   UNL     1       2.397  -1.918  -0.391  1.00  0.00           H  
HETATM   77  H   UNL     1      -1.957  -2.724   3.066  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.969  -1.429   2.808  1.00  0.00           H  
HETATM   79  H   UNL     1       4.936   4.032  -1.905  1.00  0.00           H  
HETATM   80  H   UNL     1      -5.634   2.358   3.232  1.00  0.00           H  
HETATM   81  H   UNL     1      -5.566   0.830   2.580  1.00  0.00           H  
HETATM   82  H   UNL     1      -4.491  -1.690  -1.431  1.00  0.00           H  
HETATM   83  H   UNL     1       4.811  -6.932  -2.113  1.00  0.00           H  
HETATM   84  H   UNL     1       3.573  -7.016  -1.005  1.00  0.00           H  
HETATM   85  H   UNL     1      -1.315   2.522   0.361  1.00  0.00           H  
HETATM   86  H   UNL     1       4.238   0.414  -2.148  1.00  0.00           H  
HETATM   87  H   UNL     1       1.665   5.514  -2.039  1.00  0.00           H  
HETATM   88  H   UNL     1       4.656  -4.517   2.352  1.00  0.00           H  
HETATM   89  H   UNL     1      -3.358  -3.910  -3.723  1.00  0.00           H  
CONECT    1    3    2   32   42                                       
CONECT    2    6    1   26   43                                       
CONECT    3    4   35    1   44                                       
CONECT    4   33    5    3   45                                       
CONECT    5   27    4    6   46                                       
CONECT    6    5    2   47   48                                       
CONECT    7   34   32    9   49                                       
CONECT    8   10    9   28   50                                       
CONECT    9    7    8   36   51                                       
CONECT   10   11   13   37    8                                       
CONECT   11   34   10   52   53                                       
CONECT   12   14   38   33   54                                       
CONECT   13   10   55   56   57                                       
CONECT   14   16   29   12   58                                       
CONECT   15   26   39   39   17                                       
CONECT   16   20   14   59   60                                       
CONECT   17   15   40   21   61                                       
CONECT   18   28   62   63   64                                       
CONECT   19   20   20   22   38                                       
CONECT   20   16   19   19   65                                       
CONECT   21   17   23   66   67                                       
CONECT   22   30   19   68   69                                       
CONECT   23   21   31   70   71                                       
CONECT   24   25   30   72   73                                       
CONECT   25   24   41   74   75                                       
CONECT   26    2   15   76                                            
CONECT   27    5   77   78                                            
CONECT   28    8   18   79                                            
CONECT   29   14   80   81                                            
CONECT   30   24   22   82                                            
CONECT   31   23   83   84                                            
CONECT   32    1    7                                                 
CONECT   33   12    4                                                 
CONECT   34   11    7                                                 
CONECT   35    3   85                                                 
CONECT   36    9   86                                                 
CONECT   37   10   87                                                 
CONECT   38   19   12                                                 
CONECT   39   15   15                                                 
CONECT   40   17   88                                                 
CONECT   41   25   89                                                 
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   11                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   13                                                      
CONECT   57   13                                                      
CONECT   58   14                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   18                                                      
CONECT   65   20                                                      
CONECT   66   21                                                      
CONECT   67   21                                                      
CONECT   68   22                                                      
CONECT   69   22                                                      
CONECT   70   23                                                      
CONECT   71   23                                                      
CONECT   72   24                                                      
CONECT   73   24                                                      
CONECT   74   25                                                      
CONECT   75   25                                                      
CONECT   76   26                                                      
CONECT   77   27                                                      
CONECT   78   27                                                      
CONECT   79   28                                                      
CONECT   80   29                                                      
CONECT   81   29                                                      
CONECT   82   30                                                      
CONECT   83   31                                                      
CONECT   84   31                                                      
CONECT   85   35                                                      
CONECT   86   36                                                      
CONECT   87   37                                                      
CONECT   88   40                                                      
CONECT   89   41                                                      
MASTER        0    0    0    0    0    0    0    0   89    0   89    0
END
