COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.579   1.035   0.146  1.00  0.00           N  
HETATM    2  N   UNL     1       1.636  -1.520  -1.056  1.00  0.00           N  
HETATM    3  C   UNL     1      -1.045  -3.080  -1.087  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.819   0.657   0.284  1.00  0.00           C  
HETATM    5  C   UNL     1       1.019   2.504  -0.270  1.00  0.00           C  
HETATM    6  C   UNL     1       2.959  -1.273  -0.825  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.315  -3.862  -1.378  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.620   1.787   0.915  1.00  0.00           C  
HETATM    9  C   UNL     1       1.950   3.285  -0.930  1.00  0.00           C  
HETATM   10  C   UNL     1       3.559  -2.442  -0.494  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.439  -2.947  -0.870  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.540   2.824   1.272  1.00  0.00           C  
HETATM   13  C   UNL     1       3.020   2.454  -1.273  1.00  0.00           C  
HETATM   14  C   UNL     1       2.597  -3.456  -0.578  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.734  -1.650  -0.507  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.313   2.280   0.552  1.00  0.00           C  
HETATM   17  C   UNL     1       2.739   1.206  -0.824  1.00  0.00           C  
HETATM   18  C   UNL     1       1.414  -2.868  -0.955  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.471  -2.704  -1.974  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.915   4.207   0.737  1.00  0.00           C  
HETATM   21  C   UNL     1       4.266   2.871  -2.013  1.00  0.00           C  
HETATM   22  C   UNL     1       5.004  -2.619  -0.106  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.664  -1.941  -1.396  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.029   4.803   1.601  1.00  0.00           C  
HETATM   25  C   UNL     1       5.329   3.320  -1.008  1.00  0.00           C  
HETATM   26  C   UNL     1       5.147  -2.466   1.410  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.753  -1.850  -2.435  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.461   6.125   1.021  1.00  0.00           C  
HETATM   29  C   UNL     1       6.574   3.737  -1.748  1.00  0.00           C  
HETATM   30  C   UNL     1       6.592  -2.643   1.799  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.315  -5.189  -0.617  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.342   1.301   2.173  1.00  0.00           C  
HETATM   33  C   UNL     1       1.832   4.759  -1.225  1.00  0.00           C  
HETATM   34  C   UNL     1       2.818  -4.921  -0.306  1.00  0.00           C  
HETATM   35  C   UNL     1       2.559  -5.206   1.151  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.100  -4.925   0.851  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.337   0.726   3.138  1.00  0.00           C  
HETATM   38  C   UNL     1       2.421   5.548  -0.084  1.00  0.00           C  
HETATM   39  C   UNL     1       0.175  -3.606  -1.194  1.00  0.00           C  
HETATM   40  C   UNL     1      -3.400  -0.567  -0.067  1.00  0.00           C  
HETATM   41  C   UNL     1      -0.200   3.008   0.350  1.00  0.00           C  
HETATM   42  C   UNL     1       3.676   0.040  -0.946  1.00  0.00           C  
HETATM   43  C   UNL     1      -2.460  -4.107  -2.882  1.00  0.00           C  
HETATM   44  C   UNL     1      -4.618   2.368  -0.090  1.00  0.00           C  
HETATM   45  N   UNL     1      -1.395  -1.809  -0.691  1.00  0.00           N  
HETATM   46  N   UNL     1       1.499   1.216  -0.258  1.00  0.00           N  
HETATM   47  O   UNL     1      -6.590  -2.345  -3.525  1.00  0.00           O  
HETATM   48  O   UNL     1      -5.433   6.834   1.617  1.00  0.00           O  
HETATM   49  O   UNL     1       7.646   4.172  -1.066  1.00  0.00           O  
HETATM   50  O   UNL     1       7.423  -2.869   0.951  1.00  0.00           O  
HETATM   51  O   UNL     1      -7.903  -1.219  -2.149  1.00  0.00           O  
HETATM   52  O   UNL     1      -3.933   6.548   0.020  1.00  0.00           O  
HETATM   53  O   UNL     1       6.608   3.681  -2.954  1.00  0.00           O  
HETATM   54  O   UNL     1       6.957  -2.551   3.087  1.00  0.00           O  
HETATM   55  O   UNL     1      -1.962  -5.953   1.704  1.00  0.00           O  
HETATM   56  O   UNL     1      -2.160   0.739   2.864  1.00  0.00           O  
HETATM   57  O   UNL     1       2.889   4.973   0.870  1.00  0.00           O  
HETATM   58  O   UNL     1       2.228  -4.311   1.892  1.00  0.00           O  
HETATM   59  O   UNL     1      -2.052  -3.790   1.261  1.00  0.00           O  
HETATM   60  O   UNL     1      -3.749   0.199   4.302  1.00  0.00           O  
HETATM   61  O   UNL     1       2.427   6.889  -0.128  1.00  0.00           O  
HETATM   62  O   UNL     1       2.695  -6.455   1.626  1.00  0.00           O  
HETATM   63  H   UNL     1      -4.017  -2.117  -2.773  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.809  -3.660  -2.372  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.042   4.859   0.770  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.263   4.117  -0.292  1.00  0.00           H  
HETATM   67  H   UNL     1       4.645   2.028  -2.590  1.00  0.00           H  
HETATM   68  H   UNL     1       4.030   3.695  -2.685  1.00  0.00           H  
HETATM   69  H   UNL     1       5.342  -3.612  -0.404  1.00  0.00           H  
HETATM   70  H   UNL     1       5.610  -1.864  -0.606  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.042  -2.467  -0.519  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.350  -0.937  -1.110  1.00  0.00           H  
HETATM   73  H   UNL     1      -4.878   4.120   1.621  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.660   4.954   2.615  1.00  0.00           H  
HETATM   75  H   UNL     1       4.950   4.164  -0.431  1.00  0.00           H  
HETATM   76  H   UNL     1       5.565   2.496  -0.336  1.00  0.00           H  
HETATM   77  H   UNL     1       4.810  -1.474   1.708  1.00  0.00           H  
HETATM   78  H   UNL     1       4.541  -3.222   1.910  1.00  0.00           H  
HETATM   79  H   UNL     1      -3.272  -5.689  -0.760  1.00  0.00           H  
HETATM   80  H   UNL     1      -1.513  -5.824  -0.993  1.00  0.00           H  
HETATM   81  H   UNL     1      -4.857   2.139   2.643  1.00  0.00           H  
HETATM   82  H   UNL     1      -5.067   0.534   1.903  1.00  0.00           H  
HETATM   83  H   UNL     1       2.371   4.990  -2.143  1.00  0.00           H  
HETATM   84  H   UNL     1       0.781   5.022  -1.344  1.00  0.00           H  
HETATM   85  H   UNL     1       2.137  -5.512  -0.918  1.00  0.00           H  
HETATM   86  H   UNL     1       3.848  -5.185  -0.550  1.00  0.00           H  
HETATM   87  H   UNL     1       0.250  -4.658  -1.480  1.00  0.00           H  
HETATM   88  H   UNL     1      -4.489  -0.652   0.023  1.00  0.00           H  
HETATM   89  H   UNL     1      -0.214   4.053   0.674  1.00  0.00           H  
HETATM   90  H   UNL     1       4.429   0.106  -0.161  1.00  0.00           H  
HETATM   91  H   UNL     1      -1.616  -4.698  -3.237  1.00  0.00           H  
HETATM   92  H   UNL     1      -3.388  -4.646  -3.074  1.00  0.00           H  
HETATM   93  H   UNL     1      -2.480  -3.151  -3.405  1.00  0.00           H  
HETATM   94  H   UNL     1      -5.359   1.611  -0.346  1.00  0.00           H  
HETATM   95  H   UNL     1      -5.117   3.231   0.352  1.00  0.00           H  
HETATM   96  H   UNL     1      -4.088   2.678  -0.990  1.00  0.00           H  
HETATM   97  H   UNL     1      -0.751  -1.096  -0.557  1.00  0.00           H  
HETATM   98  H   UNL     1       1.032   0.442   0.095  1.00  0.00           H  
HETATM   99  H   UNL     1      -5.676   7.676   1.208  1.00  0.00           H  
HETATM  100  H   UNL     1       8.421   4.428  -1.584  1.00  0.00           H  
HETATM  101  H   UNL     1      -8.571  -1.187  -2.847  1.00  0.00           H  
HETATM  102  H   UNL     1       7.895  -2.671   3.288  1.00  0.00           H  
HETATM  103  H   UNL     1      -1.826  -5.734   2.636  1.00  0.00           H  
HETATM  104  H   UNL     1      -3.068  -0.158   4.888  1.00  0.00           H  
HETATM  105  H   UNL     1       2.815   7.352   0.627  1.00  0.00           H  
HETATM  106  H   UNL     1       2.518  -6.588   2.567  1.00  0.00           H  
HETATM  107  H   UNL     1       0.964  -0.851  -1.258  1.00  0.00           H  
HETATM  108  H   UNL     1      -3.916  -3.381   0.008  1.00  0.00           H  
HETATM  109  H   UNL     1      -2.375   2.856   2.349  1.00  0.00           H  
HETATM  110  H   UNL     1       4.173   0.084  -1.915  1.00  0.00           H  
CONECT    1   16    4    4                                            
CONECT    2    6   18  107                                            
CONECT    3   45    7   39   39                                       
CONECT    4    8    1    1   40                                       
CONECT    5   41    9    9   46                                       
CONECT    6   42    2   10   10                                       
CONECT    7   31   11    3   43                                       
CONECT    8   12   44   32    4                                       
CONECT    9   33    5    5   13                                       
CONECT   10    6    6   22   14                                       
CONECT   11   15    7   19  108                                       
CONECT   12   20    8   16  109                                       
CONECT   13    9   17   17   21                                       
CONECT   14   18   18   10   34                                       
CONECT   15   40   40   45   11                                       
CONECT   16   12   41   41    1                                       
CONECT   17   46   13   13   42                                       
CONECT   18    2   39   14   14                                       
CONECT   19   11   23   63   64                                       
CONECT   20   24   12   65   66                                       
CONECT   21   13   25   67   68                                       
CONECT   22   10   26   69   70                                       
CONECT   23   19   27   71   72                                       
CONECT   24   28   20   73   74                                       
CONECT   25   21   29   75   76                                       
CONECT   26   22   30   77   78                                       
CONECT   27   23   47   47   51                                       
CONECT   28   52   52   48   24                                       
CONECT   29   25   53   53   49                                       
CONECT   30   50   50   26   54                                       
CONECT   31   36    7   79   80                                       
CONECT   32   37    8   81   82                                       
CONECT   33   38    9   83   84                                       
CONECT   34   14   35   85   86                                       
CONECT   35   34   58   58   62                                       
CONECT   36   59   59   31   55                                       
CONECT   37   56   56   60   32                                       
CONECT   38   57   57   61   33                                       
CONECT   39    3    3   18   87                                       
CONECT   40    4   15   15   88                                       
CONECT   41   16   16    5   89                                       
CONECT   42   17    6   90  110                                       
CONECT   43    7   91   92   93                                       
CONECT   44    8   94   95   96                                       
CONECT   45   15    3   97                                            
CONECT   46    5   17   98                                            
CONECT   47   27   27                                                 
CONECT   48   28   99                                                 
CONECT   49   29  100                                                 
CONECT   50   30   30                                                 
CONECT   51   27  101                                                 
CONECT   52   28   28                                                 
CONECT   53   29   29                                                 
CONECT   54   30  102                                                 
CONECT   55   36  103                                                 
CONECT   56   37   37                                                 
CONECT   57   38   38                                                 
CONECT   58   35   35                                                 
CONECT   59   36   36                                                 
CONECT   60   37  104                                                 
CONECT   61   38  105                                                 
CONECT   62   35  106                                                 
CONECT   63   19                                                      
CONECT   64   19                                                      
CONECT   65   20                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   21                                                      
CONECT   69   22                                                      
CONECT   70   22                                                      
CONECT   71   23                                                      
CONECT   72   23                                                      
CONECT   73   24                                                      
CONECT   74   24                                                      
CONECT   75   25                                                      
CONECT   76   25                                                      
CONECT   77   26                                                      
CONECT   78   26                                                      
CONECT   79   31                                                      
CONECT   80   31                                                      
CONECT   81   32                                                      
CONECT   82   32                                                      
CONECT   83   33                                                      
CONECT   84   33                                                      
CONECT   85   34                                                      
CONECT   86   34                                                      
CONECT   87   39                                                      
CONECT   88   40                                                      
CONECT   89   41                                                      
CONECT   90   42                                                      
CONECT   91   43                                                      
CONECT   92   43                                                      
CONECT   93   43                                                      
CONECT   94   44                                                      
CONECT   95   44                                                      
CONECT   96   44                                                      
CONECT   97   45                                                      
CONECT   98   46                                                      
CONECT   99   48                                                      
CONECT  100   49                                                      
CONECT  101   51                                                      
CONECT  102   54                                                      
CONECT  103   55                                                      
CONECT  104   60                                                      
CONECT  105   61                                                      
CONECT  106   62                                                      
CONECT  107    2                                                      
CONECT  108   11                                                      
CONECT  109   12                                                      
CONECT  110   42                                                      
MASTER        0    0    0    0    0    0    0    0  110    0  110    0
END
