COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.511  -3.090  -5.355  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.135  -2.650  -4.047  1.00  0.00           C  
HETATM    3  C   UNL     1       0.040  -1.159  -3.685  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.916  -0.168  -4.375  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.475   1.305  -4.268  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.366   1.995  -2.879  1.00  0.00           C  
HETATM    7  C   UNL     1       0.622   1.262  -1.909  1.00  0.00           C  
HETATM    8  C   UNL     1       0.970   2.083  -0.626  1.00  0.00           C  
HETATM    9  O   UNL     1       2.418   2.025  -0.475  1.00  0.00           O  
HETATM   10  C   UNL     1       3.275   2.988  -0.902  1.00  0.00           C  
HETATM   11  O   UNL     1       4.382   2.686  -1.341  1.00  0.00           O  
HETATM   12  C   UNL     1       2.782   4.419  -0.841  1.00  0.00           C  
HETATM   13  C   UNL     1       3.807   5.396  -0.254  1.00  0.00           C  
HETATM   14  C   UNL     1       4.328   6.469  -1.222  1.00  0.00           C  
HETATM   15  C   UNL     1       5.841   6.495  -1.469  1.00  0.00           C  
HETATM   16  C   UNL     1       6.331   5.579  -2.596  1.00  0.00           C  
HETATM   17  C   UNL     1       7.205   6.222  -3.671  1.00  0.00           C  
HETATM   18  C   UNL     1       8.583   5.592  -3.791  1.00  0.00           C  
HETATM   19  C   UNL     1       0.321   1.353   0.557  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.908   2.020   0.901  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.845   3.085   1.742  1.00  0.00           C  
HETATM   22  O   UNL     1       0.157   3.588   2.226  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.225   3.555   2.005  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.091   3.837   0.815  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.642   3.749   3.269  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.903   3.471   4.539  1.00  0.00           C  
HETATM   27  C   UNL     1       0.000   0.000   0.000  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.489  -1.072   0.917  1.00  0.00           C  
HETATM   29  C   UNL     1       0.166  -0.059  -1.333  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.172  -1.244  -2.177  1.00  0.00           C  
HETATM   31  O   UNL     1       0.589  -2.408  -1.811  1.00  0.00           O  
HETATM   32  C   UNL     1       0.512  -3.314  -2.841  1.00  0.00           C  
HETATM   33  O   UNL     1       0.903  -4.469  -2.774  1.00  0.00           O  
HETATM   34  C   UNL     1      -1.736   2.251  -2.233  1.00  0.00           C  
HETATM   35  O   UNL     1       0.295   3.297  -3.113  1.00  0.00           O  
HETATM   36  C   UNL     1       0.587   3.782  -4.350  1.00  0.00           C  
HETATM   37  O   UNL     1      -0.017   3.568  -5.391  1.00  0.00           O  
HETATM   38  C   UNL     1       1.803   4.655  -4.259  1.00  0.00           C  
HETATM   39  O   UNL     1      -2.256  -0.323  -3.860  1.00  0.00           O  
HETATM   40  C   UNL     1      -3.068  -1.258  -4.421  1.00  0.00           C  
HETATM   41  O   UNL     1      -3.043  -1.616  -5.593  1.00  0.00           O  
HETATM   42  C   UNL     1      -4.091  -1.777  -3.430  1.00  0.00           C  
HETATM   43  C   UNL     1      -4.688  -3.150  -3.758  1.00  0.00           C  
HETATM   44  C   UNL     1      -5.106  -3.917  -2.500  1.00  0.00           C  
HETATM   45  O   UNL     1       1.400  -0.806  -3.966  1.00  0.00           O  
HETATM   46  O   UNL     1      -1.498  -3.043  -4.033  1.00  0.00           O  
HETATM   47  C   UNL     1      -9.687  -3.465  -5.048  1.00  0.00           C  
HETATM   48  C   UNL     1      -9.927  -2.727  -3.724  1.00  0.00           C  
HETATM   49  C   UNL     1      -9.513  -1.262  -3.892  1.00  0.00           C  
HETATM   50  C   UNL     1     -11.403  -2.867  -3.341  1.00  0.00           C  
HETATM   51  O   UNL     1      -9.069  -3.397  -2.759  1.00  0.00           O  
HETATM   52  C   UNL     1      -9.018  -3.023  -1.448  1.00  0.00           C  
HETATM   53  O   UNL     1      -9.677  -2.123  -0.941  1.00  0.00           O  
HETATM   54  N   UNL     1      -8.103  -3.812  -0.783  1.00  0.00           N  
HETATM   55  C   UNL     1      -7.791  -3.675   0.629  1.00  0.00           C  
HETATM   56  C   UNL     1      -7.607  -5.031   1.311  1.00  0.00           C  
HETATM   57  C   UNL     1      -6.340  -5.096   2.169  1.00  0.00           C  
HETATM   58  C   UNL     1      -5.385  -6.224   1.762  1.00  0.00           C  
HETATM   59  C   UNL     1      -3.983  -5.783   1.326  1.00  0.00           C  
HETATM   60  C   UNL     1      -3.606  -6.259  -0.077  1.00  0.00           C  
HETATM   61  C   UNL     1      -3.372  -5.082  -1.027  1.00  0.00           C  
HETATM   62  C   UNL     1      -4.286  -5.183  -2.248  1.00  0.00           C  
HETATM   63  H   UNL     1       0.309  -4.149  -5.553  1.00  0.00           H  
HETATM   64  H   UNL     1       1.598  -2.963  -5.348  1.00  0.00           H  
HETATM   65  H   UNL     1       0.096  -2.531  -6.200  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.913  -0.415  -5.446  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.176   1.888  -4.879  1.00  0.00           H  
HETATM   68  H   UNL     1       0.488   1.423  -4.784  1.00  0.00           H  
HETATM   69  H   UNL     1       1.564   1.112  -2.453  1.00  0.00           H  
HETATM   70  H   UNL     1       0.653   3.126  -0.709  1.00  0.00           H  
HETATM   71  H   UNL     1       2.559   4.728  -1.869  1.00  0.00           H  
HETATM   72  H   UNL     1       1.864   4.482  -0.258  1.00  0.00           H  
HETATM   73  H   UNL     1       3.359   5.907   0.608  1.00  0.00           H  
HETATM   74  H   UNL     1       4.646   4.817   0.143  1.00  0.00           H  
HETATM   75  H   UNL     1       3.998   7.452  -0.866  1.00  0.00           H  
HETATM   76  H   UNL     1       3.834   6.327  -2.191  1.00  0.00           H  
HETATM   77  H   UNL     1       6.216   7.511  -1.607  1.00  0.00           H  
HETATM   78  H   UNL     1       6.321   6.132  -0.549  1.00  0.00           H  
HETATM   79  H   UNL     1       5.463   5.118  -3.082  1.00  0.00           H  
HETATM   80  H   UNL     1       6.895   4.754  -2.141  1.00  0.00           H  
HETATM   81  H   UNL     1       7.297   7.299  -3.497  1.00  0.00           H  
HETATM   82  H   UNL     1       6.693   6.115  -4.636  1.00  0.00           H  
HETATM   83  H   UNL     1       8.509   4.513  -3.957  1.00  0.00           H  
HETATM   84  H   UNL     1       9.124   6.029  -4.637  1.00  0.00           H  
HETATM   85  H   UNL     1       9.182   5.762  -2.893  1.00  0.00           H  
HETATM   86  H   UNL     1       1.004   1.280   1.411  1.00  0.00           H  
HETATM   87  H   UNL     1      -3.402   2.904   0.335  1.00  0.00           H  
HETATM   88  H   UNL     1      -2.550   4.441   0.079  1.00  0.00           H  
HETATM   89  H   UNL     1      -3.996   4.389   1.089  1.00  0.00           H  
HETATM   90  H   UNL     1      -3.652   4.128   3.417  1.00  0.00           H  
HETATM   91  H   UNL     1      -1.635   4.412   5.031  1.00  0.00           H  
HETATM   92  H   UNL     1      -2.548   2.904   5.218  1.00  0.00           H  
HETATM   93  H   UNL     1      -0.996   2.882   4.395  1.00  0.00           H  
HETATM   94  H   UNL     1      -0.708  -2.009   0.400  1.00  0.00           H  
HETATM   95  H   UNL     1      -1.410  -0.758   1.416  1.00  0.00           H  
HETATM   96  H   UNL     1       0.265  -1.284   1.682  1.00  0.00           H  
HETATM   97  H   UNL     1      -1.220  -1.491  -1.955  1.00  0.00           H  
HETATM   98  H   UNL     1      -1.677   3.048  -1.486  1.00  0.00           H  
HETATM   99  H   UNL     1      -2.141   1.361  -1.754  1.00  0.00           H  
HETATM  100  H   UNL     1      -2.475   2.579  -2.971  1.00  0.00           H  
HETATM  101  H   UNL     1       1.611   5.487  -3.578  1.00  0.00           H  
HETATM  102  H   UNL     1       2.033   5.061  -5.248  1.00  0.00           H  
HETATM  103  H   UNL     1       2.657   4.065  -3.916  1.00  0.00           H  
HETATM  104  H   UNL     1      -3.645  -1.760  -2.430  1.00  0.00           H  
HETATM  105  H   UNL     1      -4.913  -1.050  -3.439  1.00  0.00           H  
HETATM  106  H   UNL     1      -5.577  -2.995  -4.380  1.00  0.00           H  
HETATM  107  H   UNL     1      -3.983  -3.744  -4.349  1.00  0.00           H  
HETATM  108  H   UNL     1      -4.986  -3.276  -1.625  1.00  0.00           H  
HETATM  109  H   UNL     1      -6.171  -4.170  -2.556  1.00  0.00           H  
HETATM  110  H   UNL     1       1.489  -0.691  -4.928  1.00  0.00           H  
HETATM  111  H   UNL     1      -1.545  -3.995  -4.226  1.00  0.00           H  
HETATM  112  H   UNL     1      -9.916  -4.532  -4.948  1.00  0.00           H  
HETATM  113  H   UNL     1     -10.296  -3.054  -5.860  1.00  0.00           H  
HETATM  114  H   UNL     1      -8.634  -3.401  -5.341  1.00  0.00           H  
HETATM  115  H   UNL     1      -9.714  -0.676  -2.989  1.00  0.00           H  
HETATM  116  H   UNL     1      -8.437  -1.181  -4.084  1.00  0.00           H  
HETATM  117  H   UNL     1     -10.051  -0.787  -4.720  1.00  0.00           H  
HETATM  118  H   UNL     1     -11.653  -3.913  -3.133  1.00  0.00           H  
HETATM  119  H   UNL     1     -12.058  -2.504  -4.141  1.00  0.00           H  
HETATM  120  H   UNL     1     -11.646  -2.300  -2.437  1.00  0.00           H  
HETATM  121  H   UNL     1      -7.615  -4.528  -1.312  1.00  0.00           H  
HETATM  122  H   UNL     1      -6.899  -3.051   0.753  1.00  0.00           H  
HETATM  123  H   UNL     1      -8.638  -3.150   1.083  1.00  0.00           H  
HETATM  124  H   UNL     1      -8.477  -5.219   1.953  1.00  0.00           H  
HETATM  125  H   UNL     1      -7.591  -5.816   0.548  1.00  0.00           H  
HETATM  126  H   UNL     1      -5.808  -4.139   2.139  1.00  0.00           H  
HETATM  127  H   UNL     1      -6.626  -5.253   3.216  1.00  0.00           H  
HETATM  128  H   UNL     1      -5.289  -6.915   2.609  1.00  0.00           H  
HETATM  129  H   UNL     1      -5.838  -6.798   0.945  1.00  0.00           H  
HETATM  130  H   UNL     1      -3.944  -4.687   1.357  1.00  0.00           H  
HETATM  131  H   UNL     1      -3.240  -6.137   2.050  1.00  0.00           H  
HETATM  132  H   UNL     1      -4.400  -6.902  -0.476  1.00  0.00           H  
HETATM  133  H   UNL     1      -2.692  -6.862  -0.033  1.00  0.00           H  
HETATM  134  H   UNL     1      -2.324  -5.077  -1.352  1.00  0.00           H  
HETATM  135  H   UNL     1      -3.554  -4.141  -0.494  1.00  0.00           H  
HETATM  136  H   UNL     1      -3.672  -5.367  -3.138  1.00  0.00           H  
HETATM  137  H   UNL     1      -4.956  -6.045  -2.144  1.00  0.00           H  
CONECT    1    2   63   64   65                                       
CONECT    2    1    3   32   46                                       
CONECT    3    2    4   30   45                                       
CONECT    4    3    5   39   66                                       
CONECT    5    4    6   67   68                                       
CONECT    6    5    7   34   35                                       
CONECT    7    6    8   29   69                                       
CONECT    8    7    9   19   70                                       
CONECT    9    8   10                                                 
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   71   72                                       
CONECT   13   12   14   73   74                                       
CONECT   14   13   15   75   76                                       
CONECT   15   14   16   77   78                                       
CONECT   16   15   17   79   80                                       
CONECT   17   16   18   81   82                                       
CONECT   18   17   83   84   85                                       
CONECT   19    8   20   27   86                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   22   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   24   25   25                                       
CONECT   24   23   87   88   89                                       
CONECT   25   23   23   26   90                                       
CONECT   26   25   91   92   93                                       
CONECT   27   19   28   29   29                                       
CONECT   28   27   94   95   96                                       
CONECT   29    7   27   27   30                                       
CONECT   30    3   29   31   97                                       
CONECT   31   30   32                                                 
CONECT   32    2   31   33   33                                       
CONECT   33   32   32                                                 
CONECT   34    6   98   99  100                                       
CONECT   35    6   36                                                 
CONECT   36   35   37   37   38                                       
CONECT   37   36   36                                                 
CONECT   38   36  101  102  103                                       
CONECT   39    4   40                                                 
CONECT   40   39   41   41   42                                       
CONECT   41   40   40                                                 
CONECT   42   40   43  104  105                                       
CONECT   43   42   44  106  107                                       
CONECT   44   43   62  108  109                                       
CONECT   45    3  110                                                 
CONECT   46    2  111                                                 
CONECT   47   48  112  113  114                                       
CONECT   48   47   49   50   51                                       
CONECT   49   48  115  116  117                                       
CONECT   50   48  118  119  120                                       
CONECT   51   48   52                                                 
CONECT   52   51   53   53   54                                       
CONECT   53   52   52                                                 
CONECT   54   52   55  121                                            
CONECT   55   54   56  122  123                                       
CONECT   56   55   57  124  125                                       
CONECT   57   56   58  126  127                                       
CONECT   58   57   59  128  129                                       
CONECT   59   58   60  130  131                                       
CONECT   60   59   61  132  133                                       
CONECT   61   60   62  134  135                                       
CONECT   62   44   61  136  137                                       
CONECT   63    1                                                      
CONECT   64    1                                                      
CONECT   65    1                                                      
CONECT   66    4                                                      
CONECT   67    5                                                      
CONECT   68    5                                                      
CONECT   69    7                                                      
CONECT   70    8                                                      
CONECT   71   12                                                      
CONECT   72   12                                                      
CONECT   73   13                                                      
CONECT   74   13                                                      
CONECT   75   14                                                      
CONECT   76   14                                                      
CONECT   77   15                                                      
CONECT   78   15                                                      
CONECT   79   16                                                      
CONECT   80   16                                                      
CONECT   81   17                                                      
CONECT   82   17                                                      
CONECT   83   18                                                      
CONECT   84   18                                                      
CONECT   85   18                                                      
CONECT   86   19                                                      
CONECT   87   24                                                      
CONECT   88   24                                                      
CONECT   89   24                                                      
CONECT   90   25                                                      
CONECT   91   26                                                      
CONECT   92   26                                                      
CONECT   93   26                                                      
CONECT   94   28                                                      
CONECT   95   28                                                      
CONECT   96   28                                                      
CONECT   97   30                                                      
CONECT   98   34                                                      
CONECT   99   34                                                      
CONECT  100   34                                                      
CONECT  101   38                                                      
CONECT  102   38                                                      
CONECT  103   38                                                      
CONECT  104   42                                                      
CONECT  105   42                                                      
CONECT  106   43                                                      
CONECT  107   43                                                      
CONECT  108   44                                                      
CONECT  109   44                                                      
CONECT  110   45                                                      
CONECT  111   46                                                      
CONECT  112   47                                                      
CONECT  113   47                                                      
CONECT  114   47                                                      
CONECT  115   49                                                      
CONECT  116   49                                                      
CONECT  117   49                                                      
CONECT  118   50                                                      
CONECT  119   50                                                      
CONECT  120   50                                                      
CONECT  121   54                                                      
CONECT  122   55                                                      
CONECT  123   55                                                      
CONECT  124   56                                                      
CONECT  125   56                                                      
CONECT  126   57                                                      
CONECT  127   57                                                      
CONECT  128   58                                                      
CONECT  129   58                                                      
CONECT  130   59                                                      
CONECT  131   59                                                      
CONECT  132   60                                                      
CONECT  133   60                                                      
CONECT  134   61                                                      
CONECT  135   61                                                      
CONECT  136   62                                                      
CONECT  137   62                                                      
MASTER        0    0    0    0    0    0    0    0  137    0  137    0
END
