COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.207  -5.147   3.422  1.00  0.00           O  
HETATM    2  C   UNL     1       6.306  -4.535   2.377  1.00  0.00           C  
HETATM    3  C   UNL     1       5.636  -4.980   1.138  1.00  0.00           C  
HETATM    4  C   UNL     1       5.544  -4.156   0.104  1.00  0.00           C  
HETATM    5  C   UNL     1       6.107  -2.767   0.121  1.00  0.00           C  
HETATM    6  O   UNL     1       7.326  -2.747  -0.625  1.00  0.00           O  
HETATM    7  C   UNL     1       4.853  -4.645  -1.147  1.00  0.00           C  
HETATM    8  C   UNL     1       3.573  -3.842  -1.379  1.00  0.00           C  
HETATM    9  O   UNL     1       2.478  -4.489  -0.727  1.00  0.00           O  
HETATM   10  C   UNL     1       1.627  -3.456  -0.226  1.00  0.00           C  
HETATM   11  C   UNL     1       3.295  -3.758  -2.885  1.00  0.00           C  
HETATM   12  C   UNL     1       1.810  -3.729  -3.127  1.00  0.00           C  
HETATM   13  C   UNL     1       0.961  -4.913  -2.742  1.00  0.00           C  
HETATM   14  C   UNL     1       1.242  -2.652  -3.674  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.199  -2.618  -3.920  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.799  -1.452  -4.258  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.029  -0.267  -4.352  1.00  0.00           C  
HETATM   18  O   UNL     1       1.178  -0.323  -4.210  1.00  0.00           O  
HETATM   19  O   UNL     1      -0.614   0.924  -4.597  1.00  0.00           O  
HETATM   20  O   UNL     1       7.045  -3.391   2.271  1.00  0.00           O  
HETATM   21  C   UNL     1       6.387  -2.304   1.546  1.00  0.00           C  
HETATM   22  C   UNL     1       7.310  -1.081   1.524  1.00  0.00           C  
HETATM   23  C   UNL     1       8.641  -1.432   2.190  1.00  0.00           C  
HETATM   24  C   UNL     1       6.645   0.066   2.285  1.00  0.00           C  
HETATM   25  O   UNL     1       7.388   0.340   3.474  1.00  0.00           O  
HETATM   26  C   UNL     1       6.860  -0.508   4.496  1.00  0.00           C  
HETATM   27  C   UNL     1       6.611   1.318   1.406  1.00  0.00           C  
HETATM   28  C   UNL     1       6.034   2.488   2.211  1.00  0.00           C  
HETATM   29  O   UNL     1       4.967   2.018   3.037  1.00  0.00           O  
HETATM   30  C   UNL     1       5.274   2.417   4.374  1.00  0.00           C  
HETATM   31  C   UNL     1       5.513   3.536   1.264  1.00  0.00           C  
HETATM   32  C   UNL     1       4.572   4.363   1.648  1.00  0.00           C  
HETATM   33  C   UNL     1       4.054   5.411   0.695  1.00  0.00           C  
HETATM   34  C   UNL     1       4.407   6.803   1.223  1.00  0.00           C  
HETATM   35  C   UNL     1       2.534   5.279   0.579  1.00  0.00           C  
HETATM   36  O   UNL     1       1.908   6.160   1.513  1.00  0.00           O  
HETATM   37  C   UNL     1       2.094   5.646  -0.840  1.00  0.00           C  
HETATM   38  C   UNL     1       0.595   5.377  -0.994  1.00  0.00           C  
HETATM   39  O   UNL     1      -0.100   6.618  -1.131  1.00  0.00           O  
HETATM   40  C   UNL     1      -1.403   6.424  -0.578  1.00  0.00           C  
HETATM   41  C   UNL     1       0.360   4.531  -2.219  1.00  0.00           C  
HETATM   42  C   UNL     1      -0.799   3.948  -2.402  1.00  0.00           C  
HETATM   43  C   UNL     1      -1.038   3.106  -3.629  1.00  0.00           C  
HETATM   44  C   UNL     1      -2.542   2.907  -3.825  1.00  0.00           C  
HETATM   45  C   UNL     1      -0.362   1.746  -3.455  1.00  0.00           C  
HETATM   46  C   UNL     1      -0.919   1.062  -2.205  1.00  0.00           C  
HETATM   47  C   UNL     1      -0.872   2.036  -1.026  1.00  0.00           C  
HETATM   48  C   UNL     1      -2.368   0.638  -2.458  1.00  0.00           C  
HETATM   49  O   UNL     1      -2.394  -0.411  -3.428  1.00  0.00           O  
HETATM   50  C   UNL     1      -3.194   0.055  -4.518  1.00  0.00           C  
HETATM   51  C   UNL     1      -2.989   0.140  -1.152  1.00  0.00           C  
HETATM   52  C   UNL     1      -3.145   1.313  -0.181  1.00  0.00           C  
HETATM   53  C   UNL     1      -4.362  -0.470  -1.440  1.00  0.00           C  
HETATM   54  C   UNL     1      -4.929  -1.081  -0.156  1.00  0.00           C  
HETATM   55  C   UNL     1      -6.330  -1.574  -0.411  1.00  0.00           C  
HETATM   56  O   UNL     1      -6.791  -1.534  -1.526  1.00  0.00           O  
HETATM   57  C   UNL     1      -7.155  -2.118   0.727  1.00  0.00           C  
HETATM   58  C   UNL     1      -6.828  -3.599   0.931  1.00  0.00           C  
HETATM   59  C   UNL     1      -8.641  -1.965   0.397  1.00  0.00           C  
HETATM   60  O   UNL     1      -8.947  -0.583   0.206  1.00  0.00           O  
HETATM   61  C   UNL     1      -9.947  -0.518  -0.813  1.00  0.00           C  
HETATM   62  C   UNL     1      -9.479  -2.518   1.552  1.00  0.00           C  
HETATM   63  C   UNL     1      -9.213  -1.711   2.797  1.00  0.00           C  
HETATM   64  C   UNL     1     -10.216  -1.168   3.458  1.00  0.00           C  
HETATM   65  N   UNL     1      -9.970  -0.423   4.608  1.00  0.00           N  
HETATM   66  C   UNL     1      -8.596  -0.242   5.084  1.00  0.00           C  
HETATM   67  C   UNL     1     -10.996   0.131   5.284  1.00  0.00           C  
HETATM   68  O   UNL     1     -10.781   0.781   6.286  1.00  0.00           O  
HETATM   69  H   UNL     1       5.223  -5.975   1.075  1.00  0.00           H  
HETATM   70  H   UNL     1       5.393  -2.086  -0.343  1.00  0.00           H  
HETATM   71  H   UNL     1       7.107  -3.020  -1.526  1.00  0.00           H  
HETATM   72  H   UNL     1       4.603  -5.700  -1.033  1.00  0.00           H  
HETATM   73  H   UNL     1       5.519  -4.522  -2.001  1.00  0.00           H  
HETATM   74  H   UNL     1       3.695  -2.837  -0.975  1.00  0.00           H  
HETATM   75  H   UNL     1       2.151  -2.897   0.549  1.00  0.00           H  
HETATM   76  H   UNL     1       1.356  -2.782  -1.039  1.00  0.00           H  
HETATM   77  H   UNL     1       0.724  -3.900   0.194  1.00  0.00           H  
HETATM   78  H   UNL     1       3.746  -2.850  -3.286  1.00  0.00           H  
HETATM   79  H   UNL     1       3.726  -4.627  -3.382  1.00  0.00           H  
HETATM   80  H   UNL     1       0.612  -4.792  -1.716  1.00  0.00           H  
HETATM   81  H   UNL     1       0.103  -4.978  -3.412  1.00  0.00           H  
HETATM   82  H   UNL     1       1.553  -5.825  -2.819  1.00  0.00           H  
HETATM   83  H   UNL     1       1.853  -1.800  -3.938  1.00  0.00           H  
HETATM   84  H   UNL     1      -0.782  -3.524  -3.839  1.00  0.00           H  
HETATM   85  H   UNL     1      -1.858  -1.436  -4.465  1.00  0.00           H  
HETATM   86  H   UNL     1       5.455  -2.041   2.046  1.00  0.00           H  
HETATM   87  H   UNL     1       7.488  -0.778   0.492  1.00  0.00           H  
HETATM   88  H   UNL     1       8.462  -1.736   3.222  1.00  0.00           H  
HETATM   89  H   UNL     1       9.115  -2.250   1.647  1.00  0.00           H  
HETATM   90  H   UNL     1       9.295  -0.560   2.177  1.00  0.00           H  
HETATM   91  H   UNL     1       5.627  -0.218   2.551  1.00  0.00           H  
HETATM   92  H   UNL     1       5.786  -0.342   4.586  1.00  0.00           H  
HETATM   93  H   UNL     1       7.046  -1.550   4.236  1.00  0.00           H  
HETATM   94  H   UNL     1       7.344  -0.278   5.445  1.00  0.00           H  
HETATM   95  H   UNL     1       5.984   1.133   0.534  1.00  0.00           H  
HETATM   96  H   UNL     1       7.622   1.563   1.083  1.00  0.00           H  
HETATM   97  H   UNL     1       6.816   2.919   2.836  1.00  0.00           H  
HETATM   98  H   UNL     1       6.246   2.013   4.660  1.00  0.00           H  
HETATM   99  H   UNL     1       5.302   3.505   4.432  1.00  0.00           H  
HETATM  100  H   UNL     1       4.510   2.037   5.052  1.00  0.00           H  
HETATM  101  H   UNL     1       5.914   3.604   0.263  1.00  0.00           H  
HETATM  102  H   UNL     1       4.163   4.293   2.645  1.00  0.00           H  
HETATM  103  H   UNL     1       4.507   5.267  -0.286  1.00  0.00           H  
HETATM  104  H   UNL     1       3.954   6.945   2.204  1.00  0.00           H  
HETATM  105  H   UNL     1       5.490   6.896   1.305  1.00  0.00           H  
HETATM  106  H   UNL     1       4.029   7.559   0.535  1.00  0.00           H  
HETATM  107  H   UNL     1       2.241   4.252   0.795  1.00  0.00           H  
HETATM  108  H   UNL     1       0.953   6.045   1.409  1.00  0.00           H  
HETATM  109  H   UNL     1       2.648   5.042  -1.559  1.00  0.00           H  
HETATM  110  H   UNL     1       2.295   6.702  -1.021  1.00  0.00           H  
HETATM  111  H   UNL     1       0.228   4.850  -0.113  1.00  0.00           H  
HETATM  112  H   UNL     1      -1.974   7.349  -0.660  1.00  0.00           H  
HETATM  113  H   UNL     1      -1.915   5.632  -1.123  1.00  0.00           H  
HETATM  114  H   UNL     1      -1.315   6.144   0.472  1.00  0.00           H  
HETATM  115  H   UNL     1       1.149   4.406  -2.946  1.00  0.00           H  
HETATM  116  H   UNL     1      -1.584   4.071  -1.670  1.00  0.00           H  
HETATM  117  H   UNL     1      -0.621   3.609  -4.502  1.00  0.00           H  
HETATM  118  H   UNL     1      -3.042   2.936  -2.857  1.00  0.00           H  
HETATM  119  H   UNL     1      -2.934   3.701  -4.461  1.00  0.00           H  
HETATM  120  H   UNL     1      -2.722   1.941  -4.298  1.00  0.00           H  
HETATM  121  H   UNL     1       0.712   1.888  -3.341  1.00  0.00           H  
HETATM  122  H   UNL     1      -0.318   0.182  -1.974  1.00  0.00           H  
HETATM  123  H   UNL     1      -1.727   2.709  -1.076  1.00  0.00           H  
HETATM  124  H   UNL     1      -0.903   1.477  -0.091  1.00  0.00           H  
HETATM  125  H   UNL     1       0.050   2.616  -1.072  1.00  0.00           H  
HETATM  126  H   UNL     1      -2.936   1.491  -2.829  1.00  0.00           H  
HETATM  127  H   UNL     1      -2.549   0.307  -5.360  1.00  0.00           H  
HETATM  128  H   UNL     1      -3.892  -0.727  -4.816  1.00  0.00           H  
HETATM  129  H   UNL     1      -3.749   0.940  -4.208  1.00  0.00           H  
HETATM  130  H   UNL     1      -2.342  -0.616  -0.707  1.00  0.00           H  
HETATM  131  H   UNL     1      -3.901   1.068   0.565  1.00  0.00           H  
HETATM  132  H   UNL     1      -2.193   1.503   0.314  1.00  0.00           H  
HETATM  133  H   UNL     1      -3.452   2.202  -0.732  1.00  0.00           H  
HETATM  134  H   UNL     1      -5.036   0.307  -1.801  1.00  0.00           H  
HETATM  135  H   UNL     1      -4.263  -1.246  -2.199  1.00  0.00           H  
HETATM  136  H   UNL     1      -4.301  -1.915   0.157  1.00  0.00           H  
HETATM  137  H   UNL     1      -4.947  -0.325   0.629  1.00  0.00           H  
HETATM  138  H   UNL     1      -6.926  -1.566   1.638  1.00  0.00           H  
HETATM  139  H   UNL     1      -7.056  -4.151   0.020  1.00  0.00           H  
HETATM  140  H   UNL     1      -5.769  -3.708   1.166  1.00  0.00           H  
HETATM  141  H   UNL     1      -7.425  -3.992   1.754  1.00  0.00           H  
HETATM  142  H   UNL     1      -8.870  -2.517  -0.514  1.00  0.00           H  
HETATM  143  H   UNL     1     -10.277   0.514  -0.932  1.00  0.00           H  
HETATM  144  H   UNL     1      -9.531  -0.877  -1.754  1.00  0.00           H  
HETATM  145  H   UNL     1     -10.795  -1.140  -0.529  1.00  0.00           H  
HETATM  146  H   UNL     1     -10.537  -2.453   1.297  1.00  0.00           H  
HETATM  147  H   UNL     1      -9.211  -3.559   1.730  1.00  0.00           H  
HETATM  148  H   UNL     1      -8.200  -1.578   3.147  1.00  0.00           H  
HETATM  149  H   UNL     1     -11.229  -1.302   3.108  1.00  0.00           H  
HETATM  150  H   UNL     1      -8.602   0.365   5.989  1.00  0.00           H  
HETATM  151  H   UNL     1      -8.156  -1.215   5.301  1.00  0.00           H  
HETATM  152  H   UNL     1      -8.009   0.259   4.314  1.00  0.00           H  
HETATM  153  H   UNL     1     -12.009  -0.002   4.934  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   20                                       
CONECT    3    2    4    4   69                                       
CONECT    4    3    3    5    7                                       
CONECT    5    4    6   21   70                                       
CONECT    6    5   71                                                 
CONECT    7    4    8   72   73                                       
CONECT    8    7    9   11   74                                       
CONECT    9    8   10                                                 
CONECT   10    9   75   76   77                                       
CONECT   11    8   12   78   79                                       
CONECT   12   11   13   14   14                                       
CONECT   13   12   80   81   82                                       
CONECT   14   12   12   15   83                                       
CONECT   15   14   16   16   84                                       
CONECT   16   15   15   17   85                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   45                                                 
CONECT   20    2   21                                                 
CONECT   21    5   20   22   86                                       
CONECT   22   21   23   24   87                                       
CONECT   23   22   88   89   90                                       
CONECT   24   22   25   27   91                                       
CONECT   25   24   26                                                 
CONECT   26   25   92   93   94                                       
CONECT   27   24   28   95   96                                       
CONECT   28   27   29   31   97                                       
CONECT   29   28   30                                                 
CONECT   30   29   98   99  100                                       
CONECT   31   28   32   32  101                                       
CONECT   32   31   31   33  102                                       
CONECT   33   32   34   35  103                                       
CONECT   34   33  104  105  106                                       
CONECT   35   33   36   37  107                                       
CONECT   36   35  108                                                 
CONECT   37   35   38  109  110                                       
CONECT   38   37   39   41  111                                       
CONECT   39   38   40                                                 
CONECT   40   39  112  113  114                                       
CONECT   41   38   42   42  115                                       
CONECT   42   41   41   43  116                                       
CONECT   43   42   44   45  117                                       
CONECT   44   43  118  119  120                                       
CONECT   45   19   43   46  121                                       
CONECT   46   45   47   48  122                                       
CONECT   47   46  123  124  125                                       
CONECT   48   46   49   51  126                                       
CONECT   49   48   50                                                 
CONECT   50   49  127  128  129                                       
CONECT   51   48   52   53  130                                       
CONECT   52   51  131  132  133                                       
CONECT   53   51   54  134  135                                       
CONECT   54   53   55  136  137                                       
CONECT   55   54   56   56   57                                       
CONECT   56   55   55                                                 
CONECT   57   55   58   59  138                                       
CONECT   58   57  139  140  141                                       
CONECT   59   57   60   62  142                                       
CONECT   60   59   61                                                 
CONECT   61   60  143  144  145                                       
CONECT   62   59   63  146  147                                       
CONECT   63   62   64   64  148                                       
CONECT   64   63   63   65  149                                       
CONECT   65   64   66   67                                            
CONECT   66   65  150  151  152                                       
CONECT   67   65   68   68  153                                       
CONECT   68   67   67                                                 
CONECT   69    3                                                      
CONECT   70    5                                                      
CONECT   71    6                                                      
CONECT   72    7                                                      
CONECT   73    7                                                      
CONECT   74    8                                                      
CONECT   75   10                                                      
CONECT   76   10                                                      
CONECT   77   10                                                      
CONECT   78   11                                                      
CONECT   79   11                                                      
CONECT   80   13                                                      
CONECT   81   13                                                      
CONECT   82   13                                                      
CONECT   83   14                                                      
CONECT   84   15                                                      
CONECT   85   16                                                      
CONECT   86   21                                                      
CONECT   87   22                                                      
CONECT   88   23                                                      
CONECT   89   23                                                      
CONECT   90   23                                                      
CONECT   91   24                                                      
CONECT   92   26                                                      
CONECT   93   26                                                      
CONECT   94   26                                                      
CONECT   95   27                                                      
CONECT   96   27                                                      
CONECT   97   28                                                      
CONECT   98   30                                                      
CONECT   99   30                                                      
CONECT  100   30                                                      
CONECT  101   31                                                      
CONECT  102   32                                                      
CONECT  103   33                                                      
CONECT  104   34                                                      
CONECT  105   34                                                      
CONECT  106   34                                                      
CONECT  107   35                                                      
CONECT  108   36                                                      
CONECT  109   37                                                      
CONECT  110   37                                                      
CONECT  111   38                                                      
CONECT  112   40                                                      
CONECT  113   40                                                      
CONECT  114   40                                                      
CONECT  115   41                                                      
CONECT  116   42                                                      
CONECT  117   43                                                      
CONECT  118   44                                                      
CONECT  119   44                                                      
CONECT  120   44                                                      
CONECT  121   45                                                      
CONECT  122   46                                                      
CONECT  123   47                                                      
CONECT  124   47                                                      
CONECT  125   47                                                      
CONECT  126   48                                                      
CONECT  127   50                                                      
CONECT  128   50                                                      
CONECT  129   50                                                      
CONECT  130   51                                                      
CONECT  131   52                                                      
CONECT  132   52                                                      
CONECT  133   52                                                      
CONECT  134   53                                                      
CONECT  135   53                                                      
CONECT  136   54                                                      
CONECT  137   54                                                      
CONECT  138   57                                                      
CONECT  139   58                                                      
CONECT  140   58                                                      
CONECT  141   58                                                      
CONECT  142   59                                                      
CONECT  143   61                                                      
CONECT  144   61                                                      
CONECT  145   61                                                      
CONECT  146   62                                                      
CONECT  147   62                                                      
CONECT  148   63                                                      
CONECT  149   64                                                      
CONECT  150   66                                                      
CONECT  151   66                                                      
CONECT  152   66                                                      
CONECT  153   67                                                      
MASTER        0    0    0    0    0    0    0    0  153    0  153    0
END
