COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK     1      -2.593   0.543  -0.011  1.00  0.00           C  
HETATM    2  C   UNK     1      -6.070   0.100   0.907  1.00  0.00           C  
HETATM    3  C   UNK     1      -4.645  -0.455   0.843  1.00  0.00           C  
HETATM    4  C   UNK     1     -10.453   0.331   0.896  1.00  0.00           C  
HETATM    5  C   UNK     1      -6.364   0.899  -0.341  1.00  0.00           C  
HETATM    6  C   UNK     1       6.659   0.007   0.207  1.00  0.00           C  
HETATM    7  C   UNK     1       8.052   0.197  -0.401  1.00  0.00           C  
HETATM    8  C   UNK     1      10.129  -0.578   0.648  1.00  0.00           C  
HETATM    9  C   UNK     1      11.834   0.942   1.339  1.00  0.00           C  
HETATM   10  C   UNK     1      12.120   2.444   1.357  1.00  0.00           C  
HETATM   11  C   UNK     1       8.470  -2.261  -0.008  1.00  0.00           C  
HETATM   12  C   UNK     1       7.061  -2.355   0.585  1.00  0.00           C  
HETATM   13  C   UNK     1       4.795  -1.532   0.355  1.00  0.00           C  
HETATM   14  C   UNK     1      12.912   0.227   0.522  1.00  0.00           C  
HETATM   15  C   UNK     1      11.842   0.405   2.772  1.00  0.00           C  
HETATM   16  O   UNK     1      10.534   0.702   0.740  1.00  0.00           O  
HETATM   17  O   UNK     1      10.843  -1.472   1.058  1.00  0.00           O  
HETATM   18  N   UNK     1       8.932  -0.869   0.101  1.00  0.00           N  
HETATM   19  N   UNK     1       6.194  -1.360  -0.061  1.00  0.00           N  
HETATM   20  C   UNK     1       3.907  -0.668  -0.503  1.00  0.00           C  
HETATM   21  O   UNK     1       4.391   0.023  -1.375  1.00  0.00           O  
HETATM   22  C   UNK     1       0.444   0.497  -0.384  1.00  0.00           C  
HETATM   23  O   UNK     1       0.258   0.027   0.719  1.00  0.00           O  
HETATM   24  C   UNK     1       1.711   0.178  -1.135  1.00  0.00           C  
HETATM   25  N   UNK     1       2.574  -0.662  -0.301  1.00  0.00           N  
HETATM   26  C   UNK     1       1.365  -0.569  -2.425  1.00  0.00           C  
HETATM   27  O   UNK     1       0.587  -1.727  -2.111  1.00  0.00           O  
HETATM   28  C   UNK     1       0.304  -2.559  -3.238  1.00  0.00           C  
HETATM   29  C   UNK     1      -0.616  -3.676  -2.818  1.00  0.00           C  
HETATM   30  C   UNK     1      -1.983  -3.473  -2.793  1.00  0.00           C  
HETATM   31  C   UNK     1      -2.827  -4.498  -2.408  1.00  0.00           C  
HETATM   32  C   UNK     1      -2.304  -5.726  -2.047  1.00  0.00           C  
HETATM   33  C   UNK     1      -0.937  -5.929  -2.072  1.00  0.00           C  
HETATM   34  C   UNK     1      -0.093  -4.906  -2.463  1.00  0.00           C  
HETATM   35  N   UNK     1      -0.483   1.304  -0.938  1.00  0.00           N  
HETATM   36  C   UNK     1      -1.655   1.714  -0.161  1.00  0.00           C  
HETATM   37  C   UNK     1      -2.374   2.853  -0.886  1.00  0.00           C  
HETATM   38  C   UNK     1      -1.480   4.065  -0.928  1.00  0.00           C  
HETATM   39  C   UNK     1      -0.612   4.247  -1.989  1.00  0.00           C  
HETATM   40  C   UNK     1       0.209   5.357  -2.029  1.00  0.00           C  
HETATM   41  C   UNK     1       0.162   6.291  -1.004  1.00  0.00           C  
HETATM   42  O   UNK     1       0.969   7.384  -1.041  1.00  0.00           O  
HETATM   43  C   UNK     1       0.867   8.303   0.048  1.00  0.00           C  
HETATM   44  C   UNK     1      -0.710   6.106   0.060  1.00  0.00           C  
HETATM   45  C   UNK     1      -1.533   4.997   0.093  1.00  0.00           C  
HETATM   46  O   UNK     1      -2.355  -0.501  -0.581  1.00  0.00           O  
HETATM   47  N   UNK     1      -3.692   0.655   0.760  1.00  0.00           N  
HETATM   48  C   UNK     1      -4.361  -1.278   2.101  1.00  0.00           C  
HETATM   49  C   UNK     1      -2.993  -1.950   1.973  1.00  0.00           C  
HETATM   50  C   UNK     1      -2.634  -2.632   3.295  1.00  0.00           C  
HETATM   51  C   UNK     1      -1.265  -3.303   3.167  1.00  0.00           C  
HETATM   52  C   UNK     1      -1.312  -4.348   2.050  1.00  0.00           C  
HETATM   53  C   UNK     1      -1.671  -3.667   0.729  1.00  0.00           C  
HETATM   54  C   UNK     1      -3.040  -2.995   0.857  1.00  0.00           C  
HETATM   55  O   UNK     1      -6.213   0.933   2.059  1.00  0.00           O  
HETATM   56  O   UNK     1      -7.010  -0.984   0.971  1.00  0.00           O  
HETATM   57  C   UNK     1      -8.256  -0.706   1.453  1.00  0.00           C  
HETATM   58  C   UNK     1      -9.081  -1.994   1.481  1.00  0.00           C  
HETATM   59  C   UNK     1      -8.981   0.338   0.576  1.00  0.00           C  
HETATM   60  O   UNK     1     -10.987   1.334   1.307  1.00  0.00           O  
HETATM   61  N   UNK     1      -8.432   1.650   0.851  1.00  0.00           N  
HETATM   62  C   UNK     1      -7.336   2.052  -0.061  1.00  0.00           C  
HETATM   63  C   UNK     1      -6.981  -0.027  -1.392  1.00  0.00           C  
HETATM   64  O   UNK     1      -5.141   1.433  -0.851  1.00  0.00           O  
HETATM   65  H   UNK     1      -4.541  -1.089  -0.037  1.00  0.00           H  
HETATM   66  H   UNK     1     -11.032  -0.570   0.758  1.00  0.00           H  
HETATM   67  H   UNK     1       6.707   0.170   1.284  1.00  0.00           H  
HETATM   68  H   UNK     1       5.967   0.721  -0.238  1.00  0.00           H  
HETATM   69  H   UNK     1       7.989   0.137  -1.488  1.00  0.00           H  
HETATM   70  H   UNK     1       8.449   1.170  -0.111  1.00  0.00           H  
HETATM   71  H   UNK     1      11.352   2.954   1.939  1.00  0.00           H  
HETATM   72  H   UNK     1      13.096   2.624   1.807  1.00  0.00           H  
HETATM   73  H   UNK     1      12.115   2.827   0.336  1.00  0.00           H  
HETATM   74  H   UNK     1       9.144  -2.915   0.545  1.00  0.00           H  
HETATM   75  H   UNK     1       8.450  -2.559  -1.057  1.00  0.00           H  
HETATM   76  H   UNK     1       6.659  -3.354   0.413  1.00  0.00           H  
HETATM   77  H   UNK     1       7.103  -2.159   1.656  1.00  0.00           H  
HETATM   78  H   UNK     1       4.507  -2.576   0.239  1.00  0.00           H  
HETATM   79  H   UNK     1       4.688  -1.239   1.399  1.00  0.00           H  
HETATM   80  H   UNK     1      12.907   0.610  -0.499  1.00  0.00           H  
HETATM   81  H   UNK     1      13.889   0.406   0.972  1.00  0.00           H  
HETATM   82  H   UNK     1      12.709  -0.844   0.510  1.00  0.00           H  
HETATM   83  H   UNK     1      11.638  -0.666   2.760  1.00  0.00           H  
HETATM   84  H   UNK     1      12.818   0.584   3.223  1.00  0.00           H  
HETATM   85  H   UNK     1      11.074   0.914   3.355  1.00  0.00           H  
HETATM   86  H   UNK     1       2.231   1.104  -1.380  1.00  0.00           H  
HETATM   87  H   UNK     1       2.187  -1.214   0.396  1.00  0.00           H  
HETATM   88  H   UNK     1       0.792   0.086  -3.082  1.00  0.00           H  
HETATM   89  H   UNK     1       2.283  -0.873  -2.926  1.00  0.00           H  
HETATM   90  H   UNK     1      -0.176  -1.966  -4.016  1.00  0.00           H  
HETATM   91  H   UNK     1       1.234  -2.979  -3.622  1.00  0.00           H  
HETATM   92  H   UNK     1      -2.392  -2.514  -3.075  1.00  0.00           H  
HETATM   93  H   UNK     1      -3.895  -4.339  -2.388  1.00  0.00           H  
HETATM   94  H   UNK     1      -2.963  -6.526  -1.745  1.00  0.00           H  
HETATM   95  H   UNK     1      -0.528  -6.888  -1.789  1.00  0.00           H  
HETATM   96  H   UNK     1       0.975  -5.064  -2.482  1.00  0.00           H  
HETATM   97  H   UNK     1      -0.373   1.613  -1.851  1.00  0.00           H  
HETATM   98  H   UNK     1      -1.338   2.053   0.825  1.00  0.00           H  
HETATM   99  H   UNK     1      -2.614   2.543  -1.903  1.00  0.00           H  
HETATM  100  H   UNK     1      -3.294   3.098  -0.355  1.00  0.00           H  
HETATM  101  H   UNK     1      -0.576   3.520  -2.786  1.00  0.00           H  
HETATM  102  H   UNK     1       0.887   5.498  -2.857  1.00  0.00           H  
HETATM  103  H   UNK     1       1.562   9.127  -0.106  1.00  0.00           H  
HETATM  104  H   UNK     1      -0.150   8.691   0.102  1.00  0.00           H  
HETATM  105  H   UNK     1       1.110   7.791   0.979  1.00  0.00           H  
HETATM  106  H   UNK     1      -0.751   6.834   0.857  1.00  0.00           H  
HETATM  107  H   UNK     1      -2.212   4.854   0.920  1.00  0.00           H  
HETATM  108  H   UNK     1      -3.853   1.470   1.261  1.00  0.00           H  
HETATM  109  H   UNK     1      -4.364  -0.623   2.972  1.00  0.00           H  
HETATM  110  H   UNK     1      -5.131  -2.041   2.217  1.00  0.00           H  
HETATM  111  H   UNK     1      -2.240  -1.198   1.735  1.00  0.00           H  
HETATM  112  H   UNK     1      -2.600  -1.887   4.090  1.00  0.00           H  
HETATM  113  H   UNK     1      -3.386  -3.383   3.533  1.00  0.00           H  
HETATM  114  H   UNK     1      -0.512  -2.552   2.929  1.00  0.00           H  
HETATM  115  H   UNK     1      -1.009  -3.789   4.109  1.00  0.00           H  
HETATM  116  H   UNK     1      -0.337  -4.827   1.959  1.00  0.00           H  
HETATM  117  H   UNK     1      -2.065  -5.100   2.288  1.00  0.00           H  
HETATM  118  H   UNK     1      -0.919  -2.915   0.491  1.00  0.00           H  
HETATM  119  H   UNK     1      -1.705  -4.411  -0.067  1.00  0.00           H  
HETATM  120  H   UNK     1      -3.793  -3.747   1.094  1.00  0.00           H  
HETATM  121  H   UNK     1      -3.296  -2.509  -0.085  1.00  0.00           H  
HETATM  122  H   UNK     1      -5.993   0.493   2.892  1.00  0.00           H  
HETATM  123  H   UNK     1      -8.167  -0.319   2.468  1.00  0.00           H  
HETATM  124  H   UNK     1      -8.593  -2.724   2.126  1.00  0.00           H  
HETATM  125  H   UNK     1     -10.078  -1.779   1.866  1.00  0.00           H  
HETATM  126  H   UNK     1      -9.160  -2.397   0.472  1.00  0.00           H  
HETATM  127  H   UNK     1      -8.835   0.094  -0.476  1.00  0.00           H  
HETATM  128  H   UNK     1      -8.146   1.727   1.816  1.00  0.00           H  
HETATM  129  H   UNK     1      -6.785   2.877   0.391  1.00  0.00           H  
HETATM  130  H   UNK     1      -7.766   2.389  -1.004  1.00  0.00           H  
HETATM  131  H   UNK     1      -6.188  -0.571  -1.906  1.00  0.00           H  
HETATM  132  H   UNK     1      -7.650  -0.736  -0.904  1.00  0.00           H  
HETATM  133  H   UNK     1      -7.543   0.566  -2.113  1.00  0.00           H  
HETATM  134  H   UNK     1      -5.248   1.961  -1.655  1.00  0.00           H  
CONECT    1   36   46   46   47                                       
CONECT    2    3    5   55   56                                       
CONECT    3   47   48    2   65                                       
CONECT    4   59   60   60   66                                       
CONECT    5   63   64    2   62                                       
CONECT    6   19    7   67   68                                       
CONECT    7   18    6   69   70                                       
CONECT    8   16   18   17   17                                       
CONECT    9   15   16   14   10                                       
CONECT   10    9   71   72   73                                       
CONECT   11   12   18   74   75                                       
CONECT   12   11   19   76   77                                       
CONECT   13   19   20   78   79                                       
CONECT   14    9   80   81   82                                       
CONECT   15    9   83   84   85                                       
CONECT   16    9    8                                                 
CONECT   17    8    8                                                 
CONECT   18   11    8    7                                            
CONECT   19   12   13    6                                            
CONECT   20   13   25   21   21                                       
CONECT   21   20   20                                                 
CONECT   22   24   23   23   35                                       
CONECT   23   22   22                                                 
CONECT   24   25   26   22   86                                       
CONECT   25   20   24   87                                            
CONECT   26   27   24   88   89                                       
CONECT   27   28   26                                                 
CONECT   28   29   27   90   91                                       
CONECT   29   30   30   34   28                                       
CONECT   30   31   29   29   92                                       
CONECT   31   32   32   30   93                                       
CONECT   32   31   31   33   94                                       
CONECT   33   32   34   34   95                                       
CONECT   34   33   33   29   96                                       
CONECT   35   22   36   97                                            
CONECT   36   35   37    1   98                                       
CONECT   37   38   36   99  100                                       
CONECT   38   45   37   39   39                                       
CONECT   39   38   38   40  101                                       
CONECT   40   41   41   39  102                                       
CONECT   41   44   42   40   40                                       
CONECT   42   43   41                                                 
CONECT   43   42  103  104  105                                       
CONECT   44   45   45   41  106                                       
CONECT   45   44   44   38  107                                       
CONECT   46    1    1                                                 
CONECT   47    1    3  108                                            
CONECT   48   49    3  109  110                                       
CONECT   49   54   50   48  111                                       
CONECT   50   49   51  112  113                                       
CONECT   51   52   50  114  115                                       
CONECT   52   53   51  116  117                                       
CONECT   53   54   52  118  119                                       
CONECT   54   53   49  120  121                                       
CONECT   55    2  122                                                 
CONECT   56    2   57                                                 
CONECT   57   56   59   58  123                                       
CONECT   58   57  124  125  126                                       
CONECT   59   61   57    4  127                                       
CONECT   60    4    4                                                 
CONECT   61   62   59  128                                            
CONECT   62    5   61  129  130                                       
CONECT   63    5  131  132  133                                       
CONECT   64    5  134                                                 
CONECT   65    3                                                      
CONECT   66    4                                                      
CONECT   67    6                                                      
CONECT   68    6                                                      
CONECT   69    7                                                      
CONECT   70    7                                                      
CONECT   71   10                                                      
CONECT   72   10                                                      
CONECT   73   10                                                      
CONECT   74   11                                                      
CONECT   75   11                                                      
CONECT   76   12                                                      
CONECT   77   12                                                      
CONECT   78   13                                                      
CONECT   79   13                                                      
CONECT   80   14                                                      
CONECT   81   14                                                      
CONECT   82   14                                                      
CONECT   83   15                                                      
CONECT   84   15                                                      
CONECT   85   15                                                      
CONECT   86   24                                                      
CONECT   87   25                                                      
CONECT   88   26                                                      
CONECT   89   26                                                      
CONECT   90   28                                                      
CONECT   91   28                                                      
CONECT   92   30                                                      
CONECT   93   31                                                      
CONECT   94   32                                                      
CONECT   95   33                                                      
CONECT   96   34                                                      
CONECT   97   35                                                      
CONECT   98   36                                                      
CONECT   99   37                                                      
CONECT  100   37                                                      
CONECT  101   39                                                      
CONECT  102   40                                                      
CONECT  103   43                                                      
CONECT  104   43                                                      
CONECT  105   43                                                      
CONECT  106   44                                                      
CONECT  107   45                                                      
CONECT  108   47                                                      
CONECT  109   48                                                      
CONECT  110   48                                                      
CONECT  111   49                                                      
CONECT  112   50                                                      
CONECT  113   50                                                      
CONECT  114   51                                                      
CONECT  115   51                                                      
CONECT  116   52                                                      
CONECT  117   52                                                      
CONECT  118   53                                                      
CONECT  119   53                                                      
CONECT  120   54                                                      
CONECT  121   54                                                      
CONECT  122   55                                                      
CONECT  123   57                                                      
CONECT  124   58                                                      
CONECT  125   58                                                      
CONECT  126   58                                                      
CONECT  127   59                                                      
CONECT  128   61                                                      
CONECT  129   62                                                      
CONECT  130   62                                                      
CONECT  131   63                                                      
CONECT  132   63                                                      
CONECT  133   63                                                      
CONECT  134   64                                                      
MASTER        0    0    0    0    0    0    0    0  134    0  134    0
END
