COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.272  -4.249   1.201  1.00  0.00           C  
HETATM    2  C   UNL     1       6.489  -0.393   3.173  1.00  0.00           C  
HETATM    3  C   UNL     1       9.630  -5.941   0.084  1.00  0.00           C  
HETATM    4  C   UNL     1       8.477  -4.727   4.826  1.00  0.00           C  
HETATM    5  C   UNL     1      10.129  -2.938  -1.900  1.00  0.00           C  
HETATM    6  C   UNL     1       8.230  -3.755   2.649  1.00  0.00           C  
HETATM    7  C   UNL     1       7.172  -2.686   2.768  1.00  0.00           C  
HETATM    8  C   UNL     1       7.515  -1.445   3.089  1.00  0.00           C  
HETATM    9  C   UNL     1       9.080  -3.270   0.344  1.00  0.00           C  
HETATM   10  C   UNL     1       6.860   0.864   3.387  1.00  0.00           C  
HETATM   11  C   UNL     1       8.318   1.196   3.577  1.00  0.00           C  
HETATM   12  C   UNL     1       5.833   1.969   3.409  1.00  0.00           C  
HETATM   13  C   UNL     1       6.311   3.083   2.510  1.00  0.00           C  
HETATM   14  C   UNL     1       9.237  -3.855  -1.061  1.00  0.00           C  
HETATM   15  C   UNL     1       6.988   2.778   1.344  1.00  0.00           C  
HETATM   16  C   UNL     1       7.443   3.797   0.518  1.00  0.00           C  
HETATM   17  C   UNL     1       7.211   5.123   0.861  1.00  0.00           C  
HETATM   18  C   UNL     1       6.527   5.423   2.029  1.00  0.00           C  
HETATM   19  C   UNL     1       6.078   4.400   2.853  1.00  0.00           C  
HETATM   20  C   UNL     1       5.585   6.955   3.585  1.00  0.00           C  
HETATM   21  C   UNL     1      10.971  -3.782  -2.859  1.00  0.00           C  
HETATM   22  C   UNL     1       9.254  -1.972  -2.703  1.00  0.00           C  
HETATM   23  C   UNL     1       8.362   2.194  -0.974  1.00  0.00           C  
HETATM   24  C   UNL     1       8.631   4.563  -1.534  1.00  0.00           C  
HETATM   25  C   UNL     1       9.148   1.857  -2.215  1.00  0.00           C  
HETATM   26  C   UNL     1       8.611   0.563  -2.829  1.00  0.00           C  
HETATM   27  C   UNL     1       9.700  -0.510  -2.787  1.00  0.00           C  
HETATM   28  C   UNL     1      10.995  -0.117  -2.074  1.00  0.00           C  
HETATM   29  C   UNL     1       6.255   0.557  -2.469  1.00  0.00           C  
HETATM   30  C   UNL     1       5.012   0.130  -1.732  1.00  0.00           C  
HETATM   31  C   UNL     1       3.786   0.775  -2.383  1.00  0.00           C  
HETATM   32  C   UNL     1       2.524   0.341  -1.635  1.00  0.00           C  
HETATM   33  C   UNL     1       1.299   0.986  -2.286  1.00  0.00           C  
HETATM   34  C   UNL     1       0.056   0.559  -1.549  1.00  0.00           C  
HETATM   35  C   UNL     1      -0.879   1.370  -0.999  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.013   0.986   0.264  1.00  0.00           C  
HETATM   37  C   UNL     1      -4.242   0.340  -0.379  1.00  0.00           C  
HETATM   38  C   UNL     1      -5.502   0.790   0.363  1.00  0.00           C  
HETATM   39  C   UNL     1      -7.908   0.426   0.239  1.00  0.00           C  
HETATM   40  C   UNL     1      -9.095  -0.197  -0.382  1.00  0.00           C  
HETATM   41  C   UNL     1      -8.932  -1.052  -1.483  1.00  0.00           C  
HETATM   42  C   UNL     1     -10.002  -1.645  -2.083  1.00  0.00           C  
HETATM   43  C   UNL     1     -11.298  -1.409  -1.606  1.00  0.00           C  
HETATM   44  C   UNL     1     -11.484  -0.519  -0.456  1.00  0.00           C  
HETATM   45  C   UNL     1     -10.356   0.067   0.134  1.00  0.00           C  
HETATM   46  C   UNL     1     -12.821  -0.250   0.068  1.00  0.00           C  
HETATM   47  C   UNL     1     -13.546  -1.244   0.871  1.00  0.00           C  
HETATM   48  C   UNL     1     -14.832  -0.915   1.344  1.00  0.00           C  
HETATM   49  C   UNL     1     -14.767   1.231   0.343  1.00  0.00           C  
HETATM   50  C   UNL     1     -13.503   1.033  -0.178  1.00  0.00           C  
HETATM   51  C   UNL     1     -15.395   2.358   0.133  1.00  0.00           C  
HETATM   52  C   UNL     1     -14.748   3.454  -0.672  1.00  0.00           C  
HETATM   53  C   UNL     1     -13.458   3.254  -1.198  1.00  0.00           C  
HETATM   54  C   UNL     1     -12.835   2.066  -0.966  1.00  0.00           C  
HETATM   55  C   UNL     1     -12.982  -2.489   1.163  1.00  0.00           C  
HETATM   56  C   UNL     1     -13.683  -3.392   1.913  1.00  0.00           C  
HETATM   57  C   UNL     1     -14.955  -3.076   2.384  1.00  0.00           C  
HETATM   58  C   UNL     1     -15.527  -1.844   2.103  1.00  0.00           C  
HETATM   59  C   UNL     1     -12.453  -2.044  -2.248  1.00  0.00           C  
HETATM   60  N   UNL     1       8.144   3.493  -0.659  1.00  0.00           N  
HETATM   61  N   UNL     1      -1.807   0.555  -0.447  1.00  0.00           N  
HETATM   62  N   UNL     1       8.901  -5.569   1.146  1.00  0.00           N  
HETATM   63  N   UNL     1      -1.448  -0.664  -0.654  1.00  0.00           N  
HETATM   64  N   UNL     1      -0.345  -0.696  -1.314  1.00  0.00           N  
HETATM   65  N   UNL     1      -6.679   0.172  -0.252  1.00  0.00           N  
HETATM   66  O   UNL     1       9.833  -5.170  -0.986  1.00  0.00           O  
HETATM   67  O   UNL     1      10.136  -7.046   0.097  1.00  0.00           O  
HETATM   68  O   UNL     1       6.940  -4.336   0.691  1.00  0.00           O  
HETATM   69  O   UNL     1       6.296   6.719   2.368  1.00  0.00           O  
HETATM   70  O   UNL     1       7.929   1.311  -0.264  1.00  0.00           O  
HETATM   71  O   UNL     1       7.457   0.111  -2.072  1.00  0.00           O  
HETATM   72  O   UNL     1       9.799  -1.408  -3.896  1.00  0.00           O  
HETATM   73  O   UNL     1       6.170   1.300  -3.418  1.00  0.00           O  
HETATM   74  O   UNL     1      -8.040   1.168   1.193  1.00  0.00           O  
HETATM   75  O   UNL     1     -15.380   0.284   1.063  1.00  0.00           O  
HETATM   76  O   UNL     1     -15.334   4.501  -0.866  1.00  0.00           O  
HETATM   77  O   UNL     1     -15.641  -3.982   3.127  1.00  0.00           O  
HETATM   78  O   UNL     1     -13.575  -1.834  -1.827  1.00  0.00           O  
HETATM   79  O   UNL     1     -12.271  -2.862  -3.306  1.00  0.00           O  
HETATM   80  O   UNL     1       7.914  -4.844   3.518  1.00  0.00           O  
HETATM   81 CL   UNL     1       7.776   6.400  -0.170  1.00  0.00          Cl  
HETATM   82  H   UNL     1       5.445  -0.644   3.067  1.00  0.00           H  
HETATM   83  H   UNL     1       9.563  -4.680   4.751  1.00  0.00           H  
HETATM   84  H   UNL     1       8.106  -3.818   5.301  1.00  0.00           H  
HETATM   85  H   UNL     1       8.190  -5.592   5.424  1.00  0.00           H  
HETATM   86  H   UNL     1      10.787  -2.370  -1.241  1.00  0.00           H  
HETATM   87  H   UNL     1       9.200  -3.340   2.921  1.00  0.00           H  
HETATM   88  H   UNL     1       6.136  -2.934   2.591  1.00  0.00           H  
HETATM   89  H   UNL     1       8.548  -1.205   3.296  1.00  0.00           H  
HETATM   90  H   UNL     1       8.555  -2.316   0.286  1.00  0.00           H  
HETATM   91  H   UNL     1      10.063  -3.119   0.789  1.00  0.00           H  
HETATM   92  H   UNL     1       8.864   0.972   2.661  1.00  0.00           H  
HETATM   93  H   UNL     1       8.422   2.255   3.812  1.00  0.00           H  
HETATM   94  H   UNL     1       8.722   0.600   4.396  1.00  0.00           H  
HETATM   95  H   UNL     1       4.878   1.589   3.046  1.00  0.00           H  
HETATM   96  H   UNL     1       5.719   2.343   4.427  1.00  0.00           H  
HETATM   97  H   UNL     1       8.255  -3.928  -1.531  1.00  0.00           H  
HETATM   98  H   UNL     1       7.163   1.747   1.076  1.00  0.00           H  
HETATM   99  H   UNL     1       5.545   4.634   3.763  1.00  0.00           H  
HETATM  100  H   UNL     1       5.469   8.028   3.736  1.00  0.00           H  
HETATM  101  H   UNL     1       4.602   6.488   3.528  1.00  0.00           H  
HETATM  102  H   UNL     1       6.142   6.529   4.419  1.00  0.00           H  
HETATM  103  H   UNL     1      11.606  -3.128  -3.456  1.00  0.00           H  
HETATM  104  H   UNL     1      11.594  -4.469  -2.286  1.00  0.00           H  
HETATM  105  H   UNL     1      10.313  -4.349  -3.516  1.00  0.00           H  
HETATM  106  H   UNL     1       8.183  -2.176  -2.681  1.00  0.00           H  
HETATM  107  H   UNL     1       9.304   5.212  -0.973  1.00  0.00           H  
HETATM  108  H   UNL     1       9.167   4.127  -2.377  1.00  0.00           H  
HETATM  109  H   UNL     1       7.786   5.145  -1.901  1.00  0.00           H  
HETATM  110  H   UNL     1       9.050   2.668  -2.937  1.00  0.00           H  
HETATM  111  H   UNL     1      10.198   1.727  -1.956  1.00  0.00           H  
HETATM  112  H   UNL     1       8.319   0.744  -3.863  1.00  0.00           H  
HETATM  113  H   UNL     1      10.768   0.184  -1.051  1.00  0.00           H  
HETATM  114  H   UNL     1      11.674  -0.969  -2.059  1.00  0.00           H  
HETATM  115  H   UNL     1      11.463   0.713  -2.602  1.00  0.00           H  
HETATM  116  H   UNL     1       4.918  -0.955  -1.776  1.00  0.00           H  
HETATM  117  H   UNL     1       5.080   0.447  -0.692  1.00  0.00           H  
HETATM  118  H   UNL     1       3.880   1.860  -2.339  1.00  0.00           H  
HETATM  119  H   UNL     1       3.719   0.458  -3.424  1.00  0.00           H  
HETATM  120  H   UNL     1       2.430  -0.744  -1.679  1.00  0.00           H  
HETATM  121  H   UNL     1       2.592   0.658  -0.594  1.00  0.00           H  
HETATM  122  H   UNL     1       1.393   2.071  -2.242  1.00  0.00           H  
HETATM  123  H   UNL     1       1.231   0.669  -3.326  1.00  0.00           H  
HETATM  124  H   UNL     1      -0.882   2.450  -1.001  1.00  0.00           H  
HETATM  125  H   UNL     1      -3.101   2.071   0.207  1.00  0.00           H  
HETATM  126  H   UNL     1      -2.948   0.681   1.309  1.00  0.00           H  
HETATM  127  H   UNL     1      -4.308   0.645  -1.424  1.00  0.00           H  
HETATM  128  H   UNL     1      -4.155  -0.745  -0.322  1.00  0.00           H  
HETATM  129  H   UNL     1      -5.437   0.486   1.408  1.00  0.00           H  
HETATM  130  H   UNL     1      -5.590   1.875   0.306  1.00  0.00           H  
HETATM  131  H   UNL     1      -7.939  -1.243  -1.862  1.00  0.00           H  
HETATM  132  H   UNL     1      -9.851  -2.298  -2.929  1.00  0.00           H  
HETATM  133  H   UNL     1     -10.467   0.723   0.985  1.00  0.00           H  
HETATM  134  H   UNL     1     -16.339   2.115  -0.354  1.00  0.00           H  
HETATM  135  H   UNL     1     -15.641   2.777   1.108  1.00  0.00           H  
HETATM  136  H   UNL     1     -12.975   4.026  -1.779  1.00  0.00           H  
HETATM  137  H   UNL     1     -11.846   1.888  -1.363  1.00  0.00           H  
HETATM  138  H   UNL     1     -11.996  -2.737   0.799  1.00  0.00           H  
HETATM  139  H   UNL     1     -13.250  -4.355   2.140  1.00  0.00           H  
HETATM  140  H   UNL     1     -16.514  -1.610   2.474  1.00  0.00           H  
HETATM  141  H   UNL     1       8.789  -6.183   1.888  1.00  0.00           H  
HETATM  142  H   UNL     1      -6.574  -0.420  -1.014  1.00  0.00           H  
HETATM  143  H   UNL     1       6.370  -4.945   1.180  1.00  0.00           H  
HETATM  144  H   UNL     1     -15.484  -3.911   4.078  1.00  0.00           H  
HETATM  145  H   UNL     1     -13.091  -3.233  -3.661  1.00  0.00           H  
CONECT    1    6   68   62    9                                       
CONECT    2    8   10   10   82                                       
CONECT    3   62   67   67   66                                       
CONECT    4   80   83   84   85                                       
CONECT    5   14   22   21   86                                       
CONECT    6   80    7    1   87                                       
CONECT    7    6    8    8   88                                       
CONECT    8    7    7    2   89                                       
CONECT    9    1   14   90   91                                       
CONECT   10    2    2   12   11                                       
CONECT   11   10   92   93   94                                       
CONECT   12   10   13   95   96                                       
CONECT   13   12   19   19   15                                       
CONECT   14    9   66    5   97                                       
CONECT   15   13   16   16   98                                       
CONECT   16   15   15   17   60                                       
CONECT   17   18   18   16   81                                       
CONECT   18   19   69   17   17                                       
CONECT   19   13   13   18   99                                       
CONECT   20   69  100  101  102                                       
CONECT   21    5  103  104  105                                       
CONECT   22   27    5   72  106                                       
CONECT   23   60   25   70   70                                       
CONECT   24   60  107  108  109                                       
CONECT   25   26   23  110  111                                       
CONECT   26   71   27   25  112                                       
CONECT   27   28   26   22   72                                       
CONECT   28   27  113  114  115                                       
CONECT   29   30   71   73   73                                       
CONECT   30   31   29  116  117                                       
CONECT   31   32   30  118  119                                       
CONECT   32   33   31  120  121                                       
CONECT   33   32   34  122  123                                       
CONECT   34   64   35   35   33                                       
CONECT   35   61   34   34  124                                       
CONECT   36   61   37  125  126                                       
CONECT   37   36   38  127  128                                       
CONECT   38   65   37  129  130                                       
CONECT   39   74   74   65   40                                       
CONECT   40   39   41   41   45                                       
CONECT   41   40   40   42  131                                       
CONECT   42   41   43   43  132                                       
CONECT   43   42   42   44   59                                       
CONECT   44   45   45   43   46                                       
CONECT   45   40   44   44  133                                       
CONECT   46   44   50   50   47                                       
CONECT   47   46   55   55   48                                       
CONECT   48   47   75   58   58                                       
CONECT   49   50   51   51   75                                       
CONECT   50   54   46   46   49                                       
CONECT   51   52   49   49  134                                       
CONECT   51  135                                                      
CONECT   52   53   76   76   51                                       
CONECT   53   54   54   52  136                                       
CONECT   54   53   53   50  137                                       
CONECT   55   47   47   56  138                                       
CONECT   56   55   57   57  139                                       
CONECT   57   56   56   58   77                                       
CONECT   58   48   48   57  140                                       
CONECT   59   43   78   78   79                                       
CONECT   60   16   24   23                                            
CONECT   61   63   36   35                                            
CONECT   62    1    3  141                                            
CONECT   63   64   64   61                                            
CONECT   64   63   63   34                                            
CONECT   65   39   38  142                                            
CONECT   66    3   14                                                 
CONECT   67    3    3                                                 
CONECT   68    1  143                                                 
CONECT   69   18   20                                                 
CONECT   70   23   23                                                 
CONECT   71   29   26                                                 
CONECT   72   27   22                                                 
CONECT   73   29   29                                                 
CONECT   74   39   39                                                 
CONECT   75   49   48                                                 
CONECT   76   52   52                                                 
CONECT   77   57  144                                                 
CONECT   78   59   59                                                 
CONECT   79   59  145                                                 
CONECT   80    4    6                                                 
CONECT   81   17                                                      
CONECT   82    2                                                      
CONECT   83    4                                                      
CONECT   84    4                                                      
CONECT   85    4                                                      
CONECT   86    5                                                      
CONECT   87    6                                                      
CONECT   88    7                                                      
CONECT   89    8                                                      
CONECT   90    9                                                      
CONECT   91    9                                                      
CONECT   92   11                                                      
CONECT   93   11                                                      
CONECT   94   11                                                      
CONECT   95   12                                                      
CONECT   96   12                                                      
CONECT   97   14                                                      
CONECT   98   15                                                      
CONECT   99   19                                                      
CONECT  100   20                                                      
CONECT  101   20                                                      
CONECT  102   20                                                      
CONECT  103   21                                                      
CONECT  104   21                                                      
CONECT  105   21                                                      
CONECT  106   22                                                      
CONECT  107   24                                                      
CONECT  108   24                                                      
CONECT  109   24                                                      
CONECT  110   25                                                      
CONECT  111   25                                                      
CONECT  112   26                                                      
CONECT  113   28                                                      
CONECT  114   28                                                      
CONECT  115   28                                                      
CONECT  116   30                                                      
CONECT  117   30                                                      
CONECT  118   31                                                      
CONECT  119   31                                                      
CONECT  120   32                                                      
CONECT  121   32                                                      
CONECT  122   33                                                      
CONECT  123   33                                                      
CONECT  124   35                                                      
CONECT  125   36                                                      
CONECT  126   36                                                      
CONECT  127   37                                                      
CONECT  128   37                                                      
CONECT  129   38                                                      
CONECT  130   38                                                      
CONECT  131   41                                                      
CONECT  132   42                                                      
CONECT  133   45                                                      
CONECT  134   51                                                      
CONECT  135   51                                                      
CONECT  136   53                                                      
CONECT  137   54                                                      
CONECT  138   55                                                      
CONECT  139   56                                                      
CONECT  140   58                                                      
CONECT  141   62                                                      
CONECT  142   65                                                      
CONECT  143   68                                                      
CONECT  144   77                                                      
CONECT  145   79                                                      
MASTER        0    0    0    0    0    0    0    0  145    0  145    0
END
