COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.487  -2.461   2.157  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.214  -2.768   0.819  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.779  -2.031  -0.203  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.168   1.050  -3.001  1.00  0.00           C  
HETATM    5  C   UNL     1      -9.420   1.193  -3.902  1.00  0.00           C  
HETATM    6  C   UNL     1     -10.577   0.826  -2.939  1.00  0.00           C  
HETATM    7  C   UNL     1      -8.002   0.774  -0.524  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.625   1.587  -1.629  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.236   3.036  -1.487  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.306   3.411  -0.535  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.945   4.739  -0.407  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.514   5.693  -1.232  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.445   5.317  -2.184  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.805   3.988  -2.311  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.250  -3.384  -0.335  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.443  -4.603  -0.795  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.090  -5.742   1.363  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.872  -4.478   1.738  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.969   1.884   3.322  1.00  0.00           C  
HETATM   20  C   UNL     1      -9.135   2.051   4.833  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.764  -5.739   0.585  1.00  0.00           C  
HETATM   22  C   UNL     1       0.287  -5.354  -0.423  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.632  -0.967   0.107  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.901  -0.665   1.465  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.314  -1.430   2.481  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.768   0.417   1.749  1.00  0.00           C  
HETATM   27  N   UNL     1      -8.283   1.093   0.730  1.00  0.00           N  
HETATM   28  N   UNL     1      -8.069   0.760   3.050  1.00  0.00           N  
HETATM   29  N   UNL     1      -7.207  -0.218  -0.847  1.00  0.00           N  
HETATM   30  N   UNL     1      -4.363  -3.829   0.515  1.00  0.00           N  
HETATM   31  N   UNL     1      -2.048  -5.376   0.392  1.00  0.00           N  
HETATM   32  N   UNL     1     -10.037   3.178   5.106  1.00  0.00           N  
HETATM   33  O   UNL     1      -0.456  -6.377   1.570  1.00  0.00           O  
HETATM   34  C   UNL     1       1.648  -5.885   0.031  1.00  0.00           C  
HETATM   35  O   UNL     1       2.646  -5.520  -0.925  1.00  0.00           O  
HETATM   36  C   UNL     1       3.961  -5.970  -0.594  1.00  0.00           C  
HETATM   37  C   UNL     1       4.941  -5.524  -1.680  1.00  0.00           C  
HETATM   38  O   UNL     1       5.022  -4.098  -1.693  1.00  0.00           O  
HETATM   39  C   UNL     1       5.916  -3.575  -2.678  1.00  0.00           C  
HETATM   40  C   UNL     1       5.923  -2.047  -2.600  1.00  0.00           C  
HETATM   41  O   UNL     1       6.463  -1.636  -1.343  1.00  0.00           O  
HETATM   42  C   UNL     1     -10.157   1.445  -1.590  1.00  0.00           C  
HETATM   43 CL   UNL     1      -7.061   7.361  -1.072  1.00  0.00          Cl  
HETATM   44  H   UNL     1      -5.039  -3.053   2.941  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.563  -2.273  -1.233  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.873   0.004  -2.923  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.346   1.649  -3.394  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.525   2.218  -4.258  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.377   0.495  -4.737  1.00  0.00           H  
HETATM   50  H   UNL     1     -11.514   1.264  -3.284  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.672  -0.256  -2.852  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.862   2.666   0.109  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.219   5.032   0.336  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.890   6.061  -2.828  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.528   3.694  -3.057  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.605  -2.713   0.232  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.645  -2.859  -1.205  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.057  -5.223  -1.448  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.555  -4.272  -1.333  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.627  -6.165   2.255  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.766  -6.472   0.918  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.718  -4.747   2.372  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.218  -3.792   2.276  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.941   1.689   2.869  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.548   2.797   2.900  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.556   1.138   5.255  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.163   2.246   5.286  1.00  0.00           H  
HETATM   68  H   UNL     1       0.035  -5.782  -1.393  1.00  0.00           H  
HETATM   69  H   UNL     1       0.331  -4.268  -0.506  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.518  -1.203   3.517  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.686   0.257   3.786  1.00  0.00           H  
HETATM   72  H   UNL     1     -10.163   3.309   6.098  1.00  0.00           H  
HETATM   73  H   UNL     1      -9.701   4.023   4.669  1.00  0.00           H  
HETATM   74  H   UNL     1       1.900  -5.457   1.001  1.00  0.00           H  
HETATM   75  H   UNL     1       1.605  -6.971   0.114  1.00  0.00           H  
HETATM   76  H   UNL     1       4.261  -5.543   0.363  1.00  0.00           H  
HETATM   77  H   UNL     1       3.966  -7.058  -0.524  1.00  0.00           H  
HETATM   78  H   UNL     1       5.927  -5.943  -1.474  1.00  0.00           H  
HETATM   79  H   UNL     1       4.593  -5.877  -2.651  1.00  0.00           H  
HETATM   80  H   UNL     1       6.922  -3.953  -2.492  1.00  0.00           H  
HETATM   81  H   UNL     1       5.588  -3.887  -3.669  1.00  0.00           H  
HETATM   82  H   UNL     1       6.535  -1.645  -3.407  1.00  0.00           H  
HETATM   83  H   UNL     1       4.903  -1.674  -2.697  1.00  0.00           H  
HETATM   84  H   UNL     1     -10.620   2.424  -1.467  1.00  0.00           H  
HETATM   85  H   UNL     1     -10.450   0.788  -0.771  1.00  0.00           H  
HETATM   86  C   UNL     1       6.515  -0.219  -1.167  1.00  0.00           C  
HETATM   87  C   UNL     1       7.107   0.104   0.206  1.00  0.00           C  
HETATM   88  O   UNL     1       8.467  -0.332   0.253  1.00  0.00           O  
HETATM   89  C   UNL     1       9.117  -0.076   1.499  1.00  0.00           C  
HETATM   90  C   UNL     1      10.559  -0.582   1.436  1.00  0.00           C  
HETATM   91  O   UNL     1      11.287   0.176   0.467  1.00  0.00           O  
HETATM   92  C   UNL     1      12.654  -0.218   0.329  1.00  0.00           C  
HETATM   93  C   UNL     1      13.332   0.656  -0.729  1.00  0.00           C  
HETATM   94  O   UNL     1      13.373   2.009  -0.272  1.00  0.00           O  
HETATM   95  C   UNL     1      13.991   2.914  -1.191  1.00  0.00           C  
HETATM   96  C   UNL     1      13.979   4.326  -0.602  1.00  0.00           C  
HETATM   97  N   UNL     1      14.818   4.360   0.599  1.00  0.00           N  
HETATM   98  C   UNL     1      14.958   5.509   1.290  1.00  0.00           C  
HETATM   99  C   UNL     1      15.821   5.545   2.525  1.00  0.00           C  
HETATM  100  O   UNL     1      14.390   6.514   0.917  1.00  0.00           O  
HETATM  101  H   UNL     1       7.139   0.221  -1.945  1.00  0.00           H  
HETATM  102  H   UNL     1       5.507   0.192  -1.234  1.00  0.00           H  
HETATM  103  H   UNL     1       7.064   1.180   0.376  1.00  0.00           H  
HETATM  104  H   UNL     1       6.534  -0.409   0.978  1.00  0.00           H  
HETATM  105  H   UNL     1       9.116   0.996   1.696  1.00  0.00           H  
HETATM  106  H   UNL     1       8.586  -0.593   2.299  1.00  0.00           H  
HETATM  107  H   UNL     1      11.028  -0.468   2.413  1.00  0.00           H  
HETATM  108  H   UNL     1      10.563  -1.634   1.151  1.00  0.00           H  
HETATM  109  H   UNL     1      13.166  -0.097   1.283  1.00  0.00           H  
HETATM  110  H   UNL     1      12.701  -1.263   0.021  1.00  0.00           H  
HETATM  111  H   UNL     1      14.348   0.298  -0.899  1.00  0.00           H  
HETATM  112  H   UNL     1      12.768   0.603  -1.660  1.00  0.00           H  
HETATM  113  H   UNL     1      15.020   2.603  -1.370  1.00  0.00           H  
HETATM  114  H   UNL     1      13.440   2.908  -2.132  1.00  0.00           H  
HETATM  115  H   UNL     1      14.368   5.029  -1.337  1.00  0.00           H  
HETATM  116  H   UNL     1      12.958   4.602  -0.340  1.00  0.00           H  
HETATM  117  H   UNL     1      15.272   3.557   0.897  1.00  0.00           H  
HETATM  118  H   UNL     1      16.245   4.556   2.701  1.00  0.00           H  
HETATM  119  H   UNL     1      16.626   6.266   2.385  1.00  0.00           H  
HETATM  120  H   UNL     1      15.215   5.839   3.383  1.00  0.00           H  
CONECT    1    2    2   25   44                                       
CONECT    2   30    1    1    3                                       
CONECT    3    2   23   23   45                                       
CONECT    4    8    5   46   47                                       
CONECT    5    4    6   48   49                                       
CONECT    6   42    5   50   51                                       
CONECT    7   29   29   27    8                                       
CONECT    8    7    9    4   42                                       
CONECT    9   10   10   14    8                                       
CONECT   10   11    9    9   52                                       
CONECT   11   12   12   10   53                                       
CONECT   12   43   11   11   13                                       
CONECT   13   12   14   14   54                                       
CONECT   14   13   13    9   55                                       
CONECT   15   16   30   56   57                                       
CONECT   16   31   15   58   59                                       
CONECT   17   31   18   60   61                                       
CONECT   18   17   30   62   63                                       
CONECT   19   28   20   64   65                                       
CONECT   20   19   32   66   67                                       
CONECT   21   31   22   33   33                                       
CONECT   22   34   21   68   69                                       
CONECT   23    3    3   24   29                                       
CONECT   24   25   25   23   26                                       
CONECT   25    1   24   24   70                                       
CONECT   26   24   28   27   27                                       
CONECT   27   26   26    7                                            
CONECT   28   26   19   71                                            
CONECT   29   23    7    7                                            
CONECT   30   18    2   15                                            
CONECT   31   17   16   21                                            
CONECT   32   20   72   73                                            
CONECT   33   21   21                                                 
CONECT   34   22   35   74   75                                       
CONECT   35   34   36                                                 
CONECT   36   35   37   76   77                                       
CONECT   37   36   38   78   79                                       
CONECT   38   37   39                                                 
CONECT   39   38   40   80   81                                       
CONECT   40   39   41   82   83                                       
CONECT   41   40   86                                                 
CONECT   42    8    6   84   85                                       
CONECT   43   12                                                      
CONECT   44    1                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    5                                                      
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51    6                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   13                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   20                                                      
CONECT   68   22                                                      
CONECT   69   22                                                      
CONECT   70   25                                                      
CONECT   71   28                                                      
CONECT   72   32                                                      
CONECT   73   32                                                      
CONECT   74   34                                                      
CONECT   75   34                                                      
CONECT   76   36                                                      
CONECT   77   36                                                      
CONECT   78   37                                                      
CONECT   79   37                                                      
CONECT   80   39                                                      
CONECT   81   39                                                      
CONECT   82   40                                                      
CONECT   83   40                                                      
CONECT   84   42                                                      
CONECT   85   42                                                      
CONECT   86   41   87  101  102                                       
CONECT   87   86   88  103  104                                       
CONECT   88   87   89                                                 
CONECT   89   88   90  105  106                                       
CONECT   90   89   91  107  108                                       
CONECT   91   90   92                                                 
CONECT   92   91   93  109  110                                       
CONECT   93   92   94  111  112                                       
CONECT   94   93   95                                                 
CONECT   95   94   96  113  114                                       
CONECT   96   95   97  115  116                                       
CONECT   97   96   98  117                                            
CONECT   98   97   99  100  100                                       
CONECT   99   98  118  119  120                                       
CONECT  100   98   98                                                 
CONECT  101   86                                                      
CONECT  102   86                                                      
CONECT  103   87                                                      
CONECT  104   87                                                      
CONECT  105   89                                                      
CONECT  106   89                                                      
CONECT  107   90                                                      
CONECT  108   90                                                      
CONECT  109   92                                                      
CONECT  110   92                                                      
CONECT  111   93                                                      
CONECT  112   93                                                      
CONECT  113   95                                                      
CONECT  114   95                                                      
CONECT  115   96                                                      
CONECT  116   96                                                      
CONECT  117   97                                                      
CONECT  118   99                                                      
CONECT  119   99                                                      
CONECT  120   99                                                      
MASTER        0    0    0    0    0    0    0    0  120    0  120    0
END
