COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.988  -3.993  -0.376  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.645  -2.539   0.320  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.002  -1.460  -0.260  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.284  -2.963  -0.980  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.061  -0.530  -1.548  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.638   3.155  -1.694  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.104   3.551  -0.302  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.835   1.878  -1.820  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.534   4.102  -0.416  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.272   4.053   0.920  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.198   2.310   2.327  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.978   0.994   2.255  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.019  -0.181   2.040  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.524  -1.056   0.887  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.062   2.421   0.715  1.00  0.00           C  
HETATM   16  C   UNL     1       0.470   1.948  -1.034  1.00  0.00           C  
HETATM   17  C   UNL     1       1.336   0.733  -1.374  1.00  0.00           C  
HETATM   18  C   UNL     1       3.567  -0.192  -1.203  1.00  0.00           C  
HETATM   19  C   UNL     1       4.961   0.075  -0.696  1.00  0.00           C  
HETATM   20  C   UNL     1       5.314  -0.301   0.587  1.00  0.00           C  
HETATM   21  C   UNL     1       6.592  -0.056   1.052  1.00  0.00           C  
HETATM   22  C   UNL     1       7.518   0.564   0.234  1.00  0.00           C  
HETATM   23  C   UNL     1       7.166   0.939  -1.049  1.00  0.00           C  
HETATM   24  C   UNL     1       5.889   0.690  -1.516  1.00  0.00           C  
HETATM   25  C   UNL     1       6.977  -0.465   2.451  1.00  0.00           C  
HETATM   26  C   UNL     1       8.139  -1.457   2.391  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.790  -1.663  -0.925  1.00  0.00           C  
HETATM   28  C   UNL     1       7.402   0.772   3.245  1.00  0.00           C  
HETATM   29  N   UNL     1      -1.653   0.705  -1.466  1.00  0.00           N  
HETATM   30  N   UNL     1      -3.129  -3.759   0.249  1.00  0.00           N  
HETATM   31  N   UNL     1      -4.866  -2.372   0.988  1.00  0.00           N  
HETATM   32  N   UNL     1       2.706   0.957  -0.893  1.00  0.00           N  
HETATM   33  O   UNL     1      -5.017   2.837   1.013  1.00  0.00           O  
HETATM   34  O   UNL     1       1.171   3.144  -1.380  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.006  -0.718  -2.119  1.00  0.00           O  
HETATM   36 CL   UNL     1      -1.365  -5.612  -0.449  1.00  0.00          Cl  
HETATM   37  H   UNL     1      -3.429  -0.470  -0.197  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.353  -3.167  -1.489  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.523   3.074  -2.347  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.038   3.984  -2.106  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.462   4.370   0.062  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.558   1.768  -2.892  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.487   5.135  -0.768  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.082   3.509  -1.153  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.597   4.164   1.759  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.985   4.891   0.954  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.756   3.027   2.930  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.227   2.131   2.789  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.526   0.848   3.187  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.685   1.039   1.426  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.026   0.198   1.803  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.970  -0.778   2.952  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.607  -1.181   0.972  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.293  -0.588  -0.069  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.027   2.128   0.890  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.508   2.757   1.651  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.621   1.567   0.332  1.00  0.00           H  
HETATM   58  H   UNL     1       0.252   1.951   0.034  1.00  0.00           H  
HETATM   59  H   UNL     1       0.923  -0.154  -0.892  1.00  0.00           H  
HETATM   60  H   UNL     1       1.349   0.586  -2.454  1.00  0.00           H  
HETATM   61  H   UNL     1       3.596  -0.344  -2.282  1.00  0.00           H  
HETATM   62  H   UNL     1       3.170  -1.084  -0.720  1.00  0.00           H  
HETATM   63  H   UNL     1       4.590  -0.785   1.225  1.00  0.00           H  
HETATM   64  H   UNL     1       8.517   0.756   0.598  1.00  0.00           H  
HETATM   65  H   UNL     1       7.889   1.424  -1.688  1.00  0.00           H  
HETATM   66  H   UNL     1       5.614   0.983  -2.518  1.00  0.00           H  
HETATM   67  H   UNL     1       6.123  -0.934   2.939  1.00  0.00           H  
HETATM   68  H   UNL     1       8.417  -1.753   3.402  1.00  0.00           H  
HETATM   69  H   UNL     1       7.836  -2.338   1.825  1.00  0.00           H  
HETATM   70  H   UNL     1       8.993  -0.988   1.902  1.00  0.00           H  
HETATM   71  H   UNL     1       6.573   1.479   3.287  1.00  0.00           H  
HETATM   72  H   UNL     1       7.680   0.477   4.256  1.00  0.00           H  
HETATM   73  H   UNL     1       8.255   1.242   2.756  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.598   0.787  -1.222  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.263  -3.099   1.502  1.00  0.00           H  
HETATM   76  H   UNL     1       2.714   1.159   0.095  1.00  0.00           H  
HETATM   77  H   UNL     1       1.399   3.209  -2.318  1.00  0.00           H  
CONECT    1    4   36   30   30                                       
CONECT    2    3    3   30   31                                       
CONECT    3   27    2    2   37                                       
CONECT    4   27   27    1   38                                       
CONECT    5   35   35   29   27                                       
CONECT    6    8    7   39   40                                       
CONECT    7   15    6    9   41                                       
CONECT    8   16    6   29   42                                       
CONECT    9    7   10   43   44                                       
CONECT   10    9   33   45   46                                       
CONECT   11   33   12   47   48                                       
CONECT   12   11   13   49   50                                       
CONECT   13   14   12   51   52                                       
CONECT   14   31   13   53   54                                       
CONECT   15    7   55   56   57                                       
CONECT   16   17   34    8   58                                       
CONECT   17   32   16   59   60                                       
CONECT   18   19   32   61   62                                       
CONECT   19   20   20   24   18                                       
CONECT   20   21   19   19   63                                       
CONECT   21   25   22   22   20                                       
CONECT   22   21   21   23   64                                       
CONECT   23   22   24   24   65                                       
CONECT   24   23   23   19   66                                       
CONECT   25   28   26   21   67                                       
CONECT   26   25   68   69   70                                       
CONECT   27    5    4    4    3                                       
CONECT   28   25   71   72   73                                       
CONECT   29    8    5   74                                            
CONECT   30    1    1    2                                            
CONECT   31    2   14   75                                            
CONECT   32   18   17   76                                            
CONECT   33   10   11                                                 
CONECT   34   16   77                                                 
CONECT   35    5    5                                                 
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   18                                                      
CONECT   62   18                                                      
CONECT   63   20                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   26                                                      
CONECT   70   26                                                      
CONECT   71   28                                                      
CONECT   72   28                                                      
CONECT   73   28                                                      
CONECT   74   29                                                      
CONECT   75   31                                                      
CONECT   76   32                                                      
CONECT   77   34                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
