COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.288   0.860   0.088  1.00  0.00           C  
HETATM    2  C   UNL     1       0.112   2.247   0.206  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.801   1.313  -0.287  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.683  -0.176  -0.835  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.292   0.897  -0.554  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.073  -1.289   0.399  1.00  0.00           C  
HETATM    7  C   UNL     1       2.179   5.184   0.953  1.00  0.00           C  
HETATM    8  C   UNL     1       3.966   0.538   0.810  1.00  0.00           C  
HETATM    9  C   UNL     1       3.584  -0.943  -1.109  1.00  0.00           C  
HETATM   10  C   UNL     1       5.660  -1.165   0.308  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.720  -1.280   0.109  1.00  0.00           C  
HETATM   12 CL   UNL     1      -7.782  -2.662   1.190  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -7.858  -0.198   0.071  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.942   0.902  -0.852  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.156  -0.187  -0.520  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.473  -0.536  -2.307  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.138   1.159  -0.576  1.00  0.00           N  
HETATM   18  O   UNL     1      -1.198   2.487  -0.034  1.00  0.00           O  
HETATM   19  N   UNL     1      -0.932   0.337  -0.218  1.00  0.00           N  
HETATM   20  C   UNL     1       1.548   0.301   0.288  1.00  0.00           C  
HETATM   21  C   UNL     1       1.196   3.064   0.517  1.00  0.00           C  
HETATM   22  O   UNL     1       1.024   4.408   0.632  1.00  0.00           O  
HETATM   23  C   UNL     1       2.445   2.509   0.710  1.00  0.00           C  
HETATM   24  C   UNL     1       2.627   1.125   0.598  1.00  0.00           C  
HETATM   25  O   UNL     1       4.689   0.974   1.685  1.00  0.00           O  
HETATM   26  N   UNL     1       4.386  -0.481   0.035  1.00  0.00           N  
HETATM   27  C   UNL     1       4.493  -1.008  -2.342  1.00  0.00           C  
HETATM   28  C   UNL     1       3.738  -1.665  -3.499  1.00  0.00           C  
HETATM   29  O   UNL     1       5.655  -1.778  -2.029  1.00  0.00           O  
HETATM   30  C   UNL     1       6.468  -1.219  -0.994  1.00  0.00           C  
HETATM   31  C   UNL     1       5.386  -2.587   0.803  1.00  0.00           C  
HETATM   32  C   UNL     1       4.666  -2.526   2.152  1.00  0.00           C  
HETATM   33  O   UNL     1       4.410  -3.854   2.615  1.00  0.00           O  
HETATM   34  H   UNL     1      -3.171  -0.905  -0.206  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.905   1.747  -0.814  1.00  0.00           H  
HETATM   36  H   UNL     1       2.934   5.051   0.178  1.00  0.00           H  
HETATM   37  H   UNL     1       1.904   6.237   1.014  1.00  0.00           H  
HETATM   38  H   UNL     1       2.582   4.858   1.912  1.00  0.00           H  
HETATM   39  H   UNL     1       3.180  -1.933  -0.899  1.00  0.00           H  
HETATM   40  H   UNL     1       2.767  -0.244  -1.291  1.00  0.00           H  
HETATM   41  H   UNL     1       6.218  -0.614   1.064  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.105  -2.126   0.376  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.912  -0.201   0.304  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.501   1.756  -1.344  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.984   0.193  -2.936  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.407  -0.528  -2.535  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.878  -1.529  -2.500  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.719   1.935  -0.609  1.00  0.00           H  
HETATM   49  H   UNL     1       1.688  -0.766   0.204  1.00  0.00           H  
HETATM   50  H   UNL     1       3.285   3.144   0.951  1.00  0.00           H  
HETATM   51  H   UNL     1       4.791   0.001  -2.628  1.00  0.00           H  
HETATM   52  H   UNL     1       2.850  -1.079  -3.734  1.00  0.00           H  
HETATM   53  H   UNL     1       4.385  -1.711  -4.375  1.00  0.00           H  
HETATM   54  H   UNL     1       3.442  -2.675  -3.213  1.00  0.00           H  
HETATM   55  H   UNL     1       6.773  -0.211  -1.276  1.00  0.00           H  
HETATM   56  H   UNL     1       7.351  -1.841  -0.849  1.00  0.00           H  
HETATM   57  H   UNL     1       4.760  -3.109   0.080  1.00  0.00           H  
HETATM   58  H   UNL     1       6.330  -3.119   0.919  1.00  0.00           H  
HETATM   59  H   UNL     1       5.291  -2.004   2.875  1.00  0.00           H  
HETATM   60  H   UNL     1       3.722  -1.994   2.036  1.00  0.00           H  
HETATM   61  H   UNL     1       3.954  -3.892   3.467  1.00  0.00           H  
CONECT    1   20   19    2    2                                       
CONECT    2    1    1   21   18                                       
CONECT    3   19   19   18   17                                       
CONECT    4   15   17   16   34                                       
CONECT    5   13   14   14   35                                       
CONECT    6   12   13   13   11                                       
CONECT    7   22   36   37   38                                       
CONECT    8   26   25   25   24                                       
CONECT    9   27   26   39   40                                       
CONECT   10   30   26   31   41                                       
CONECT   11    6   15   15   42                                       
CONECT   12    6                                                      
CONECT   13    6    6    5   43                                       
CONECT   14    5    5   15   44                                       
CONECT   15   11   11   14    4                                       
CONECT   16    4   45   46   47                                       
CONECT   17    3    4   48                                            
CONECT   18    2    3                                                 
CONECT   19    1    3    3                                            
CONECT   20   24   24    1   49                                       
CONECT   21   23   23    2   22                                       
CONECT   22   21    7                                                 
CONECT   23   24   21   21   50                                       
CONECT   24    8   20   20   23                                       
CONECT   25    8    8                                                 
CONECT   26   10    9    8                                            
CONECT   27   28   29    9   51                                       
CONECT   28   27   52   53   54                                       
CONECT   29   30   27                                                 
CONECT   30   29   10   55   56                                       
CONECT   31   10   32   57   58                                       
CONECT   32   31   33   59   60                                       
CONECT   33   32   61                                                 
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   20                                                      
CONECT   50   23                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
