COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.907   0.639  -0.223  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.053   1.150   0.356  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.724   0.421   1.321  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.186  -1.160  -0.476  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.961  -0.725   0.331  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.543  -1.014   0.255  1.00  0.00           C  
HETATM    7  C   UNL     1       0.467  -1.301  -4.098  1.00  0.00           C  
HETATM    8  C   UNL     1       2.549  -3.399   0.763  1.00  0.00           C  
HETATM    9  C   UNL     1       3.236   0.817   1.016  1.00  0.00           C  
HETATM   10  C   UNL     1       2.417   3.055   0.752  1.00  0.00           C  
HETATM   11  C   UNL     1       1.061   1.199   0.065  1.00  0.00           C  
HETATM   12  C   UNL     1       3.827   4.833   1.465  1.00  0.00           C  
HETATM   13  O   UNL     1       2.593   4.396   0.892  1.00  0.00           O  
HETATM   14  C   UNL     1       1.241   2.562   0.203  1.00  0.00           C  
HETATM   15 CL   UNL     1      -0.005   3.659  -0.306  1.00  0.00          Cl  
HETATM   16  C   UNL     1       3.413   2.180   1.158  1.00  0.00           C  
HETATM   17  C   UNL     1       2.060   0.323   0.467  1.00  0.00           C  
HETATM   18  N   UNL     1       1.882  -1.058   0.318  1.00  0.00           N  
HETATM   19  C   UNL     1       2.797  -1.913   0.818  1.00  0.00           C  
HETATM   20  O   UNL     1       3.819  -1.487   1.313  1.00  0.00           O  
HETATM   21  C   UNL     1       0.703  -1.574  -0.381  1.00  0.00           C  
HETATM   22  C   UNL     1       0.757  -1.160  -1.829  1.00  0.00           C  
HETATM   23  C   UNL     1       0.312  -1.889  -2.854  1.00  0.00           C  
HETATM   24  C   UNL     1       1.042  -0.098  -4.083  1.00  0.00           C  
HETATM   25  S   UNL     1       1.424   0.353  -2.427  1.00  0.00           S  
HETATM   26  O   UNL     1      -0.460  -0.335   1.256  1.00  0.00           O  
HETATM   27  N   UNL     1      -1.750  -1.269  -0.287  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.432  -0.601   0.161  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.100  -1.327   1.129  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.249  -0.819   1.705  1.00  0.00           C  
HETATM   31  H   UNL     1      -5.385   1.207  -0.979  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.425   2.119   0.057  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.619   0.821   1.774  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.100  -0.787  -1.496  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.243  -2.249  -0.491  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.904   0.363   0.347  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.047  -1.099   1.352  1.00  0.00           H  
HETATM   38  H   UNL     1       0.150  -1.783  -5.011  1.00  0.00           H  
HETATM   39  H   UNL     1       1.593  -3.626   1.235  1.00  0.00           H  
HETATM   40  H   UNL     1       2.526  -3.725  -0.277  1.00  0.00           H  
HETATM   41  H   UNL     1       4.014   0.136   1.328  1.00  0.00           H  
HETATM   42  H   UNL     1       0.146   0.816  -0.362  1.00  0.00           H  
HETATM   43  H   UNL     1       3.929   4.418   2.467  1.00  0.00           H  
HETATM   44  H   UNL     1       4.656   4.492   0.845  1.00  0.00           H  
HETATM   45  H   UNL     1       3.837   5.921   1.519  1.00  0.00           H  
HETATM   46  H   UNL     1       4.328   2.563   1.584  1.00  0.00           H  
HETATM   47  H   UNL     1       0.688  -2.662  -0.315  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.136  -2.863  -2.724  1.00  0.00           H  
HETATM   49  H   UNL     1       1.243   0.507  -4.956  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.817  -1.813  -1.088  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.728  -2.296   1.429  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.773  -1.388   2.458  1.00  0.00           H  
HETATM   53 CL   UNL     1       3.871  -4.261   1.634  1.00  0.00          Cl  
CONECT    1    2   28   28   31                                       
CONECT    2    3    3    1   32                                       
CONECT    3    2    2   30   33                                       
CONECT    4   28    5   34   35                                       
CONECT    5    4   27   36   37                                       
CONECT    6   26   26   21   27                                       
CONECT    7   24   24   23   38                                       
CONECT    8   19   39   40   53                                       
CONECT    9   16   17   17   41                                       
CONECT   10   13   16   16   14                                       
CONECT   11   14   14   17   42                                       
CONECT   12   13   43   44   45                                       
CONECT   13   12   10                                                 
CONECT   14   10   15   11   11                                       
CONECT   15   14                                                      
CONECT   16   10   10    9   46                                       
CONECT   17    9    9   11   18                                       
CONECT   18   17   19   21                                            
CONECT   19    8   18   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   18    6   22   47                                       
CONECT   22   25   21   23   23                                       
CONECT   23   22   22    7   48                                       
CONECT   24   25    7    7   49                                       
CONECT   25   24   22                                                 
CONECT   26    6    6                                                 
CONECT   27    6    5   50                                            
CONECT   28    1    1   29    4                                       
CONECT   29   30   30   28   51                                       
CONECT   30    3   29   29   52                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   16                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   27                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53    8                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
