COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.253  -2.739   1.229  1.00  0.00           C  
HETATM    2  C   UNL     1       6.365  -1.401   2.717  1.00  0.00           C  
HETATM    3  N   UNL     1       4.810  -0.430   1.258  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.283   1.054   0.292  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.424   0.125   0.414  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.538  -2.447  -2.183  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.056   0.589  -0.194  1.00  0.00           C  
HETATM    8  C   UNL     1       0.018   1.453  -0.312  1.00  0.00           C  
HETATM    9  C   UNL     1       1.318   0.961  -0.827  1.00  0.00           C  
HETATM   10  C   UNL     1       1.972   1.651  -1.847  1.00  0.00           C  
HETATM   11  N   UNL     1       6.134  -2.597   2.202  1.00  0.00           N  
HETATM   12  C   UNL     1       3.106  -0.645  -0.776  1.00  0.00           C  
HETATM   13  O   UNL     1      -5.152  -1.942   1.561  1.00  0.00           O  
HETATM   14  C   UNL     1       3.749   0.045  -1.796  1.00  0.00           C  
HETATM   15  O   UNL     1      -4.521   0.547   0.727  1.00  0.00           O  
HETATM   16  C   UNL     1       3.182   1.191  -2.325  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.250  -1.190   0.180  1.00  0.00           N  
HETATM   18  C   UNL     1       4.572  -1.628   0.743  1.00  0.00           C  
HETATM   19  O   UNL     1       3.666  -1.770  -0.258  1.00  0.00           O  
HETATM   20 CL   UNL     1       5.268  -0.531  -2.408  1.00  0.00          Cl  
HETATM   21  C   UNL     1       5.686  -0.296   2.239  1.00  0.00           C  
HETATM   22  C   UNL     1       1.892  -0.190  -0.290  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.130   2.805   0.061  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.367   3.267   0.549  1.00  0.00           C  
HETATM   25  N   UNL     1      -1.214   4.609   0.828  1.00  0.00           N  
HETATM   26  C   UNL     1       0.067   4.980   0.528  1.00  0.00           C  
HETATM   27  C   UNL     1       0.748   3.917   0.063  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.437   2.391   0.656  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.762   2.882   1.178  1.00  0.00           C  
HETATM   30  S   UNL     1      -4.529  -2.233   0.317  1.00  0.00           S  
HETATM   31  O   UNL     1      -4.035  -3.521  -0.022  1.00  0.00           O  
HETATM   32  N   UNL     1      -5.621  -1.826  -0.859  1.00  0.00           N  
HETATM   33  C   UNL     1      -6.671  -0.844  -0.576  1.00  0.00           C  
HETATM   34  H   UNL     1       5.065  -3.716   0.809  1.00  0.00           H  
HETATM   35  H   UNL     1       7.086  -1.288   3.513  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.138  -3.357  -2.196  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.914  -1.753  -2.935  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.499  -2.694  -2.403  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.947  -0.448  -0.478  1.00  0.00           H  
HETATM   40  H   UNL     1       1.532   2.545  -2.263  1.00  0.00           H  
HETATM   41  H   UNL     1       3.688   1.727  -3.115  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.375  -1.527  -0.070  1.00  0.00           H  
HETATM   43  H   UNL     1       5.880   0.679   2.659  1.00  0.00           H  
HETATM   44  H   UNL     1       1.391  -0.725   0.503  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.903   5.195   1.179  1.00  0.00           H  
HETATM   46  H   UNL     1       0.471   5.974   0.646  1.00  0.00           H  
HETATM   47  H   UNL     1       1.781   3.912  -0.252  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.417   3.121   0.340  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.223   2.104   1.788  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.606   3.774   1.784  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.289  -0.706  -1.463  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.291  -1.202   0.247  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.215   0.107  -0.300  1.00  0.00           H  
CONECT    1   18   11   11   34                                       
CONECT    2   21   21   11   35                                       
CONECT    3   18   18   21                                            
CONECT    4   28   28    7    5                                       
CONECT    5    4   17   15   15                                       
CONECT    6   32   36   37   38                                       
CONECT    7    8    8    4   39                                       
CONECT    8   23    9    7    7                                       
CONECT    9    8   10   10   22                                       
CONECT   10    9    9   16   40                                       
CONECT   11    1    1    2                                            
CONECT   12   22   22   14   19                                       
CONECT   13   30   30                                                 
CONECT   14   16   16   12   20                                       
CONECT   15    5    5                                                 
CONECT   16   10   14   14   41                                       
CONECT   17    5   30   42                                            
CONECT   18   19    3    3    1                                       
CONECT   19   12   18                                                 
CONECT   20   14                                                      
CONECT   21    3    2    2   43                                       
CONECT   22    9   12   12   44                                       
CONECT   23   27   24   24    8                                       
CONECT   24   25   23   23   28                                       
CONECT   25   26   24   45                                            
CONECT   26   25   27   27   46                                       
CONECT   27   26   26   23   47                                       
CONECT   28   24   29    4    4                                       
CONECT   29   28   48   49   50                                       
CONECT   30   32   17   31   31                                       
CONECT   30   13   13                                                 
CONECT   31   30   30                                                 
CONECT   32   33    6   30                                            
CONECT   33   32   51   52   53                                       
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40   10                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
CONECT   53   33                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
