COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.410  -0.136   0.377  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.013   1.489  -0.342  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.100   0.228   1.628  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.677   0.730   1.384  1.00  0.00           C  
HETATM    5  C   UNL     1       0.118  -0.350   0.696  1.00  0.00           C  
HETATM    6  C   UNL     1       2.171  -1.166  -0.181  1.00  0.00           C  
HETATM    7  C   UNL     1       3.584  -3.236  -1.339  1.00  0.00           C  
HETATM    8  C   UNL     1       6.240  -1.637   0.656  1.00  0.00           C  
HETATM    9  C   UNL     1       4.204  -0.413   0.987  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.684   1.965   0.522  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.736  -2.727  -0.037  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.221  -2.493   1.384  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.454  -2.202   0.206  1.00  0.00           O  
HETATM   14  S   UNL     1      -3.323  -1.218  -0.337  1.00  0.00           S  
HETATM   15  O   UNL     1      -3.352  -0.957  -1.734  1.00  0.00           O  
HETATM   16  C   UNL     1      -5.005  -1.428   0.307  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.799   0.204   0.332  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.751   2.312  -0.277  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.685   3.459  -1.057  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.561   4.258  -1.035  1.00  0.00           C  
HETATM   21  C   UNL     1       0.445   2.773   0.546  1.00  0.00           C  
HETATM   22  C   UNL     1       0.508   3.915  -0.228  1.00  0.00           C  
HETATM   23 CL   UNL     1       1.926   4.917  -0.187  1.00  0.00          Cl  
HETATM   24  O   UNL     1      -0.405  -1.412   0.430  1.00  0.00           O  
HETATM   25  C   UNL     1       3.544  -1.296   0.122  1.00  0.00           C  
HETATM   26  C   UNL     1       5.530  -0.591   1.242  1.00  0.00           C  
HETATM   27  C   UNL     1       5.631  -2.513  -0.189  1.00  0.00           C  
HETATM   28  C   UNL     1       4.264  -2.362  -0.476  1.00  0.00           C  
HETATM   29  N   UNL     1       2.305  -3.065  -1.577  1.00  0.00           N  
HETATM   30  C   UNL     1       1.598  -2.082  -1.038  1.00  0.00           C  
HETATM   31  H   UNL     1       1.810   0.734   0.532  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.277   1.312  -1.384  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.822   2.026   0.152  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.070  -0.776   2.050  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.616   0.901   2.312  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.211   0.963   2.341  1.00  0.00           H  
HETATM   37  H   UNL     1       4.114  -4.053  -1.804  1.00  0.00           H  
HETATM   38  H   UNL     1       7.291  -1.754   0.875  1.00  0.00           H  
HETATM   39  H   UNL     1       3.665   0.402   1.447  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.206  -3.456  -0.651  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.813  -2.672  -0.198  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.959  -2.283   2.159  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.352  -3.067   1.706  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.601  -0.518   0.373  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.521   3.727  -1.687  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.516   5.148  -1.645  1.00  0.00           H  
HETATM   47  H   UNL     1       1.281   2.506   1.176  1.00  0.00           H  
HETATM   48  H   UNL     1       6.039   0.090   1.909  1.00  0.00           H  
HETATM   49  H   UNL     1       6.194  -3.319  -0.636  1.00  0.00           H  
HETATM   50  H   UNL     1       0.548  -1.997  -1.275  1.00  0.00           H  
CONECT    1    6    5   31                                            
CONECT    2   17   18   32   33                                       
CONECT    3    4   17   34   35                                       
CONECT    4    3    5   10   36                                       
CONECT    5    1    4   24   24                                       
CONECT    6   25   25   30    1                                       
CONECT    7   28   28   29   37                                       
CONECT    8   27   27   26   38                                       
CONECT    9   26   26   25   39                                       
CONECT   10    4   21   21   18                                       
CONECT   11   12   16   40   41                                       
CONECT   12   11   16   42   43                                       
CONECT   13   14   14                                                 
CONECT   14   15   15   16   17                                       
CONECT   14   13   13                                                 
CONECT   15   14   14                                                 
CONECT   16   12   11   14   44                                       
CONECT   17    3   14    2                                            
CONECT   18   10    2   19   19                                       
CONECT   19   18   18   20   45                                       
CONECT   20   22   22   19   46                                       
CONECT   21   10   10   22   47                                       
CONECT   22   21   23   20   20                                       
CONECT   23   22                                                      
CONECT   24    5    5                                                 
CONECT   25   28    9    6    6                                       
CONECT   26    8    9    9   48                                       
CONECT   27    8    8   28   49                                       
CONECT   28   27    7    7   25                                       
CONECT   29    7   30   30                                            
CONECT   30   29   29    6   50                                       
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   16                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   30                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
