COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       0.761   1.756  -0.033  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.706   1.911  -0.016  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.540   3.311   0.000  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.796   0.934   0.006  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.593  -0.201   0.019  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.004  -1.471   0.011  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.467  -3.085  -0.012  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.066  -5.136   0.743  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.103  -5.154  -0.786  1.00  0.00           C  
HETATM   10  C   UNL     1       1.652   2.770  -0.047  1.00  0.00           C  
HETATM   11  C   UNL     1       2.972   2.377  -0.060  1.00  0.00           C  
HETATM   12  C   UNL     1       3.170   1.054  -0.058  1.00  0.00           C  
HETATM   13  S   UNL     1       1.621   0.221  -0.030  1.00  0.00           S  
HETATM   14  N   UNL     1      -1.229   3.132  -0.014  1.00  0.00           N  
HETATM   15  C   UNL     1      -3.374   2.207   0.014  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.472   0.826  -0.009  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.626  -1.742  -0.011  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.693  -3.647   0.011  1.00  0.00           N  
HETATM   19  N   UNL     1      -3.643  -2.618   0.027  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.153  -3.822  -0.036  1.00  0.00           C  
HETATM   21 CL   UNL     1      -5.099   2.398   0.040  1.00  0.00          Cl  
HETATM   22  S   UNL     1       4.745   0.264  -0.074  1.00  0.00           S  
HETATM   23  O   UNL     1       4.537  -1.035  -0.612  1.00  0.00           O  
HETATM   24  O   UNL     1       5.657   1.199  -0.632  1.00  0.00           O  
HETATM   25  N   UNL     1       5.201   0.049   1.503  1.00  0.00           N  
HETATM   26  H   UNL     1      -2.955   4.308   0.002  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.560  -0.114   0.034  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.959  -5.467   1.273  1.00  0.00           H  
HETATM   29  H   UNL     1       0.882  -5.373   1.227  1.00  0.00           H  
HETATM   30  H   UNL     1       0.820  -5.403  -1.309  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.021  -5.497  -1.263  1.00  0.00           H  
HETATM   32  H   UNL     1       1.353   3.808  -0.047  1.00  0.00           H  
HETATM   33  H   UNL     1       3.788   3.085  -0.073  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.834  -1.007  -0.024  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.884  -4.598   0.015  1.00  0.00           H  
HETATM   36  H   UNL     1       0.738  -3.194  -0.065  1.00  0.00           H  
HETATM   37  H   UNL     1       6.049  -0.374   1.709  1.00  0.00           H  
HETATM   38  H   UNL     1       4.621   0.347   2.221  1.00  0.00           H  
CONECT    1   13   10   10    2                                       
CONECT    2    1   16   16   14                                       
CONECT    3   14   14   15   26                                       
CONECT    4   16    5   15   15                                       
CONECT    5    6    4   27                                            
CONECT    6   17   19   19    5                                       
CONECT    7   20   18   17   17                                       
CONECT    8    9   20   28   29                                       
CONECT    9    8   20   30   31                                       
CONECT   10   11    1    1   32                                       
CONECT   11   12   12   10   33                                       
CONECT   12   22   11   11   13                                       
CONECT   13   12    1                                                 
CONECT   14    2    3    3                                            
CONECT   15    4    4    3   21                                       
CONECT   16    2    2    4                                            
CONECT   17    7    7    6   34                                       
CONECT   18    7   19   35                                            
CONECT   19   18    6    6                                            
CONECT   20    8    9    7   36                                       
CONECT   21   15                                                      
CONECT   22   25   24   24   23                                       
CONECT   22   23   12                                                 
CONECT   23   22   22                                                 
CONECT   24   22   22                                                 
CONECT   25   22   37   38                                            
CONECT   26    3                                                      
CONECT   27    5                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
CONECT   37   25                                                      
CONECT   38   25                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
