COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.346  -0.813   0.660  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.961  -0.812   1.874  1.00  0.00           C  
HETATM    3  N   UNL     1      -5.122  -0.232   1.786  1.00  0.00           N  
HETATM    4  C   UNL     1      -5.332   0.180   0.510  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.193  -0.182  -0.229  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.125   0.116  -1.583  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.177   0.766  -2.193  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.301   1.124  -1.463  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.384   0.842  -0.128  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.027  -1.373   0.355  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.988  -0.284   0.436  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.317   0.848   0.720  1.00  0.00           O  
HETATM   13  C   UNL     1       0.424  -0.595   0.170  1.00  0.00           C  
HETATM   14  C   UNL     1       1.393   0.412   0.250  1.00  0.00           C  
HETATM   15  C   UNL     1       2.714   0.114   0.000  1.00  0.00           C  
HETATM   16  C   UNL     1       3.086  -1.180  -0.330  1.00  0.00           C  
HETATM   17  C   UNL     1       2.133  -2.182  -0.411  1.00  0.00           C  
HETATM   18  C   UNL     1       0.807  -1.899  -0.158  1.00  0.00           C  
HETATM   19  S   UNL     1       3.935   1.380   0.099  1.00  0.00           S  
HETATM   20  O   UNL     1       4.713   1.282  -1.086  1.00  0.00           O  
HETATM   21 CL   UNL     1       4.753  -1.546  -0.644  1.00  0.00          Cl  
HETATM   22  O   UNL     1       3.253   2.566   0.485  1.00  0.00           O  
HETATM   23  N   UNL     1       4.944   0.992   1.354  1.00  0.00           N  
HETATM   24  H   UNL     1      -3.546  -1.233   2.778  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.252  -0.159  -2.156  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.126   0.999  -3.247  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.118   1.633  -1.953  1.00  0.00           H  
HETATM   28  H   UNL     1      -7.264   1.124   0.431  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.790  -2.156   1.075  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.035  -1.794  -0.650  1.00  0.00           H  
HETATM   31  H   UNL     1       1.104   1.421   0.507  1.00  0.00           H  
HETATM   32  H   UNL     1       2.429  -3.188  -0.669  1.00  0.00           H  
HETATM   33  H   UNL     1       0.066  -2.683  -0.218  1.00  0.00           H  
HETATM   34  H   UNL     1       4.788   0.185   1.869  1.00  0.00           H  
HETATM   35  H   UNL     1       5.690   1.571   1.574  1.00  0.00           H  
CONECT    1    5    2   10                                            
CONECT    2    1    3    3   24                                       
CONECT    3    2    2    4                                            
CONECT    4    3    9    9    5                                       
CONECT    5    1    4    6    6                                       
CONECT    6    5    5    7   25                                       
CONECT    7    6    8    8   26                                       
CONECT    8    7    7    9   27                                       
CONECT    9    4    4    8   28                                       
CONECT   10    1   11   29   30                                       
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   18   18   14                                       
CONECT   14   13   15   15   31                                       
CONECT   15   14   14   16   19                                       
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   32                                       
CONECT   18   13   13   17   33                                       
CONECT   19   15   23   22   22                                       
CONECT   19   20   20                                                 
CONECT   20   19   19                                                 
CONECT   21   16                                                      
CONECT   22   19   19                                                 
CONECT   23   19   34   35                                            
CONECT   24    2                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   14                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   23                                                      
CONECT   35   23                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
