COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.324  -3.666   0.451  1.00  0.00           O  
HETATM    2  C   UNL     1       2.176  -3.434   0.137  1.00  0.00           C  
HETATM    3  N   UNL     1       1.365  -4.442  -0.244  1.00  0.00           N  
HETATM    4  C   UNL     1       1.654  -2.021   0.178  1.00  0.00           C  
HETATM    5  C   UNL     1       0.959  -1.773   1.518  1.00  0.00           C  
HETATM    6  S   UNL     1       3.032  -0.863  -0.011  1.00  0.00           S  
HETATM    7  C   UNL     1       2.146   0.658  -0.079  1.00  0.00           C  
HETATM    8  N   UNL     1       0.835   0.636   0.011  1.00  0.00           N  
HETATM    9  C   UNL     1       0.117   1.766  -0.036  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.216   2.043   0.030  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.381   3.429  -0.075  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.215   4.000  -0.201  1.00  0.00           C  
HETATM   13  C   UNL     1       0.776   2.998  -0.183  1.00  0.00           C  
HETATM   14  C   UNL     1       2.191   3.006  -0.278  1.00  0.00           C  
HETATM   15  O   UNL     1       2.803   4.052  -0.405  1.00  0.00           O  
HETATM   16  N   UNL     1       2.843   1.824  -0.217  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.243   1.102   0.176  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.130  -0.149  -0.415  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.374   1.418   0.918  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.385   0.488   1.062  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.274  -0.756   0.468  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.146  -1.075  -0.268  1.00  0.00           C  
HETATM   23 CL   UNL     1      -3.007  -2.640  -1.006  1.00  0.00          Cl  
HETATM   24  H   UNL     1       1.700  -5.352  -0.267  1.00  0.00           H  
HETATM   25  H   UNL     1       0.447  -4.256  -0.496  1.00  0.00           H  
HETATM   26  H   UNL     1       0.942  -1.873  -0.634  1.00  0.00           H  
HETATM   27  H   UNL     1       1.672  -1.921   2.330  1.00  0.00           H  
HETATM   28  H   UNL     1       0.582  -0.751   1.548  1.00  0.00           H  
HETATM   29  H   UNL     1       0.129  -2.471   1.632  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.039   5.061  -0.301  1.00  0.00           H  
HETATM   31  H   UNL     1       3.811   1.803  -0.279  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.250  -0.398  -0.989  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.462   2.388   1.383  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.265   0.734   1.639  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.066  -1.480   0.583  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4    3    1    1                                       
CONECT    3    2   24   25                                            
CONECT    4    6    5    2   26                                       
CONECT    5    4   27   28   29                                       
CONECT    6    7    4                                                 
CONECT    7   16    8    8    6                                       
CONECT    8    9    7    7                                            
CONECT    9   13   13   10    8                                       
CONECT   10   11    9   17                                            
CONECT   11   12   12   10                                            
CONECT   12   13   11   11   30                                       
CONECT   13   12   14    9    9                                       
CONECT   14   15   15   13   16                                       
CONECT   15   14   14                                                 
CONECT   16   14    7   31                                            
CONECT   17   10   18   18   19                                       
CONECT   18   17   17   22   32                                       
CONECT   19   17   20   20   33                                       
CONECT   20   19   19   21   34                                       
CONECT   21   22   22   20   35                                       
CONECT   22   18   23   21   21                                       
CONECT   23   22                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30   12                                                      
CONECT   31   16                                                      
CONECT   32   18                                                      
CONECT   33   19                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
