COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.078   0.211  -0.872  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.219  -0.768  -0.192  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.800  -0.261  -0.170  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.576   0.921  -0.327  1.00  0.00           O  
HETATM    5  C   UNL     1      -5.711  -0.969   1.242  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.255   3.343  -0.318  1.00  0.00           C  
HETATM    7  C   UNL     1       5.177  -0.130   0.477  1.00  0.00           C  
HETATM    8  C   UNL     1       3.102   0.577   1.189  1.00  0.00           C  
HETATM    9  C   UNL     1       3.234  -1.020  -0.611  1.00  0.00           C  
HETATM   10  C   UNL     1       0.689   2.172  -0.221  1.00  0.00           C  
HETATM   11  C   UNL     1       4.617  -0.960  -0.488  1.00  0.00           C  
HETATM   12  C   UNL     1       2.459  -0.227   0.243  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.474  -0.654   0.043  1.00  0.00           C  
HETATM   14  C   UNL     1       0.177   0.860  -0.066  1.00  0.00           C  
HETATM   15  C   UNL     1       0.986  -0.239   0.147  1.00  0.00           C  
HETATM   16  N   UNL     1       5.436  -1.725  -1.323  1.00  0.00           N  
HETATM   17  N   UNL     1       4.415   0.597   1.271  1.00  0.00           N  
HETATM   18  N   UNL     1      -1.127   0.581  -0.113  1.00  0.00           N  
HETATM   19  N   UNL     1      -2.780  -1.121   0.023  1.00  0.00           N  
HETATM   20  O   UNL     1       1.889   2.353  -0.277  1.00  0.00           O  
HETATM   21  S   UNL     1      -0.049  -1.659   0.278  1.00  0.00           S  
HETATM   22  H   UNL     1      -7.023  -0.134  -0.957  1.00  0.00           H  
HETATM   23  H   UNL     1      -6.060   1.100  -0.396  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.258  -1.717  -0.726  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.738  -1.336   1.226  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.074  -1.695   1.747  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.673  -0.019   1.776  1.00  0.00           H  
HETATM   28  H   UNL     1       0.318   4.263  -0.433  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.910   3.212  -1.179  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.856   3.400   0.590  1.00  0.00           H  
HETATM   31  H   UNL     1       6.251  -0.082   0.580  1.00  0.00           H  
HETATM   32  H   UNL     1       2.514   1.188   1.858  1.00  0.00           H  
HETATM   33  H   UNL     1       2.770  -1.653  -1.353  1.00  0.00           H  
HETATM   34  H   UNL     1       6.400  -1.678  -1.232  1.00  0.00           H  
HETATM   35  H   UNL     1       5.039  -2.302  -1.994  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.960  -2.066   0.148  1.00  0.00           H  
CONECT    1    2   22   23                                            
CONECT    2    5    3    1   24                                       
CONECT    3    4    4    2   19                                       
CONECT    4    3    3                                                 
CONECT    5    2   25   26   27                                       
CONECT    6   10   28   29   30                                       
CONECT    7   11   11   17   31                                       
CONECT    8   17   17   12   32                                       
CONECT    9   11   12   12   33                                       
CONECT   10   14    6   20   20                                       
CONECT   11   16    7    7    9                                       
CONECT   12    9    9    8   15                                       
CONECT   13   21   19   18   18                                       
CONECT   14   15   15   18   10                                       
CONECT   15   21   12   14   14                                       
CONECT   16   11   34   35                                            
CONECT   17    7    8    8                                            
CONECT   18   13   13   14                                            
CONECT   19    3   13   36                                            
CONECT   20   10   10                                                 
CONECT   21   15   13                                                 
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   19                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
