COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.921   0.481   0.261  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.531   1.709  -0.242  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.194   1.978  -0.478  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.235   1.007  -0.209  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.632  -0.242   0.303  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.979  -0.494   0.540  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.802   1.272  -0.463  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.851   0.142  -0.469  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.250  -1.109   0.047  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.611  -1.274   0.590  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.571   0.302  -0.984  1.00  0.00           C  
HETATM   12  C   UNL     1       0.316  -0.772  -0.990  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.072  -2.008  -0.481  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.353  -2.181   0.045  1.00  0.00           C  
HETATM   15  O   UNL     1      -3.892  -2.251   1.258  1.00  0.00           O  
HETATM   16  O   UNL     1      -2.413   2.405  -0.666  1.00  0.00           O  
HETATM   17  O   UNL     1      -1.729  -3.386   0.540  1.00  0.00           O  
HETATM   18  O   UNL     1       0.801  -3.049  -0.492  1.00  0.00           O  
HETATM   19  N   UNL     1       1.597  -0.610  -1.514  1.00  0.00           N  
HETATM   20  S   UNL     1       2.399   0.825  -1.311  1.00  0.00           S  
HETATM   21  O   UNL     1       1.533   1.841  -1.797  1.00  0.00           O  
HETATM   22  C   UNL     1       2.558   1.093   0.423  1.00  0.00           C  
HETATM   23  O   UNL     1       3.715   0.623  -1.809  1.00  0.00           O  
HETATM   24  C   UNL     1       3.305   0.216   1.195  1.00  0.00           C  
HETATM   25  C   UNL     1       3.429   0.430   2.560  1.00  0.00           C  
HETATM   26  C   UNL     1       2.808   1.515   3.147  1.00  0.00           C  
HETATM   27  C   UNL     1       2.064   2.388   2.375  1.00  0.00           C  
HETATM   28  C   UNL     1       1.944   2.181   1.013  1.00  0.00           C  
HETATM   29  O   UNL     1       3.915  -0.852   0.616  1.00  0.00           O  
HETATM   30  C   UNL     1       5.128  -0.644   0.079  1.00  0.00           C  
HETATM   31  C   UNL     1       5.816  -1.750  -0.680  1.00  0.00           C  
HETATM   32  O   UNL     1       5.667   0.430   0.203  1.00  0.00           O  
HETATM   33  H   UNL     1      -7.967   0.283   0.441  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.275   2.463  -0.451  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.896   2.939  -0.871  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.290  -1.451   0.933  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.263   1.258  -1.380  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.542  -3.500   1.482  1.00  0.00           H  
HETATM   39  H   UNL     1       1.346  -3.113   0.304  1.00  0.00           H  
HETATM   40  H   UNL     1       2.019  -1.337  -1.997  1.00  0.00           H  
HETATM   41  H   UNL     1       4.009  -0.252   3.164  1.00  0.00           H  
HETATM   42  H   UNL     1       2.903   1.682   4.210  1.00  0.00           H  
HETATM   43  H   UNL     1       1.579   3.236   2.835  1.00  0.00           H  
HETATM   44  H   UNL     1       1.366   2.866   0.412  1.00  0.00           H  
HETATM   45  H   UNL     1       5.613  -1.641  -1.745  1.00  0.00           H  
HETATM   46  H   UNL     1       6.891  -1.694  -0.507  1.00  0.00           H  
HETATM   47  H   UNL     1       5.442  -2.714  -0.335  1.00  0.00           H  
CONECT    1    6    6    2   33                                       
CONECT    2    3    3    1   34                                       
CONECT    3    4    2    2   35                                       
CONECT    4    7    5    5    3                                       
CONECT    5   10    4    4    6                                       
CONECT    6    5    1    1   36                                       
CONECT    7    8   16   16    4                                       
CONECT    8   11   11    9    7                                       
CONECT    9   14   14    8   10                                       
CONECT   10    9   15   15    5                                       
CONECT   11   12    8    8   37                                       
CONECT   12   19   13   13   11                                       
CONECT   13   18   12   12   14                                       
CONECT   14   13   17    9    9                                       
CONECT   15   10   10                                                 
CONECT   16    7    7                                                 
CONECT   17   14   38                                                 
CONECT   18   13   39                                                 
CONECT   19   20   12   40                                            
CONECT   20   23   23   21   21                                       
CONECT   20   19   22                                                 
CONECT   21   20   20                                                 
CONECT   22   20   24   24   28                                       
CONECT   23   20   20                                                 
CONECT   24   29   22   22   25                                       
CONECT   25   24   26   26   41                                       
CONECT   26   25   25   27   42                                       
CONECT   27   28   28   26   43                                       
CONECT   28   22   27   27   44                                       
CONECT   29   24   30                                                 
CONECT   30   31   29   32   32                                       
CONECT   31   30   45   46   47                                       
CONECT   32   30   30                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    6                                                      
CONECT   37   11                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   28                                                      
CONECT   45   31                                                      
CONECT   46   31                                                      
CONECT   47   31                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
