COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.747  -1.022   1.032  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.751  -0.079   1.102  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.500   0.225  -0.021  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.247  -0.415  -1.222  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.246  -1.361  -1.305  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.484  -1.667  -0.177  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.409  -2.680  -0.260  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.631  -3.760  -0.770  1.00  0.00           O  
HETATM    9  N   UNL     1       0.815  -2.405   0.231  1.00  0.00           N  
HETATM   10  C   UNL     1       1.082  -1.137   0.927  1.00  0.00           C  
HETATM   11  C   UNL     1       2.323  -0.490   0.302  1.00  0.00           C  
HETATM   12  N   UNL     1       3.433  -1.453   0.317  1.00  0.00           N  
HETATM   13  C   UNL     1       3.128  -2.630  -0.507  1.00  0.00           C  
HETATM   14  C   UNL     1       1.918  -3.367   0.091  1.00  0.00           C  
HETATM   15  S   UNL     1      -4.780   1.431   0.077  1.00  0.00           S  
HETATM   16  O   UNL     1      -5.687   1.141  -0.978  1.00  0.00           O  
HETATM   17  O   UNL     1      -5.171   1.491   1.442  1.00  0.00           O  
HETATM   18  N   UNL     1      -4.101   2.898  -0.279  1.00  0.00           N  
HETATM   19  C   UNL     1       2.712   0.751   1.107  1.00  0.00           C  
HETATM   20  C   UNL     1       3.856   1.455   0.422  1.00  0.00           C  
HETATM   21  C   UNL     1       3.600   2.432  -0.522  1.00  0.00           C  
HETATM   22  C   UNL     1       4.649   3.078  -1.150  1.00  0.00           C  
HETATM   23  C   UNL     1       5.953   2.747  -0.833  1.00  0.00           C  
HETATM   24  C   UNL     1       6.209   1.771   0.112  1.00  0.00           C  
HETATM   25  C   UNL     1       5.160   1.129   0.743  1.00  0.00           C  
HETATM   26  H   UNL     1      -1.164  -1.258   1.910  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.954   0.424   2.037  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.834  -0.173  -2.095  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.047  -1.856  -2.244  1.00  0.00           H  
HETATM   30  H   UNL     1       0.227  -0.470   0.816  1.00  0.00           H  
HETATM   31  H   UNL     1       1.260  -1.330   1.985  1.00  0.00           H  
HETATM   32  H   UNL     1       2.104  -0.203  -0.727  1.00  0.00           H  
HETATM   33  H   UNL     1       4.293  -1.017   0.020  1.00  0.00           H  
HETATM   34  H   UNL     1       2.898  -2.314  -1.524  1.00  0.00           H  
HETATM   35  H   UNL     1       3.989  -3.298  -0.519  1.00  0.00           H  
HETATM   36  H   UNL     1       2.183  -3.774   1.067  1.00  0.00           H  
HETATM   37  H   UNL     1       1.615  -4.174  -0.576  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.155   2.957  -0.489  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.648   3.699  -0.279  1.00  0.00           H  
HETATM   40  H   UNL     1       1.858   1.425   1.172  1.00  0.00           H  
HETATM   41  H   UNL     1       3.017   0.453   2.110  1.00  0.00           H  
HETATM   42  H   UNL     1       2.581   2.690  -0.770  1.00  0.00           H  
HETATM   43  H   UNL     1       4.449   3.840  -1.888  1.00  0.00           H  
HETATM   44  H   UNL     1       6.773   3.251  -1.323  1.00  0.00           H  
HETATM   45  H   UNL     1       7.228   1.513   0.360  1.00  0.00           H  
HETATM   46  H   UNL     1       5.359   0.369   1.485  1.00  0.00           H  
CONECT    1    6    2    2   26                                       
CONECT    2    1    1    3   27                                       
CONECT    3    4    4    2   15                                       
CONECT    4    5    3    3   28                                       
CONECT    5    6    6    4   29                                       
CONECT    6    7    5    5    1                                       
CONECT    7    9    8    8    6                                       
CONECT    8    7    7                                                 
CONECT    9   10   14    7                                            
CONECT   10   11    9   30   31                                       
CONECT   11   12   19   10   32                                       
CONECT   12   11   13   33                                            
CONECT   13   12   14   34   35                                       
CONECT   14   13    9   36   37                                       
CONECT   15    3   18   17   17                                       
CONECT   15   16   16                                                 
CONECT   16   15   15                                                 
CONECT   17   15   15                                                 
CONECT   18   15   38   39                                            
CONECT   19   11   20   40   41                                       
CONECT   20   19   21   21   25                                       
CONECT   21   20   20   22   42                                       
CONECT   22   21   23   23   43                                       
CONECT   23   22   22   24   44                                       
CONECT   24   25   25   23   45                                       
CONECT   25   20   24   24   46                                       
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
