COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -1.287   3.254  -0.155  1.00  0.00           S  
HETATM    2  C   UNL     1      -0.668   1.652   0.429  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.545   0.530  -0.134  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.901   0.679   0.363  1.00  0.00           O  
HETATM    5  C   UNL     1      -0.981  -0.822   0.313  1.00  0.00           C  
HETATM    6  O   UNL     1      -1.764  -1.893  -0.275  1.00  0.00           O  
HETATM    7  C   UNL     1       0.474  -0.934  -0.150  1.00  0.00           C  
HETATM    8  O   UNL     1       1.042  -2.180   0.332  1.00  0.00           O  
HETATM    9  C   UNL     1       1.273   0.244   0.414  1.00  0.00           C  
HETATM   10  O   UNL     1       0.678   1.470  -0.015  1.00  0.00           O  
HETATM   11  C   UNL     1       2.715   0.172  -0.094  1.00  0.00           C  
HETATM   12  O   UNL     1       3.502   1.219   0.533  1.00  0.00           O  
HETATM   13  C   UNL     1       5.677   2.355   0.803  1.00  0.00           C  
HETATM   14  C   UNL     1       2.637  -4.039   0.017  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.164   1.625   0.082  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.821  -2.333   0.427  1.00  0.00           C  
HETATM   17  O   UNL     1       5.260   0.510  -0.602  1.00  0.00           O  
HETATM   18  O   UNL     1       2.354  -2.214  -1.446  1.00  0.00           O  
HETATM   19  O   UNL     1      -3.355   1.939  -1.395  1.00  0.00           O  
HETATM   20  O   UNL     1      -3.083  -1.838   1.497  1.00  0.00           O  
HETATM   21  C   UNL     1       4.798   1.294   0.193  1.00  0.00           C  
HETATM   22  C   UNL     1       2.001  -2.744  -0.419  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.741   1.426  -0.371  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.680  -3.443  -0.121  1.00  0.00           C  
HETATM   25  H   UNL     1      -0.435   4.130   0.408  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.698   1.625   1.518  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.549   0.582  -1.223  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.025  -0.893   1.400  1.00  0.00           H  
HETATM   29  H   UNL     1       0.512  -0.914  -1.239  1.00  0.00           H  
HETATM   30  H   UNL     1       1.269   0.199   1.503  1.00  0.00           H  
HETATM   31  H   UNL     1       3.140  -0.800   0.156  1.00  0.00           H  
HETATM   32  H   UNL     1       2.727   0.306  -1.175  1.00  0.00           H  
HETATM   33  H   UNL     1       6.689   2.259   0.409  1.00  0.00           H  
HETATM   34  H   UNL     1       5.283   3.340   0.554  1.00  0.00           H  
HETATM   35  H   UNL     1       5.696   2.233   1.886  1.00  0.00           H  
HETATM   36  H   UNL     1       2.076  -4.877  -0.395  1.00  0.00           H  
HETATM   37  H   UNL     1       3.665  -4.078  -0.343  1.00  0.00           H  
HETATM   38  H   UNL     1       2.631  -4.097   1.106  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.326   1.092   1.019  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.352   2.688   0.233  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.845   1.240  -0.677  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.289  -4.404   0.214  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.702  -3.322   0.238  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.671  -3.406  -1.210  1.00  0.00           H  
CONECT    1    2   25                                                 
CONECT    2    1   10    3   26                                       
CONECT    3    2    5    4   27                                       
CONECT    4    3   23                                                 
CONECT    5    3    6    7   28                                       
CONECT    6    5   16                                                 
CONECT    7    5    9    8   29                                       
CONECT    8    7   22                                                 
CONECT    9    7   11   10   30                                       
CONECT   10    2    9                                                 
CONECT   11    9   12   31   32                                       
CONECT   12   11   21                                                 
CONECT   13   21   33   34   35                                       
CONECT   14   22   36   37   38                                       
CONECT   15   23   39   40   41                                       
CONECT   16    6   24   20   20                                       
CONECT   17   21   21                                                 
CONECT   18   22   22                                                 
CONECT   19   23   23                                                 
CONECT   20   16   16                                                 
CONECT   21   12   13   17   17                                       
CONECT   22    8   14   18   18                                       
CONECT   23    4   15   19   19                                       
CONECT   24   16   42   43   44                                       
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
