COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.117   0.597   0.373  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.324   1.447  -0.028  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.472  -1.110  -0.416  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.713  -0.302  -0.798  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.283  -0.164  -0.237  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.073  -0.954   0.265  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.727   2.345   1.143  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.958   2.315  -1.234  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.493   0.531  -0.395  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.159  -2.118  -1.524  1.00  0.00           C  
HETATM   11  C   UNL     1       0.148  -0.035   0.325  1.00  0.00           C  
HETATM   12  C   UNL     1       1.358  -0.825   0.827  1.00  0.00           C  
HETATM   13  C   UNL     1       0.442   0.515  -1.072  1.00  0.00           C  
HETATM   14  C   UNL     1       3.611  -0.395  -0.110  1.00  0.00           C  
HETATM   15  C   UNL     1       3.568  -1.939  -0.277  1.00  0.00           C  
HETATM   16  C   UNL     1       4.958   0.015   0.428  1.00  0.00           C  
HETATM   17  C   UNL     1       5.751   0.803  -0.294  1.00  0.00           C  
HETATM   18  C   UNL     1       7.003   1.312   0.284  1.00  0.00           C  
HETATM   19  C   UNL     1       5.366   1.172  -1.703  1.00  0.00           C  
HETATM   20  N   UNL     1       2.563   0.025   0.825  1.00  0.00           N  
HETATM   21  O   UNL     1      -5.459  -0.214   1.500  1.00  0.00           O  
HETATM   22  O   UNL     1      -1.347  -1.468   1.570  1.00  0.00           O  
HETATM   23  O   UNL     1       7.314   1.014   1.420  1.00  0.00           O  
HETATM   24  S   UNL     1       1.745  -2.200  -0.327  1.00  0.00           S  
HETATM   25  H   UNL     1      -4.284   1.249   0.635  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.657  -1.641   0.517  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.532  -0.982  -1.032  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.492   0.315  -1.669  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.041   0.302  -1.193  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.539   0.608   0.488  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.871  -1.782  -0.416  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.894   2.998   1.404  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.587   2.951   0.857  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.988   1.727   2.002  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.670   1.674  -2.068  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.818   2.920  -1.520  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.124   2.967  -0.973  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.754  -0.087   0.464  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.353   1.137  -0.681  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.206  -0.109  -1.229  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.340  -2.763  -1.207  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.043  -2.724  -1.723  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.872  -1.585  -2.430  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.053   0.793   1.006  1.00  0.00           H  
HETATM   45  H   UNL     1       1.168  -1.213   1.828  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.420   1.078  -1.430  1.00  0.00           H  
HETATM   47  H   UNL     1       1.312   1.170  -1.030  1.00  0.00           H  
HETATM   48  H   UNL     1       0.644  -0.312  -1.753  1.00  0.00           H  
HETATM   49  H   UNL     1       3.447   0.080  -1.077  1.00  0.00           H  
HETATM   50  H   UNL     1       4.039  -2.250  -1.210  1.00  0.00           H  
HETATM   51  H   UNL     1       4.018  -2.443   0.578  1.00  0.00           H  
HETATM   52  H   UNL     1       5.279  -0.331   1.400  1.00  0.00           H  
HETATM   53  H   UNL     1       4.705   2.039  -1.683  1.00  0.00           H  
HETATM   54  H   UNL     1       6.263   1.412  -2.274  1.00  0.00           H  
HETATM   55  H   UNL     1       4.851   0.333  -2.171  1.00  0.00           H  
HETATM   56  H   UNL     1       2.932   0.132   1.758  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.194  -0.820   1.339  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.536  -0.786   2.229  1.00  0.00           H  
HETATM   59  O   UNL     1       7.807   2.110  -0.448  1.00  0.00           O  
HETATM   60  H   UNL     1       8.620   2.420  -0.025  1.00  0.00           H  
CONECT    1   21    2    4   25                                       
CONECT    2    8    1    7    9                                       
CONECT    3    5   10    4   26                                       
CONECT    4    1    3   27   28                                       
CONECT    5    6    3   29   30                                       
CONECT    6   11    5   22   31                                       
CONECT    7    2   32   33   34                                       
CONECT    8    2   35   36   37                                       
CONECT    9    2   38   39   40                                       
CONECT   10    3   41   42   43                                       
CONECT   11   13   12    6   44                                       
CONECT   12   20   11   24   45                                       
CONECT   13   11   46   47   48                                       
CONECT   14   20   15   16   49                                       
CONECT   15   14   24   50   51                                       
CONECT   16   14   17   17   52                                       
CONECT   17   19   16   16   18                                       
CONECT   18   17   23   23   59                                       
CONECT   19   17   53   54   55                                       
CONECT   20   14   12   56                                            
CONECT   21    1   57                                                 
CONECT   22    6   58                                                 
CONECT   23   18   18                                                 
CONECT   24   15   12                                                 
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   18   60                                                 
CONECT   60   59                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
