COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.753   1.698   0.713  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.122   0.969  -0.395  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.242  -0.094   0.107  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.605  -0.829  -1.074  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.702  -1.921  -0.559  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.207  -3.199  -0.338  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.511  -3.495  -0.577  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.988  -4.684  -0.373  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.239  -5.721   0.089  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.925  -5.554   0.366  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.351  -4.219   0.146  1.00  0.00           C  
HETATM   12  C   UNL     1       0.988  -3.951   0.402  1.00  0.00           C  
HETATM   13  C   UNL     1       1.485  -2.670   0.179  1.00  0.00           C  
HETATM   14  C   UNL     1       0.632  -1.658  -0.309  1.00  0.00           C  
HETATM   15  N   UNL     1       1.414  -0.521  -0.422  1.00  0.00           N  
HETATM   16  C   UNL     1       2.676  -0.852  -0.015  1.00  0.00           C  
HETATM   17  N   UNL     1       2.717  -2.113   0.332  1.00  0.00           N  
HETATM   18  N   UNL     1       3.748   0.013   0.019  1.00  0.00           N  
HETATM   19  C   UNL     1       3.579   1.406  -0.402  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.245  -6.474   0.781  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.660   2.795   0.152  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.412   3.472   1.300  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.318   4.569   0.738  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.468   5.607   0.004  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.716   4.930  -1.144  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.809   3.833  -0.583  1.00  0.00           C  
HETATM   27  S   UNL     1       5.438   2.989   1.166  1.00  0.00           S  
HETATM   28  C   UNL     1       6.938   3.439   0.365  1.00  0.00           C  
HETATM   29  C   UNL     1       6.948   2.947  -0.875  1.00  0.00           C  
HETATM   30  C   UNL     1       5.819   2.227  -1.226  1.00  0.00           C  
HETATM   31  C   UNL     1       4.892   2.134  -0.271  1.00  0.00           C  
HETATM   32  H   UNL     1      -4.347   1.007   1.311  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.981   2.148   1.338  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.817   0.596  -1.025  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.460   0.343   0.727  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.826  -0.798   0.701  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.387  -1.267  -1.694  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.022  -0.126  -1.668  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.033  -4.860  -0.581  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.651  -6.589   0.222  1.00  0.00           H  
HETATM   41  H   UNL     1       1.638  -4.730   0.772  1.00  0.00           H  
HETATM   42  H   UNL     1       1.120   0.350  -0.732  1.00  0.00           H  
HETATM   43  H   UNL     1       4.615  -0.300   0.321  1.00  0.00           H  
HETATM   44  H   UNL     1       3.251   1.435  -1.441  1.00  0.00           H  
HETATM   45  H   UNL     1       2.832   1.888   0.228  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.376   2.355  -0.542  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.017   2.732   1.823  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.696   3.912   1.994  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.035   4.129   0.045  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.854   5.051   1.556  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.114   6.389  -0.396  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.752   6.047   0.697  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.432   4.490  -1.838  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.110   5.670  -1.668  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.093   4.273   0.111  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.274   3.351  -1.401  1.00  0.00           H  
HETATM   57  H   UNL     1       7.730   4.024   0.809  1.00  0.00           H  
HETATM   58  H   UNL     1       7.774   3.100  -1.554  1.00  0.00           H  
HETATM   59  H   UNL     1       5.697   1.776  -2.199  1.00  0.00           H  
CONECT    1   21    2   32   33                                       
CONECT    2    1    3   34                                            
CONECT    3    2    4   35   36                                       
CONECT    4    3    5   37   38                                       
CONECT    5   14    4    6    6                                       
CONECT    6    5    5   11    7                                       
CONECT    7    6    8    8                                            
CONECT    8    7    7    9   39                                       
CONECT    9   10    8   40                                            
CONECT   10   11   20   20    9                                       
CONECT   11   12   12    6   10                                       
CONECT   12   13   11   11   41                                       
CONECT   13   17   14   14   12                                       
CONECT   14   15   13   13    5                                       
CONECT   15   16   14   42                                            
CONECT   16   18   15   17   17                                       
CONECT   17   16   16   13                                            
CONECT   18   19   16   43                                            
CONECT   19   31   18   44   45                                       
CONECT   20   10   10                                                 
CONECT   21   26   22    1   46                                       
CONECT   22   21   23   47   48                                       
CONECT   23   24   22   49   50                                       
CONECT   24   25   23   51   52                                       
CONECT   25   26   24   53   54                                       
CONECT   26   25   21   55   56                                       
CONECT   27   28   31                                                 
CONECT   28   29   29   27   57                                       
CONECT   29   28   28   30   58                                       
CONECT   30   29   31   31   59                                       
CONECT   31   30   30   27   19                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   26                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
