COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.450  -2.248   1.067  1.00  0.00           C  
HETATM    2  C   UNL     1       0.306   3.211   0.521  1.00  0.00           C  
HETATM    3  C   UNL     1       3.905   2.166   0.036  1.00  0.00           C  
HETATM    4  C   UNL     1       5.186   4.162   0.199  1.00  0.00           C  
HETATM    5  C   UNL     1       4.749  -2.103   0.797  1.00  0.00           C  
HETATM    6  C   UNL     1       2.536   0.198  -0.129  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.170  -1.783   1.451  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.269  -1.397  -0.026  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.552   0.036  -0.139  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.544   0.928  -0.081  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.786   2.121  -0.087  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.149   0.461  -0.012  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.768  -0.798   0.107  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.428  -0.861   0.145  1.00  0.00           C  
HETATM   15  C   UNL     1       0.386  -2.088   0.253  1.00  0.00           C  
HETATM   16  C   UNL     1       2.052  -3.488   0.992  1.00  0.00           C  
HETATM   17  C   UNL     1       1.490  -4.338   0.128  1.00  0.00           C  
HETATM   18  S   UNL     1       0.118  -3.569  -0.658  1.00  0.00           S  
HETATM   19  C   UNL     1       0.048   0.428   0.065  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.049   1.254  -0.061  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.921   2.700  -0.230  1.00  0.00           C  
HETATM   22  C   UNL     1       1.527   2.369   0.270  1.00  0.00           C  
HETATM   23  C   UNL     1       2.779   2.948   0.242  1.00  0.00           C  
HETATM   24  O   UNL     1       5.134   2.747   0.008  1.00  0.00           O  
HETATM   25  C   UNL     1       3.787   0.789  -0.144  1.00  0.00           C  
HETATM   26  O   UNL     1       4.899   0.028  -0.334  1.00  0.00           O  
HETATM   27  C   UNL     1       4.699  -1.371  -0.546  1.00  0.00           C  
HETATM   28  C   UNL     1       5.800  -1.910  -1.462  1.00  0.00           C  
HETATM   29  C   UNL     1       1.407   0.986   0.066  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.931   0.499  -0.313  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.947   2.025  -0.416  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.514  -0.105  -1.592  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.772   0.060   0.887  1.00  0.00           C  
HETATM   34  H   UNL     1       1.806  -1.466   1.721  1.00  0.00           H  
HETATM   35  H   UNL     1       0.512   4.234   0.206  1.00  0.00           H  
HETATM   36  H   UNL     1       0.090   3.209   1.589  1.00  0.00           H  
HETATM   37  H   UNL     1       6.223   4.496   0.154  1.00  0.00           H  
HETATM   38  H   UNL     1       4.611   4.656  -0.585  1.00  0.00           H  
HETATM   39  H   UNL     1       4.765   4.414   1.172  1.00  0.00           H  
HETATM   40  H   UNL     1       3.964  -1.719   1.449  1.00  0.00           H  
HETATM   41  H   UNL     1       4.596  -3.170   0.635  1.00  0.00           H  
HETATM   42  H   UNL     1       5.721  -1.941   1.263  1.00  0.00           H  
HETATM   43  H   UNL     1       2.437  -0.869  -0.269  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.366  -1.216   1.922  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.113  -1.559   1.949  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.959  -2.849   1.535  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.326  -1.621  -0.524  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.072  -1.964  -0.497  1.00  0.00           H  
HETATM   49  H   UNL     1       2.913  -3.751   1.587  1.00  0.00           H  
HETATM   50  H   UNL     1       1.828  -5.347  -0.059  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.813   3.190   0.159  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.818   2.932  -1.291  1.00  0.00           H  
HETATM   53  H   UNL     1       2.882   4.014   0.382  1.00  0.00           H  
HETATM   54  H   UNL     1       3.727  -1.533  -1.012  1.00  0.00           H  
HETATM   55  H   UNL     1       5.648  -2.977  -1.623  1.00  0.00           H  
HETATM   56  H   UNL     1       5.765  -1.389  -2.418  1.00  0.00           H  
HETATM   57  H   UNL     1       6.772  -1.748  -0.995  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.532   2.455   0.495  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.348   2.338  -1.271  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.973   2.369  -0.546  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.540   0.239  -1.722  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.914   0.207  -2.447  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.502  -1.193  -1.519  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.798   0.404   0.757  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.760  -1.028   0.961  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.357   0.490   1.799  1.00  0.00           H  
CONECT    1   16   15   15   34                                       
CONECT    2   21   22   35   36                                       
CONECT    3   25   23   23   24                                       
CONECT    4   24   37   38   39                                       
CONECT    5   27   40   41   42                                       
CONECT    6   29   25   25   43                                       
CONECT    7    8   44   45   46                                       
CONECT    8    7    9   47   48                                       
CONECT    9    8   30   10                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   13   20                                       
CONECT   13   12   12   14                                            
CONECT   14   13   15   19   19                                       
CONECT   15    1    1   14   18                                       
CONECT   16    1   17   17   49                                       
CONECT   17   16   16   18   50                                       
CONECT   18   15   17                                                 
CONECT   19   14   14   20   29                                       
CONECT   20   12   19   21                                            
CONECT   21   20    2   51   52                                       
CONECT   22    2   29   29   23                                       
CONECT   23   22    3    3   53                                       
CONECT   24    3    4                                                 
CONECT   25    6    6    3   26                                       
CONECT   26   27   25                                                 
CONECT   27   28    5   26   54                                       
CONECT   28   27   55   56   57                                       
CONECT   29   19   22   22    6                                       
CONECT   30   32   33   31    9                                       
CONECT   31   30   58   59   60                                       
CONECT   32   30   61   62   63                                       
CONECT   33   30   64   65   66                                       
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
CONECT   60   31                                                      
CONECT   61   32                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   33                                                      
CONECT   66   33                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
