COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.307  -3.058   2.236  1.00  0.00           O  
HETATM    2  C   UNL     1       0.759  -2.162   1.564  1.00  0.00           C  
HETATM    3  C   UNL     1       1.309  -0.926   2.228  1.00  0.00           C  
HETATM    4  C   UNL     1       2.785  -0.762   1.858  1.00  0.00           C  
HETATM    5  C   UNL     1       3.343   0.492   2.531  1.00  0.00           C  
HETATM    6  C   UNL     1       0.526   0.298   1.753  1.00  0.00           C  
HETATM    7  N   UNL     1       0.485   0.328   0.284  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.924   0.238  -0.149  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.742   0.771   1.053  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.931   0.215   2.253  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.120   1.051   3.442  1.00  0.00           N  
HETATM   12  S   UNL     1      -1.612   0.365   4.866  1.00  0.00           S  
HETATM   13  O   UNL     1      -2.823  -0.284   4.501  1.00  0.00           O  
HETATM   14  O   UNL     1      -1.586   1.461   5.770  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.296  -0.829   5.226  1.00  0.00           C  
HETATM   16  C   UNL     1       1.554   0.419  -0.532  1.00  0.00           C  
HETATM   17  O   UNL     1       2.604   0.853  -0.110  1.00  0.00           O  
HETATM   18  C   UNL     1       1.442  -0.017  -1.970  1.00  0.00           C  
HETATM   19  C   UNL     1       2.709   0.389  -2.726  1.00  0.00           C  
HETATM   20  C   UNL     1       2.915   1.900  -2.599  1.00  0.00           C  
HETATM   21  C   UNL     1       3.914  -0.341  -2.132  1.00  0.00           C  
HETATM   22  N   UNL     1       0.278   0.624  -2.587  1.00  0.00           N  
HETATM   23  C   UNL     1      -0.386   0.001  -3.580  1.00  0.00           C  
HETATM   24  O   UNL     1      -0.019  -1.091  -3.965  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.455   0.591  -4.147  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.172  -0.079  -5.217  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.336   0.798  -5.680  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.221  -0.326  -6.390  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.712  -1.417  -4.709  1.00  0.00           C  
HETATM   30  H   UNL     1       0.769  -2.247   0.487  1.00  0.00           H  
HETATM   31  H   UNL     1       1.214  -1.022   3.309  1.00  0.00           H  
HETATM   32  H   UNL     1       2.880  -0.667   0.776  1.00  0.00           H  
HETATM   33  H   UNL     1       3.343  -1.635   2.197  1.00  0.00           H  
HETATM   34  H   UNL     1       4.394   0.609   2.268  1.00  0.00           H  
HETATM   35  H   UNL     1       2.785   1.365   2.193  1.00  0.00           H  
HETATM   36  H   UNL     1       3.248   0.397   3.613  1.00  0.00           H  
HETATM   37  H   UNL     1       0.995   1.207   2.129  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.191  -0.796  -0.361  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.090   0.862  -1.027  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.755   0.367   1.045  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.758   1.861   1.063  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.209  -0.817   2.461  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.956   2.006   3.394  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.520  -1.347   6.159  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.230  -1.554   4.415  1.00  0.00           H  
HETATM   46  H   UNL     1       0.654  -0.304   5.322  1.00  0.00           H  
HETATM   47  H   UNL     1       1.326  -1.100  -2.013  1.00  0.00           H  
HETATM   48  H   UNL     1       2.605   0.124  -3.778  1.00  0.00           H  
HETATM   49  H   UNL     1       3.817   2.190  -3.138  1.00  0.00           H  
HETATM   50  H   UNL     1       2.056   2.421  -3.023  1.00  0.00           H  
HETATM   51  H   UNL     1       3.019   2.165  -1.547  1.00  0.00           H  
HETATM   52  H   UNL     1       3.968  -0.143  -1.062  1.00  0.00           H  
HETATM   53  H   UNL     1       3.807  -1.413  -2.299  1.00  0.00           H  
HETATM   54  H   UNL     1       4.826   0.011  -2.614  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.013   1.496  -2.280  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.873   0.295  -6.484  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.013   0.974  -4.844  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.950   1.752  -6.042  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.836   0.627  -6.752  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.391  -0.951  -6.061  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.759  -0.829  -7.194  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.390  -1.241  -3.873  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.250  -1.920  -5.513  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.883  -2.042  -4.379  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   30                                       
CONECT    3    2    4    6   31                                       
CONECT    4    3    5   32   33                                       
CONECT    5    4   34   35   36                                       
CONECT    6    3    7   10   37                                       
CONECT    7    6    8   16                                            
CONECT    8    7    9   38   39                                       
CONECT    9    8   10   40   41                                       
CONECT   10    6    9   11   42                                       
CONECT   11   10   12   43                                            
CONECT   12   11   13   13   14                                       
CONECT   12   14   15                                                 
CONECT   13   12   12                                                 
CONECT   14   12   12                                                 
CONECT   15   12   44   45   46                                       
CONECT   16    7   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   22   47                                       
CONECT   19   18   20   21   48                                       
CONECT   20   19   49   50   51                                       
CONECT   21   19   52   53   54                                       
CONECT   22   18   23   55                                            
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26                                                 
CONECT   26   25   27   28   29                                       
CONECT   27   26   56   57   58                                       
CONECT   28   26   59   60   61                                       
CONECT   29   26   62   63   64                                       
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   29                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
