COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.631   2.126   0.380  1.00  0.00           C  
HETATM    2  C   UNL     1       5.925   0.050  -0.498  1.00  0.00           C  
HETATM    3  C   UNL     1       5.817  -0.015  -1.875  1.00  0.00           C  
HETATM    4  C   UNL     1       4.584  -0.227  -2.466  1.00  0.00           C  
HETATM    5  C   UNL     1       3.457  -0.374  -1.681  1.00  0.00           C  
HETATM    6  C   UNL     1       3.563  -0.310  -0.298  1.00  0.00           C  
HETATM    7  C   UNL     1       1.424  -1.273   0.103  1.00  0.00           C  
HETATM    8  C   UNL     1       0.084  -0.444   1.961  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.575   0.829   1.496  1.00  0.00           C  
HETATM   10  C   UNL     1       0.203   1.897   1.086  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.393   3.065   0.659  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.785   3.168   0.642  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.431   4.417   0.185  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.382   5.686  -0.259  1.00  0.00           C  
HETATM   15  N   UNL     1       2.423  -0.459   0.500  1.00  0.00           N  
HETATM   16  N   UNL     1       0.283  -1.337   0.817  1.00  0.00           N  
HETATM   17  N   UNL     1      -3.775   4.514   0.170  1.00  0.00           N  
HETATM   18  N   UNL     1      -3.754   6.805  -0.687  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.784   7.706  -1.008  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.897   7.102  -0.765  1.00  0.00           N  
HETATM   21  N   UNL     1      -5.674   5.915  -0.331  1.00  0.00           N  
HETATM   22  O   UNL     1       8.428  -0.180  -0.701  1.00  0.00           O  
HETATM   23  O   UNL     1       7.378  -0.265   1.538  1.00  0.00           O  
HETATM   24  O   UNL     1       1.554  -1.950  -0.899  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.750   5.356  -0.177  1.00  0.00           O  
HETATM   26  S   UNL     1       7.497   0.322   0.249  1.00  0.00           S  
HETATM   27  C   UNL     1      -2.565   2.087   1.057  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.955   0.923   1.477  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.712  -2.256   0.465  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.007  -3.319   1.309  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.989  -4.225   0.959  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.678  -4.074  -0.230  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.745  -5.068  -0.612  1.00  0.00           C  
HETATM   34  C   UNL     1      -3.130  -6.465  -0.709  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.213  -7.474  -1.097  1.00  0.00           C  
HETATM   36  C   UNL     1      -5.314  -7.474  -0.034  1.00  0.00           C  
HETATM   37  C   UNL     1      -5.929  -6.076   0.063  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.846  -5.068   0.450  1.00  0.00           C  
HETATM   39  C   UNL     1      -2.386  -3.017  -1.073  1.00  0.00           C  
HETATM   40  C   UNL     1      -1.410  -2.105  -0.726  1.00  0.00           C  
HETATM   41  C   UNL     1       4.801  -0.091   0.292  1.00  0.00           C  
HETATM   42  H   UNL     1       6.817   2.507   0.997  1.00  0.00           H  
HETATM   43  H   UNL     1       8.585   2.387   0.837  1.00  0.00           H  
HETATM   44  H   UNL     1       7.571   2.568  -0.614  1.00  0.00           H  
HETATM   45  H   UNL     1       6.696   0.101  -2.491  1.00  0.00           H  
HETATM   46  H   UNL     1       4.503  -0.277  -3.542  1.00  0.00           H  
HETATM   47  H   UNL     1       2.495  -0.539  -2.143  1.00  0.00           H  
HETATM   48  H   UNL     1       1.048  -0.211   2.412  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.553  -0.934   2.698  1.00  0.00           H  
HETATM   50  H   UNL     1       1.280   1.815   1.099  1.00  0.00           H  
HETATM   51  H   UNL     1       0.215   3.898   0.339  1.00  0.00           H  
HETATM   52  H   UNL     1       2.351   0.023   1.338  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.319   3.764   0.458  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.798   6.954  -0.757  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.642   2.161   1.047  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.557   0.084   1.794  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.469  -3.438   2.238  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.219  -5.051   1.615  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.171  -4.791  -1.577  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.345  -6.465  -1.466  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.704  -6.742   0.255  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.639  -7.197  -2.061  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.774  -8.469  -1.165  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.085  -8.192  -0.310  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.888  -7.751   0.930  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.355  -5.799  -0.901  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.713  -6.076   0.820  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.420  -5.345   1.415  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.284  -4.072   0.519  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.926  -2.902  -2.001  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.182  -1.279  -1.384  1.00  0.00           H  
HETATM   72  H   UNL     1       4.886  -0.041   1.367  1.00  0.00           H  
CONECT    1   26   42   43   44                                       
CONECT    2    3    3   41   26                                       
CONECT    3    4    2    2   45                                       
CONECT    4    5    5    3   46                                       
CONECT    5    4    4    6   47                                       
CONECT    6    5   15   41   41                                       
CONECT    7   15   16   24   24                                       
CONECT    8   16    9   48   49                                       
CONECT    9    8   10   10   28                                       
CONECT   10    9    9   11   50                                       
CONECT   11   10   12   12   51                                       
CONECT   12   11   11   27   13                                       
CONECT   13   12   17   25   25                                       
CONECT   14   17   21   21   18                                       
CONECT   15    6    7   52                                            
CONECT   16   29    7    8                                            
CONECT   17   13   14   53                                            
CONECT   18   14   19   54                                            
CONECT   19   20   20   18                                            
CONECT   20   21   19   19                                            
CONECT   21   14   14   20                                            
CONECT   22   26   26                                                 
CONECT   23   26   26                                                 
CONECT   24    7    7                                                 
CONECT   25   13   13                                                 
CONECT   26    2    1   22   22                                       
CONECT   26   23   23                                                 
CONECT   27   28   28   12   55                                       
CONECT   28    9   27   27   56                                       
CONECT   29   40   40   30   16                                       
CONECT   30   31   31   29   57                                       
CONECT   31   32   30   30   58                                       
CONECT   32   33   39   39   31                                       
CONECT   33   38   34   32   59                                       
CONECT   34   35   33   60   61                                       
CONECT   35   36   34   62   63                                       
CONECT   36   37   35   64   65                                       
CONECT   37   36   38   66   67                                       
CONECT   38   37   33   68   69                                       
CONECT   39   32   32   40   70                                       
CONECT   40   39   29   29   71                                       
CONECT   41    6    6    2   72                                       
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   30                                                      
CONECT   58   31                                                      
CONECT   59   33                                                      
CONECT   60   34                                                      
CONECT   61   34                                                      
CONECT   62   35                                                      
CONECT   63   35                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
CONECT   66   37                                                      
CONECT   67   37                                                      
CONECT   68   38                                                      
CONECT   69   38                                                      
CONECT   70   39                                                      
CONECT   71   40                                                      
CONECT   72   41                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
