COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      55.344 123.432  96.085  1.00  0.00           N  
HETATM    2  C   UNL     1      56.485 122.822  96.521  1.00  0.00           C  
HETATM    3  N   UNL     1      56.611 122.574  97.843  1.00  0.00           N  
HETATM    4  C   UNL     1      55.698 122.881  98.781  1.00  0.00           C  
HETATM    5  C   UNL     1      54.482 123.555  98.236  1.00  0.00           C  
HETATM    6  C   UNL     1      54.344 123.806  96.900  1.00  0.00           C  
HETATM    7  O   UNL     1      57.440 122.456  95.818  1.00  0.00           O  
HETATM    8  N   UNL     1      55.857 122.620 100.052  1.00  0.00           N  
HETATM    9  C   UNL     1      55.198 123.671  94.661  1.00  0.00           C  
HETATM   10  C   UNL     1      54.250 122.857  93.765  1.00  0.00           C  
HETATM   11  O   UNL     1      54.398 121.445  93.823  1.00  0.00           O  
HETATM   12  C   UNL     1      53.220 123.476  92.782  1.00  0.00           C  
HETATM   13  C   UNL     1      53.603 124.916  93.293  1.00  0.00           C  
HETATM   14  O   UNL     1      54.731 124.925  94.181  1.00  0.00           O  
HETATM   15  O   UNL     1      54.057 123.138  91.713  1.00  0.00           O  
HETATM   16  C   UNL     1      52.374 125.704  93.848  1.00  0.00           C  
HETATM   17  O   UNL     1      52.075 124.765  94.903  1.00  0.00           O  
HETATM   18  P   UNL     1      50.718 125.131  95.669  1.00  0.00           P  
HETATM   19  O   UNL     1      50.102 123.837  96.368  1.00  0.00           O  
HETATM   20  O   UNL     1      51.111 126.028  96.862  1.00  0.00           O  
HETATM   21  O   UNL     1      49.586 125.904  94.737  1.00  0.00           O  
HETATM   22  P   UNL     1      48.613 125.467  93.554  1.00  0.00           P  
HETATM   23  O   UNL     1      47.305 125.129  94.336  1.00  0.00           O  
HETATM   24  O   UNL     1      49.660 124.674  92.711  1.00  0.00           O  
HETATM   25  O   UNL     1      48.598 126.881  92.904  1.00  0.00           O  
HETATM   26  C   UNL     1      47.595 127.831  93.163  1.00  0.00           C  
HETATM   27  C   UNL     1      48.122 129.171  93.559  1.00  0.00           C  
HETATM   28  C   UNL     1      47.045 130.267  93.605  1.00  0.00           C  
HETATM   29  S   UNL     1      45.621 130.015  94.657  1.00  0.00           S  
HETATM   30  C   UNL     1      47.172 131.418  92.892  1.00  0.00           C  
HETATM   31  S   UNL     1      45.772 132.509  92.878  1.00  0.00           S  
HETATM   32  C   UNL     1      48.474 131.677  92.152  1.00  0.00           C  
HETATM   33  C   UNL     1      49.624 130.792  92.658  1.00  0.00           C  
HETATM   34  O   UNL     1      49.122 129.457  92.585  1.00  0.00           O  
HETATM   35  N   UNL     1      48.005 131.486  90.754  1.00  0.00           N  
HETATM   36  C   UNL     1      49.163 131.297  89.973  1.00  0.00           C  
HETATM   37  N   UNL     1      50.560 131.086  91.594  1.00  0.00           N  
HETATM   38  C   UNL     1      50.551 131.084  90.178  1.00  0.00           C  
HETATM   39  N   UNL     1      51.554 130.922  89.305  1.00  0.00           N  
HETATM   40  C   UNL     1      51.205 130.963  87.973  1.00  0.00           C  
HETATM   41  N   UNL     1      52.415 130.776  87.401  1.00  0.00           N  
HETATM   42  N   UNL     1      49.910 131.152  87.598  1.00  0.00           N  
HETATM   43  C   UNL     1      49.018 131.300  88.607  1.00  0.00           C  
HETATM   44  O   UNL     1      47.871 131.461  87.862  1.00  0.00           O  
HETATM   45 MO   UNL     1      43.903 131.550  93.855  1.00  0.00          Mo  
HETATM   46  O   UNL     1      43.027 133.651  94.017  1.00  0.00           O  
HETATM   47  O   UNL     1      42.993 131.008  95.181  1.00  0.00           O  
HETATM   48  O   UNL     1      43.322 130.697  92.531  1.00  0.00           O  
HETATM   49  H   UNL     1      53.694 123.851  98.913  1.00  0.00           H  
HETATM   50  H   UNL     1      53.460 124.289  96.512  1.00  0.00           H  
HETATM   51  H   UNL     1      56.691 122.169 100.369  1.00  0.00           H  
HETATM   52  H   UNL     1      55.144 122.871 100.707  1.00  0.00           H  
HETATM   53  H   UNL     1      56.198 123.526  94.226  1.00  0.00           H  
HETATM   54  H   UNL     1      53.494 122.828  94.564  1.00  0.00           H  
HETATM   55  H   UNL     1      53.771 121.036  93.238  1.00  0.00           H  
HETATM   56  H   UNL     1      52.168 123.158  92.837  1.00  0.00           H  
HETATM   57  H   UNL     1      53.912 125.465  92.391  1.00  0.00           H  
HETATM   58  H   UNL     1      53.658 123.416  90.897  1.00  0.00           H  
HETATM   59  H   UNL     1      52.642 126.701  94.227  1.00  0.00           H  
HETATM   60  H   UNL     1      51.559 125.797  93.115  1.00  0.00           H  
HETATM   61  H   UNL     1      50.890 125.589  97.675  1.00  0.00           H  
HETATM   62  H   UNL     1      49.415 123.757  92.683  1.00  0.00           H  
HETATM   63  H   UNL     1      46.989 127.952  92.253  1.00  0.00           H  
HETATM   64  H   UNL     1      46.961 127.453  93.979  1.00  0.00           H  
HETATM   65  H   UNL     1      48.581 129.094  94.556  1.00  0.00           H  
HETATM   66  H   UNL     1      48.757 132.730  92.296  1.00  0.00           H  
HETATM   67  H   UNL     1      49.975 131.089  93.657  1.00  0.00           H  
HETATM   68  H   UNL     1      47.412 130.683  90.694  1.00  0.00           H  
HETATM   69  H   UNL     1      50.830 132.026  91.803  1.00  0.00           H  
HETATM   70  H   UNL     1      53.110 130.678  88.114  1.00  0.00           H  
HETATM   71  H   UNL     1      52.394 129.949  86.840  1.00  0.00           H  
HETATM   72  H   UNL     1      48.084 131.416  86.937  1.00  0.00           H  
HETATM   73  H   UNL     1      42.414 133.684  94.742  1.00  0.00           H  
HETATM   74  H   UNL     1      43.727 134.275  94.167  1.00  0.00           H  
CONECT    1    2    6    9                                            
CONECT    2    1    3    7    7                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3    5    8                                       
CONECT    5    4    6    6   49                                       
CONECT    6    1    5    5   50                                       
CONECT    7    2    2                                                 
CONECT    8    4   51   52                                            
CONECT    9    1   10   14   53                                       
CONECT   10    9   11   12   54                                       
CONECT   11   10   55                                                 
CONECT   12   10   13   15   56                                       
CONECT   13   12   14   16   57                                       
CONECT   14    9   13                                                 
CONECT   15   12   58                                                 
CONECT   16   13   17   59   60                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   19   20                                       
CONECT   18   21                                                      
CONECT   19   18   18                                                 
CONECT   20   18   61                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   23   24                                       
CONECT   22   25                                                      
CONECT   23   22   22                                                 
CONECT   24   22   62                                                 
CONECT   25   22   26                                                 
CONECT   26   25   27   63   64                                       
CONECT   27   26   28   34   65                                       
CONECT   28   27   29   30   30                                       
CONECT   29   28   45                                                 
CONECT   30   28   28   31   32                                       
CONECT   31   30   45                                                 
CONECT   32   30   33   35   66                                       
CONECT   33   32   34   37   67                                       
CONECT   34   27   33                                                 
CONECT   35   32   36   68                                            
CONECT   36   35   38   38   43                                       
CONECT   37   33   38   69                                            
CONECT   38   36   36   37   39                                       
CONECT   39   38   40   40                                            
CONECT   40   39   39   41   42                                       
CONECT   41   40   70   71                                            
CONECT   42   40   43   43                                            
CONECT   43   36   42   42   44                                       
CONECT   44   43   72                                                 
CONECT   45   29   31   46   47                                       
CONECT   45   47   48   48                                            
CONECT   46   45   73   74                                            
CONECT   47   45   45                                                 
CONECT   48   45   45                                                 
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   13                                                      
CONECT   58   15                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   20                                                      
CONECT   62   24                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   35                                                      
CONECT   69   37                                                      
CONECT   70   41                                                      
CONECT   71   41                                                      
CONECT   72   44                                                      
CONECT   73   46                                                      
CONECT   74   46                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
