COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.702  -5.607  -0.099  1.00  0.00           C  
HETATM    2  O   UNL     1      -0.430  -4.719  -0.168  1.00  0.00           O  
HETATM    3  C   UNL     1       1.312  -3.617   0.710  1.00  0.00           C  
HETATM    4  O   UNL     1       1.599  -4.947   0.814  1.00  0.00           O  
HETATM    5  C   UNL     1       2.018  -2.490   1.090  1.00  0.00           C  
HETATM    6  O   UNL     1       1.372   3.411   0.852  1.00  0.00           O  
HETATM    7  C   UNL     1       1.498  -1.222   0.866  1.00  0.00           C  
HETATM    8  O   UNL     1       3.058   2.730   2.231  1.00  0.00           O  
HETATM    9  C   UNL     1       2.329  -0.039   1.323  1.00  0.00           C  
HETATM   10  O   UNL     1       4.031  -0.048  -3.251  1.00  0.00           O  
HETATM   11  C   UNL     1       1.413   1.165   1.409  1.00  0.00           C  
HETATM   12  O   UNL     1       6.449   0.955  -2.399  1.00  0.00           O  
HETATM   13  C   UNL     1       2.072   2.503   1.571  1.00  0.00           C  
HETATM   14  O   UNL     1       6.850   1.473   0.275  1.00  0.00           O  
HETATM   15  C   UNL     1       0.273   2.764   0.123  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.343   0.572   0.948  1.00  0.00           O  
HETATM   17  C   UNL     1       0.749   1.308   0.002  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.109   0.876  -0.546  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.355   0.268  -0.038  1.00  0.00           C  
HETATM   20  O   UNL     1      -6.182   0.938  -2.548  1.00  0.00           O  
HETATM   21  C   UNL     1       0.269  -1.083   0.258  1.00  0.00           C  
HETATM   22  O   UNL     1      -6.729   0.489  -0.313  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.448  -2.211  -0.117  1.00  0.00           C  
HETATM   24  O   UNL     1      -5.930   0.349   2.453  1.00  0.00           O  
HETATM   25  C   UNL     1       0.065  -3.476   0.104  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.196  -0.402   2.892  1.00  0.00           O  
HETATM   27  C   UNL     1       3.430   0.227   0.329  1.00  0.00           C  
HETATM   28  C   UNL     1       3.224  -0.033  -1.013  1.00  0.00           C  
HETATM   29  C   UNL     1       4.234   0.209  -1.931  1.00  0.00           C  
HETATM   30  C   UNL     1       5.455   0.716  -1.501  1.00  0.00           C  
HETATM   31  C   UNL     1       5.657   0.977  -0.151  1.00  0.00           C  
HETATM   32  C   UNL     1       4.640   0.736   0.760  1.00  0.00           C  
HETATM   33  C   UNL     1       2.753  -0.568  -3.622  1.00  0.00           C  
HETATM   34  C   UNL     1       6.988   1.717   1.676  1.00  0.00           C  
HETATM   35  C   UNL     1      -2.662   0.147   0.601  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.417   0.506  -0.977  1.00  0.00           C  
HETATM   37  C   UNL     1      -4.826   1.278  -2.232  1.00  0.00           C  
HETATM   38  C   UNL     1      -7.115   1.196  -1.497  1.00  0.00           C  
HETATM   39  C   UNL     1      -5.418   0.830   0.139  1.00  0.00           C  
HETATM   40  C   UNL     1      -5.038   0.027   1.384  1.00  0.00           C  
HETATM   41  C   UNL     1      -3.603   0.398   1.780  1.00  0.00           C  
HETATM   42  C   UNL     1      -8.508   0.735  -1.931  1.00  0.00           C  
HETATM   43  H   UNL     1       0.402  -6.579   0.293  1.00  0.00           H  
HETATM   44  H   UNL     1       1.164  -5.714  -1.080  1.00  0.00           H  
HETATM   45  H   UNL     1       2.981  -2.598   1.566  1.00  0.00           H  
HETATM   46  H   UNL     1       2.759  -0.246   2.303  1.00  0.00           H  
HETATM   47  H   UNL     1       0.662   1.015   2.185  1.00  0.00           H  
HETATM   48  H   UNL     1       6.435   1.847  -2.773  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.654   2.820   0.693  1.00  0.00           H  
HETATM   50  H   UNL     1       0.148   3.211  -0.863  1.00  0.00           H  
HETATM   51  H   UNL     1       1.466   1.179  -0.809  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.814   0.254  -1.027  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.415  -2.101  -0.584  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.745  -0.126   3.275  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.298  -0.219   3.200  1.00  0.00           H  
HETATM   56  H   UNL     1       2.275  -0.427  -1.347  1.00  0.00           H  
HETATM   57  H   UNL     1       4.796   0.943   1.809  1.00  0.00           H  
HETATM   58  H   UNL     1       2.583  -1.515  -3.109  1.00  0.00           H  
HETATM   59  H   UNL     1       1.976   0.142  -3.339  1.00  0.00           H  
HETATM   60  H   UNL     1       2.724  -0.728  -4.699  1.00  0.00           H  
HETATM   61  H   UNL     1       7.984   2.110   1.880  1.00  0.00           H  
HETATM   62  H   UNL     1       6.239   2.443   1.994  1.00  0.00           H  
HETATM   63  H   UNL     1       6.846   0.785   2.223  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.650  -0.918   0.370  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.441  -0.564  -1.185  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.175   1.001  -3.062  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.750   2.349  -2.046  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.138   2.265  -1.289  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.378   1.895   0.367  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.098  -1.039   1.165  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.565   1.451   2.058  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.487  -0.333  -2.146  1.00  0.00           H  
HETATM   73  H   UNL     1      -9.221   0.931  -1.130  1.00  0.00           H  
HETATM   74  H   UNL     1      -8.808   1.280  -2.826  1.00  0.00           H  
CONECT    1    2    4   43   44                                       
CONECT    2    1   25                                                 
CONECT    3    4    5    5   25                                       
CONECT    4    1    3                                                 
CONECT    5    3    3    7   45                                       
CONECT    6   13   15                                                 
CONECT    7    5    9   21   21                                       
CONECT    8   13   13                                                 
CONECT    9    7   11   27   46                                       
CONECT   10   29   33                                                 
CONECT   11    9   13   17   47                                       
CONECT   12   30   48                                                 
CONECT   13    6    8    8   11                                       
CONECT   14   31   34                                                 
CONECT   15    6   17   49   50                                       
CONECT   16   19   35                                                 
CONECT   17   11   15   19   51                                       
CONECT   18   35   36                                                 
CONECT   19   16   17   21   52                                       
CONECT   20   37   38                                                 
CONECT   21    7    7   19   23                                       
CONECT   22   38   39                                                 
CONECT   23   21   25   25   53                                       
CONECT   24   40   54                                                 
CONECT   25    2    3   23   23                                       
CONECT   26   41   55                                                 
CONECT   27    9   28   28   32                                       
CONECT   28   27   27   29   56                                       
CONECT   29   10   28   30   30                                       
CONECT   30   12   29   29   31                                       
CONECT   31   14   30   32   32                                       
CONECT   32   27   31   31   57                                       
CONECT   33   10   58   59   60                                       
CONECT   34   14   61   62   63                                       
CONECT   35   16   18   41   64                                       
CONECT   36   18   37   39   65                                       
CONECT   37   20   36   66   67                                       
CONECT   38   20   22   42   68                                       
CONECT   39   22   36   40   69                                       
CONECT   40   24   39   41   70                                       
CONECT   41   26   35   40   71                                       
CONECT   42   38   72   73   74                                       
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    5                                                      
CONECT   46    9                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   26                                                      
CONECT   56   28                                                      
CONECT   57   32                                                      
CONECT   58   33                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   37                                                      
CONECT   67   37                                                      
CONECT   68   38                                                      
CONECT   69   39                                                      
CONECT   70   40                                                      
CONECT   71   41                                                      
CONECT   72   42                                                      
CONECT   73   42                                                      
CONECT   74   42                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
