COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.866   4.942   0.306  1.00  0.00           C  
HETATM    2  C   UNL     1       0.366   2.714  -2.729  1.00  0.00           C  
HETATM    3  C   UNL     1       1.303   1.330  -0.897  1.00  0.00           C  
HETATM    4  C   UNL     1       2.543   1.641  -0.375  1.00  0.00           C  
HETATM    5  C   UNL     1       3.446   0.626  -0.064  1.00  0.00           C  
HETATM    6  C   UNL     1       4.779   0.962   0.497  1.00  0.00           C  
HETATM    7  C   UNL     1       5.754   0.074   0.845  1.00  0.00           C  
HETATM    8  C   UNL     1       3.096  -0.703  -0.281  1.00  0.00           C  
HETATM    9  C   UNL     1       1.845  -1.011  -0.807  1.00  0.00           C  
HETATM   10  C   UNL     1       1.465  -2.427  -1.040  1.00  0.00           C  
HETATM   11  C   UNL     1       1.979  -6.003  -1.029  1.00  0.00           C  
HETATM   12  N   UNL     1       0.285  -4.189  -1.622  1.00  0.00           N  
HETATM   13  C   UNL     1       0.243  -2.884  -1.570  1.00  0.00           C  
HETATM   14  C   UNL     1       0.951   0.012  -1.114  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.400  -2.730   2.724  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.002  -4.483   1.102  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.251   3.486   0.251  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.320   2.533  -0.167  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.956   2.949  -0.557  1.00  0.00           C  
HETATM   20  C   UNL     1       0.329   2.432  -1.225  1.00  0.00           C  
HETATM   21  C   UNL     1       8.069   0.224   1.795  1.00  0.00           C  
HETATM   22  C   UNL     1       9.148  -0.084   0.755  1.00  0.00           C  
HETATM   23  C   UNL     1       8.387  -1.227   1.430  1.00  0.00           C  
HETATM   24  C   UNL     1       5.268   2.256   0.763  1.00  0.00           C  
HETATM   25  C   UNL     1       2.238  -3.522  -0.786  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.682   1.186  -0.215  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.961   0.804   0.151  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.654  -0.830   0.498  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.868  -2.340   0.381  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.880   1.759   0.566  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.521   3.093   0.620  1.00  0.00           C  
HETATM   32  N   UNL     1       6.803   0.781   1.311  1.00  0.00           N  
HETATM   33  N   UNL     1       6.475   2.141   1.250  1.00  0.00           N  
HETATM   34  N   UNL     1       1.528  -4.613  -1.136  1.00  0.00           N  
HETATM   35  N   UNL     1      -6.002  -3.033   1.343  1.00  0.00           N  
HETATM   36  N   UNL     1      -1.023   2.019  -0.839  1.00  0.00           N  
HETATM   37  O   UNL     1      -1.677   4.130  -0.622  1.00  0.00           O  
HETATM   38  O   UNL     1      -5.318  -0.506   0.105  1.00  0.00           O  
HETATM   39  H   UNL     1      -3.972   5.383  -0.685  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.517   5.464   1.008  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.831   5.032   0.634  1.00  0.00           H  
HETATM   42  H   UNL     1       1.372   3.021  -3.016  1.00  0.00           H  
HETATM   43  H   UNL     1       0.092   1.812  -3.275  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.339   3.511  -2.966  1.00  0.00           H  
HETATM   45  H   UNL     1       2.814   2.673  -0.208  1.00  0.00           H  
HETATM   46  H   UNL     1       5.697  -1.002   0.762  1.00  0.00           H  
HETATM   47  H   UNL     1       3.793  -1.493  -0.042  1.00  0.00           H  
HETATM   48  H   UNL     1       1.704  -6.400  -0.052  1.00  0.00           H  
HETATM   49  H   UNL     1       1.507  -6.599  -1.809  1.00  0.00           H  
HETATM   50  H   UNL     1       3.062  -6.043  -1.145  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.586  -2.264  -1.879  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.021  -0.226  -1.522  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.429  -3.052   2.885  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.742  -3.256   3.416  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.324  -1.656   2.896  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.636  -4.683   0.095  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.352  -4.972   1.828  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.016  -4.868   1.204  1.00  0.00           H  
HETATM   59  H   UNL     1       0.603   3.334  -0.679  1.00  0.00           H  
HETATM   60  H   UNL     1       8.397   0.581   2.771  1.00  0.00           H  
HETATM   61  H   UNL     1       8.917   0.128  -0.289  1.00  0.00           H  
HETATM   62  H   UNL     1      10.187   0.071   1.047  1.00  0.00           H  
HETATM   63  H   UNL     1       8.925  -1.825   2.166  1.00  0.00           H  
HETATM   64  H   UNL     1       7.655  -1.768   0.830  1.00  0.00           H  
HETATM   65  H   UNL     1       4.738   3.181   0.592  1.00  0.00           H  
HETATM   66  H   UNL     1       3.239  -3.516  -0.379  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.967   0.445  -0.539  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.359  -0.311  -0.152  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.814  -0.518   1.530  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.911  -2.576   0.594  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.622  -2.665  -0.630  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.877   1.458   0.852  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.240   3.831   0.944  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.246   1.077  -0.787  1.00  0.00           H  
CONECT    1   17   39   40   41                                       
CONECT    2   20   42   43   44                                       
CONECT    3   20    4    4   14                                       
CONECT    4    3    3    5   45                                       
CONECT    5    4    6    8    8                                       
CONECT    6    5    7    7   24                                       
CONECT    7    6    6   32   46                                       
CONECT    8    5    5    9   47                                       
CONECT    9    8   10   14   14                                       
CONECT   10    9   25   25   13                                       
CONECT   11   34   48   49   50                                       
CONECT   12   34   13   13                                            
CONECT   13   12   12   10   51                                       
CONECT   14    9    9    3   52                                       
CONECT   15   35   53   54   55                                       
CONECT   16   35   56   57   58                                       
CONECT   17    1   18   18   31                                       
CONECT   18   17   17   19   26                                       
CONECT   19   18   36   37   37                                       
CONECT   20   36    2    3   59                                       
CONECT   21   32   22   23   60                                       
CONECT   22   21   23   61   62                                       
CONECT   23   22   21   63   64                                       
CONECT   24   33   33    6   65                                       
CONECT   25   10   10   34   66                                       
CONECT   26   18   27   27   67                                       
CONECT   27   26   26   38   30                                       
CONECT   28   38   29   68   69                                       
CONECT   29   28   35   70   71                                       
CONECT   30   27   31   31   72                                       
CONECT   31   30   30   17   73                                       
CONECT   32    7   21   33                                            
CONECT   33   32   24   24                                            
CONECT   34   25   11   12                                            
CONECT   35   29   15   16                                            
CONECT   36   19   20   74                                            
CONECT   37   19   19                                                 
CONECT   38   27   28                                                 
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    2                                                      
CONECT   44    2                                                      
CONECT   45    4                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   20                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   28                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   29                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   36                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
