COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.254  -1.395   0.458  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.334  -1.400  -0.424  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.138  -1.727  -1.766  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.861  -2.047  -2.226  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.780  -2.041  -1.344  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.007  -1.715  -0.027  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.850  -1.709   0.917  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.080  -1.412   2.099  1.00  0.00           O  
HETATM    9  C   UNL     1      -0.497  -2.034   0.494  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.048  -3.354   0.545  1.00  0.00           C  
HETATM   11  C   UNL     1       0.350  -1.027   0.039  1.00  0.00           C  
HETATM   12  C   UNL     1       1.648  -1.337  -0.367  1.00  0.00           C  
HETATM   13  C   UNL     1       2.117  -2.660  -0.322  1.00  0.00           C  
HETATM   14  C   UNL     1       3.421  -2.990  -0.727  1.00  0.00           C  
HETATM   15  C   UNL     1       4.370  -1.941  -1.224  1.00  0.00           C  
HETATM   16  C   UNL     1       4.266  -1.752  -2.742  1.00  0.00           C  
HETATM   17  C   UNL     1       5.206  -0.666  -3.240  1.00  0.00           C  
HETATM   18  C   UNL     1       1.256  -3.684   0.140  1.00  0.00           C  
HETATM   19  C   UNL     1       1.724  -5.007   0.185  1.00  0.00           C  
HETATM   20  C   UNL     1       3.023  -5.317  -0.221  1.00  0.00           C  
HETATM   21  C   UNL     1       3.869  -4.310  -0.676  1.00  0.00           C  
HETATM   22  O   UNL     1       5.134  -4.636  -1.067  1.00  0.00           O  
HETATM   23  C   UNL     1       5.260  -5.563  -2.143  1.00  0.00           C  
HETATM   24  C   UNL     1       6.530  -5.239  -2.920  1.00  0.00           C  
HETATM   25  C   UNL     1       6.782  -6.188  -4.092  1.00  0.00           C  
HETATM   26  N   UNL     1       5.692  -6.231  -5.059  1.00  0.00           N  
HETATM   27  C   UNL     1       4.642  -7.097  -4.984  1.00  0.00           C  
HETATM   28  C   UNL     1       3.820  -6.845  -6.058  1.00  0.00           C  
HETATM   29  C   UNL     1       4.400  -5.785  -6.809  1.00  0.00           C  
HETATM   30  C   UNL     1       5.579  -5.418  -6.156  1.00  0.00           C  
HETATM   31  C   UNL     1       6.414  -4.396  -6.622  1.00  0.00           C  
HETATM   32  C   UNL     1       6.031  -3.732  -7.791  1.00  0.00           C  
HETATM   33  C   UNL     1       4.860  -4.077  -8.463  1.00  0.00           C  
HETATM   34  C   UNL     1       4.035  -5.101  -7.985  1.00  0.00           C  
HETATM   35  O   UNL     1       2.891  -5.416  -8.668  1.00  0.00           O  
HETATM   36  C   UNL     1       1.708  -4.718  -8.295  1.00  0.00           C  
HETATM   37  C   UNL     1       0.519  -5.645  -8.529  1.00  0.00           C  
HETATM   38  C   UNL     1       1.626  -3.445  -9.132  1.00  0.00           C  
HETATM   39  C   UNL     1       1.873  -4.396  -6.815  1.00  0.00           C  
HETATM   40  O   UNL     1       0.790  -3.780  -6.274  1.00  0.00           O  
HETATM   41  O   UNL     1       2.872  -4.658  -6.156  1.00  0.00           O  
HETATM   42  H   UNL     1       0.856  -3.555  -5.323  1.00  0.00           H  
HETATM   43  H   UNL     1       4.589  -3.541  -9.370  1.00  0.00           H  
HETATM   44  H   UNL     1       6.657  -2.933  -8.180  1.00  0.00           H  
HETATM   45  H   UNL     1       7.326  -4.124  -6.103  1.00  0.00           H  
HETATM   46  H   UNL     1       4.560  -7.818  -4.181  1.00  0.00           H  
HETATM   47  H   UNL     1       2.900  -7.369  -6.278  1.00  0.00           H  
HETATM   48  H   UNL     1       7.704  -5.919  -4.620  1.00  0.00           H  
HETATM   49  H   UNL     1       6.917  -7.212  -3.721  1.00  0.00           H  
HETATM   50  H   UNL     1       6.457  -4.214  -3.304  1.00  0.00           H  
HETATM   51  H   UNL     1       7.385  -5.236  -2.232  1.00  0.00           H  
HETATM   52  H   UNL     1       5.297  -6.572  -1.722  1.00  0.00           H  
HETATM   53  H   UNL     1       4.377  -5.473  -2.783  1.00  0.00           H  
HETATM   54  H   UNL     1       3.366  -6.347  -0.179  1.00  0.00           H  
HETATM   55  H   UNL     1       1.080  -5.810   0.536  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.719  -4.134   0.902  1.00  0.00           H  
HETATM   57  H   UNL     1       0.010   0.004  -0.004  1.00  0.00           H  
HETATM   58  H   UNL     1       2.278  -0.522  -0.716  1.00  0.00           H  
HETATM   59  H   UNL     1       4.173  -0.982  -0.721  1.00  0.00           H  
HETATM   60  H   UNL     1       5.404  -2.210  -0.959  1.00  0.00           H  
HETATM   61  H   UNL     1       4.501  -2.693  -3.254  1.00  0.00           H  
HETATM   62  H   UNL     1       3.237  -1.490  -3.017  1.00  0.00           H  
HETATM   63  H   UNL     1       4.975   0.297  -2.773  1.00  0.00           H  
HETATM   64  H   UNL     1       6.248  -0.916  -3.015  1.00  0.00           H  
HETATM   65  H   UNL     1       5.111  -0.549  -4.324  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.789  -2.292  -1.713  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.707  -2.300  -3.271  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.979  -1.731  -2.452  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.329  -1.151  -0.065  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.419  -1.139   1.502  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.435  -5.161  -8.296  1.00  0.00           H  
HETATM   72  H   UNL     1       0.486  -5.983  -9.571  1.00  0.00           H  
HETATM   73  H   UNL     1       0.600  -6.545  -7.909  1.00  0.00           H  
HETATM   74  H   UNL     1       2.487  -2.795  -8.934  1.00  0.00           H  
HETATM   75  H   UNL     1       0.717  -2.872  -8.924  1.00  0.00           H  
HETATM   76  H   UNL     1       1.648  -3.678 -10.202  1.00  0.00           H  
CONECT    1    2    6    6   70                                       
CONECT    2    1    3    3   69                                       
CONECT    3    2    2    4   68                                       
CONECT    4    3    5    5   67                                       
CONECT    5    4    4    6   66                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    9    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   10   11                                       
CONECT   10    9    9   18   56                                       
CONECT   11    9   57   12   12                                       
CONECT   12   11   11   58   13                                       
CONECT   13   12   18   18   14                                       
CONECT   14   13   21   21   15                                       
CONECT   15   14   59   60   16                                       
CONECT   16   15   61   62   17                                       
CONECT   17   16   63   64   65                                       
CONECT   18   10   13   13   19                                       
CONECT   19   18   20   20   55                                       
CONECT   20   19   19   21   54                                       
CONECT   21   14   14   20   22                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   52   53                                       
CONECT   24   23   25   50   51                                       
CONECT   25   24   26   48   49                                       
CONECT   26   25   30   27                                            
CONECT   27   26   46   28   28                                       
CONECT   28   27   27   47   29                                       
CONECT   29   28   34   30   30                                       
CONECT   30   26   29   29   31                                       
CONECT   31   30   32   32   45                                       
CONECT   32   31   31   33   44                                       
CONECT   33   32   34   34   43                                       
CONECT   34   29   33   33   35                                       
CONECT   35   34   36                                                 
CONECT   36   35   39   37   38                                       
CONECT   37   36   71   72   73                                       
CONECT   38   36   74   75   76                                       
CONECT   39   36   40   41   41                                       
CONECT   40   39   42                                                 
CONECT   41   39   39                                                 
CONECT   42   40                                                      
CONECT   43   33                                                      
CONECT   44   32                                                      
CONECT   45   31                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   20                                                      
CONECT   55   19                                                      
CONECT   56   10                                                      
CONECT   57   11                                                      
CONECT   58   12                                                      
CONECT   59   15                                                      
CONECT   60   15                                                      
CONECT   61   16                                                      
CONECT   62   16                                                      
CONECT   63   17                                                      
CONECT   64   17                                                      
CONECT   65   17                                                      
CONECT   66    5                                                      
CONECT   67    4                                                      
CONECT   68    3                                                      
CONECT   69    2                                                      
CONECT   70    1                                                      
CONECT   71   37                                                      
CONECT   72   37                                                      
CONECT   73   37                                                      
CONECT   74   38                                                      
CONECT   75   38                                                      
CONECT   76   38                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
