COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.741  -0.838   0.995  1.00  0.00           C  
HETATM    2  O   UNL     1       6.372  -0.463   1.300  1.00  0.00           O  
HETATM    3  C   UNL     1       5.429  -1.402   1.120  1.00  0.00           C  
HETATM    4  O   UNL     1       5.738  -2.499   0.721  1.00  0.00           O  
HETATM    5  C   UNL     1       3.986  -1.086   1.416  1.00  0.00           C  
HETATM    6  O   UNL     1       3.198  -2.268   1.261  1.00  0.00           O  
HETATM    7  C   UNL     1       3.490  -0.011   0.447  1.00  0.00           C  
HETATM    8  C   UNL     1       4.229   1.301   0.719  1.00  0.00           C  
HETATM    9  O   UNL     1       3.740  -0.429  -0.896  1.00  0.00           O  
HETATM   10  C   UNL     1       1.962   0.203   0.648  1.00  0.00           C  
HETATM   11  O   UNL     1       1.708   1.140   1.691  1.00  0.00           O  
HETATM   12  C   UNL     1       1.351   1.565   0.370  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.153   1.609   0.229  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.833   2.796   0.317  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.228   2.811   0.301  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.898   3.988   0.376  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.931   1.608   0.208  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.403   1.600   0.272  1.00  0.00           C  
HETATM   19  O   UNL     1      -5.016   2.647   0.367  1.00  0.00           O  
HETATM   20  C   UNL     1      -5.131   0.318   0.220  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.515   0.292   0.380  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.197  -0.908   0.318  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.517  -2.094   0.090  1.00  0.00           C  
HETATM   24  O   UNL     1      -7.202  -3.264   0.024  1.00  0.00           O  
HETATM   25  C   UNL     1      -5.128  -2.089  -0.073  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.465  -3.250  -0.304  1.00  0.00           O  
HETATM   27  C   UNL     1      -4.429  -0.884   0.003  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.961  -0.865  -0.132  1.00  0.00           C  
HETATM   29  O   UNL     1      -2.358  -1.892  -0.378  1.00  0.00           O  
HETATM   30  C   UNL     1      -2.226   0.400   0.032  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.824   0.404   0.021  1.00  0.00           C  
HETATM   32  N   UNL     1      -0.122  -0.734  -0.250  1.00  0.00           N  
HETATM   33  C   UNL     1       1.136  -1.033   0.373  1.00  0.00           C  
HETATM   34  C   UNL     1       1.919  -1.818  -0.650  1.00  0.00           C  
HETATM   35  C   UNL     1       2.521  -1.784  -1.700  1.00  0.00           C  
HETATM   36  C   UNL     1       3.554  -1.350  -2.602  1.00  0.00           C  
HETATM   37  C   UNL     1       3.724  -0.055  -2.922  1.00  0.00           C  
HETATM   38  C   UNL     1       2.871   0.974  -2.394  1.00  0.00           C  
HETATM   39  C   UNL     1       2.552   1.915  -1.719  1.00  0.00           C  
HETATM   40  C   UNL     1       2.162   2.569  -0.439  1.00  0.00           C  
HETATM   41  O   UNL     1       1.369   3.726  -0.709  1.00  0.00           O  
HETATM   42  H   UNL     1       7.814  -1.128  -0.053  1.00  0.00           H  
HETATM   43  H   UNL     1       8.401   0.010   1.184  1.00  0.00           H  
HETATM   44  H   UNL     1       8.038  -1.676   1.626  1.00  0.00           H  
HETATM   45  H   UNL     1       3.896  -0.722   2.440  1.00  0.00           H  
HETATM   46  H   UNL     1       3.360  -2.742   0.434  1.00  0.00           H  
HETATM   47  H   UNL     1       5.220   1.084   1.118  1.00  0.00           H  
HETATM   48  H   UNL     1       4.327   1.862  -0.211  1.00  0.00           H  
HETATM   49  H   UNL     1       3.667   1.892   1.442  1.00  0.00           H  
HETATM   50  H   UNL     1       3.989  -1.360  -0.979  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.287   3.724   0.398  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.082   4.391  -0.483  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.055   1.211   0.554  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.269  -0.922   0.449  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.503  -3.494  -0.865  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.375  -3.471  -1.241  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.085  -0.909  -1.243  1.00  0.00           H  
HETATM   58  H   UNL     1       1.023  -1.654   1.255  1.00  0.00           H  
HETATM   59  H   UNL     1       4.212  -2.098  -3.028  1.00  0.00           H  
HETATM   60  H   UNL     1       4.535   0.234  -3.582  1.00  0.00           H  
HETATM   61  H   UNL     1       3.056   2.854   0.116  1.00  0.00           H  
HETATM   62  H   UNL     1       1.819   4.396  -1.242  1.00  0.00           H  
CONECT    1    2   42   43   44                                       
CONECT    2    1    3                                                 
CONECT    3    2    5    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    7    6    3   45                                       
CONECT    6    5   46                                                 
CONECT    7    9    8    5   10                                       
CONECT    8    7   47   48   49                                       
CONECT    9    7   50                                                 
CONECT   10    7   33   11   12                                       
CONECT   11   10   12                                                 
CONECT   12   10   11   40   13                                       
CONECT   13   31   12   14   14                                       
CONECT   14   13   13   15   51                                       
CONECT   15   17   17   14   16                                       
CONECT   16   15   52                                                 
CONECT   17   30   18   15   15                                       
CONECT   18   20   17   19   19                                       
CONECT   19   18   18                                                 
CONECT   20   27   27   21   18                                       
CONECT   21   22   22   20   53                                       
CONECT   22   23   21   21   54                                       
CONECT   23   24   25   25   22                                       
CONECT   24   23   55                                                 
CONECT   25   26   23   23   27                                       
CONECT   26   25   56                                                 
CONECT   27   25   28   20   20                                       
CONECT   28   29   29   27   30                                       
CONECT   29   28   28                                                 
CONECT   30   28   31   31   17                                       
CONECT   31   32   30   30   13                                       
CONECT   32   33   31   57                                            
CONECT   33   34   10   32   58                                       
CONECT   34   35   35   35   33                                       
CONECT   35   36   34   34   34                                       
CONECT   36   35   37   37   59                                       
CONECT   37   36   36   38   60                                       
CONECT   38   37   39   39   39                                       
CONECT   39   38   38   38   40                                       
CONECT   40   39   12   41   61                                       
CONECT   41   40   62                                                 
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   14                                                      
CONECT   52   16                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   24                                                      
CONECT   56   26                                                      
CONECT   57   32                                                      
CONECT   58   33                                                      
CONECT   59   36                                                      
CONECT   60   37                                                      
CONECT   61   40                                                      
CONECT   62   41                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
