COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.070   1.224   0.641  1.00  0.00           C  
HETATM    2  C   UNL     1       2.337   1.880   0.283  1.00  0.00           C  
HETATM    3  C   UNL     1       3.421   1.036  -0.260  1.00  0.00           C  
HETATM    4  C   UNL     1       3.139  -0.182  -0.716  1.00  0.00           C  
HETATM    5  C   UNL     1       1.757  -0.753  -0.725  1.00  0.00           C  
HETATM    6  C   UNL     1       0.816  -0.016   0.176  1.00  0.00           C  
HETATM    7  O   UNL     1      -7.847   1.883  -0.005  1.00  0.00           O  
HETATM    8  C   UNL     1       5.693   0.626  -0.832  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.857  -2.742  -0.029  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.436  -0.664   0.560  1.00  0.00           C  
HETATM   11  C   UNL     1       8.867  -2.824   0.580  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.867  -0.643   0.811  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.649   1.236  -0.466  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.290  -0.622   1.061  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.351   0.466   1.201  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.870   0.989  -0.467  1.00  0.00           C  
HETATM   17  O   UNL     1       5.864  -0.527   0.021  1.00  0.00           O  
HETATM   18  C   UNL     1       7.166  -1.057  -0.312  1.00  0.00           C  
HETATM   19  C   UNL     1       8.064   0.188  -0.488  1.00  0.00           C  
HETATM   20  C   UNL     1       7.073   1.320  -0.838  1.00  0.00           C  
HETATM   21  O   UNL     1       8.993  -0.013  -1.556  1.00  0.00           O  
HETATM   22  C   UNL     1       7.682  -1.922   0.809  1.00  0.00           C  
HETATM   23  O   UNL     1       4.699   1.500  -0.293  1.00  0.00           O  
HETATM   24  O   UNL     1       2.487   3.080   0.428  1.00  0.00           O  
HETATM   25  O   UNL     1       7.119   2.350   0.151  1.00  0.00           O  
HETATM   26  O   UNL     1       7.146  -1.892   1.891  1.00  0.00           O  
HETATM   27  C   UNL     1      -1.616  -0.052   0.315  1.00  0.00           C  
HETATM   28  O   UNL     1      -2.840  -1.683   1.441  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.582   1.178  -0.133  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.796  -1.670   0.063  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.945  -0.997  -1.302  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.907   0.164  -1.245  1.00  0.00           C  
HETATM   33  N   UNL     1      -4.043  -0.033   0.567  1.00  0.00           N  
HETATM   34  O   UNL     1      -5.920   1.420   2.174  1.00  0.00           O  
HETATM   35  O   UNL     1      -6.426  -1.956  -2.245  1.00  0.00           O  
HETATM   36  O   UNL     1      -8.251  -0.231  -0.921  1.00  0.00           O  
HETATM   37  H   UNL     1       0.354   1.727   1.273  1.00  0.00           H  
HETATM   38  H   UNL     1       3.947  -0.786  -1.103  1.00  0.00           H  
HETATM   39  H   UNL     1       1.370  -0.722  -1.743  1.00  0.00           H  
HETATM   40  H   UNL     1       1.805  -1.794  -0.402  1.00  0.00           H  
HETATM   41  H   UNL     1       5.419   0.315  -1.840  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.116  -3.441  -0.645  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.419  -1.632   1.039  1.00  0.00           H  
HETATM   44  H   UNL     1       9.785  -2.286   0.817  1.00  0.00           H  
HETATM   45  H   UNL     1       8.785  -3.702   1.221  1.00  0.00           H  
HETATM   46  H   UNL     1       8.889  -3.137  -0.464  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.559   2.079   0.219  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.821   1.252  -1.175  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.592   1.308  -1.008  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.118  -1.092   2.029  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.286   0.014   1.533  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.560   0.769   0.348  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.414   1.450  -1.292  1.00  0.00           H  
HETATM   54  H   UNL     1       7.118  -1.625  -1.240  1.00  0.00           H  
HETATM   55  H   UNL     1       8.592   0.412   0.438  1.00  0.00           H  
HETATM   56  H   UNL     1       7.290   1.729  -1.825  1.00  0.00           H  
HETATM   57  H   UNL     1       9.582   0.738  -1.711  1.00  0.00           H  
HETATM   58  H   UNL     1       6.475   3.057   0.013  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.759   1.843  -0.394  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.762  -2.054   0.391  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.970  -0.636  -1.628  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.913   0.675  -2.208  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.065   0.796   0.064  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.544   2.144   2.319  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.843  -2.720  -2.361  1.00  0.00           H  
CONECT    1    6    6    2   37                                       
CONECT    2    3    1   24   24                                       
CONECT    3    4    4   23    2                                       
CONECT    4    5    3    3   38                                       
CONECT    5    4    6   39   40                                       
CONECT    6    5   10    1    1                                       
CONECT    7   29   16                                                 
CONECT    8   17   20   23   41                                       
CONECT    9   30   42                                                 
CONECT   10   27   27    6   43                                       
CONECT   11   22   44   45   46                                       
CONECT   12   28   28   27   33                                       
CONECT   13   27   47   48   49                                       
CONECT   14   33   30   15   50                                       
CONECT   15   14   34   29   51                                       
CONECT   16   36    7   52   53                                       
CONECT   17    8   18                                                 
CONECT   18   17   19   22   54                                       
CONECT   19   20   18   21   55                                       
CONECT   20    8   25   19   56                                       
CONECT   21   19   57                                                 
CONECT   22   18   26   26   11                                       
CONECT   23    8    3                                                 
CONECT   24    2    2                                                 
CONECT   25   20   58                                                 
CONECT   26   22   22                                                 
CONECT   27   13   12   10   10                                       
CONECT   28   12   12                                                 
CONECT   29   15   32    7   59                                       
CONECT   30    9   14   31   60                                       
CONECT   31   30   35   32   61                                       
CONECT   32   31   29   36   62                                       
CONECT   33   12   14   63                                            
CONECT   34   15   64                                                 
CONECT   35   31   65                                                 
CONECT   36   32   16                                                 
CONECT   37    1                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   25                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   35                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
