COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.415   2.775  -0.025  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.898   2.549  -1.459  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.113   1.395  -2.087  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.355  -4.905   0.052  1.00  0.00           C  
HETATM    5  C   UNL     1       0.765  -0.936   0.108  1.00  0.00           C  
HETATM    6  C   UNL     1       2.437   0.792   0.255  1.00  0.00           C  
HETATM    7  C   UNL     1       1.529   1.682   0.801  1.00  0.00           C  
HETATM    8  C   UNL     1       1.860   3.020   0.961  1.00  0.00           C  
HETATM    9  C   UNL     1       3.088   3.482   0.582  1.00  0.00           C  
HETATM   10  C   UNL     1       4.023   2.603   0.028  1.00  0.00           C  
HETATM   11  C   UNL     1       3.701   1.245  -0.132  1.00  0.00           C  
HETATM   12  C   UNL     1       5.794   1.545  -0.890  1.00  0.00           C  
HETATM   13  C   UNL     1       5.391   2.756  -0.472  1.00  0.00           C  
HETATM   14  O   UNL     1       2.617  -3.108   0.052  1.00  0.00           O  
HETATM   15  C   UNL     1       1.426  -3.360   0.062  1.00  0.00           C  
HETATM   16  N   UNL     1       0.976  -4.637   0.040  1.00  0.00           N  
HETATM   17  N   UNL     1      -1.270  -3.981   0.079  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.944  -2.668   0.098  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.903  -1.657   0.123  1.00  0.00           C  
HETATM   20  C   UNL     1       0.424  -2.295   0.088  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.189  -0.017   0.126  1.00  0.00           N  
HETATM   22  C   UNL     1      -1.479  -0.335   0.137  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.425   0.679   0.155  1.00  0.00           N  
HETATM   24  C   UNL     1      -3.852   0.348   0.167  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.335   0.123  -1.268  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.637   1.502   0.794  1.00  0.00           C  
HETATM   27  N   UNL     1      -4.173   1.718   2.171  1.00  0.00           N  
HETATM   28  N   UNL     1       2.095  -0.555   0.098  1.00  0.00           N  
HETATM   29  N   UNL     1       4.800   0.628  -0.688  1.00  0.00           N  
HETATM   30  H   UNL     1      -3.353   3.021  -0.034  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.975   3.597   0.421  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.960   2.303  -1.451  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.740   3.456  -2.043  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.457   1.235  -3.108  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.051   1.641  -2.095  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.669  -5.938   0.033  1.00  0.00           H  
HETATM   37  H   UNL     1       0.553   1.332   1.105  1.00  0.00           H  
HETATM   38  H   UNL     1       1.140   3.702   1.388  1.00  0.00           H  
HETATM   39  H   UNL     1       3.337   4.525   0.710  1.00  0.00           H  
HETATM   40  H   UNL     1       6.763   1.327  -1.315  1.00  0.00           H  
HETATM   41  H   UNL     1       5.967   3.669  -0.499  1.00  0.00           H  
HETATM   42  H   UNL     1       1.613  -5.368   0.015  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.956  -1.897   0.132  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.142   1.606   0.160  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.010  -0.559   0.750  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.397  -0.123  -1.259  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.776  -0.699  -1.714  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.699   1.256   0.803  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.677   2.476   2.607  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.250   0.872   2.715  1.00  0.00           H  
HETATM   51  H   UNL     1       2.789  -1.222  -0.018  1.00  0.00           H  
HETATM   52  H   UNL     1       4.857  -0.314  -0.912  1.00  0.00           H  
CONECT    1    2   26   30   31                                       
CONECT    2    3    1   32   33                                       
CONECT    3   25    2   34   35                                       
CONECT    4   17   17   16   36                                       
CONECT    5   21   28   20   20                                       
CONECT    6    7   28   11   11                                       
CONECT    7    8    8    6   37                                       
CONECT    8    7    7    9   38                                       
CONECT    9    8   10   10   39                                       
CONECT   10    9    9   11   13                                       
CONECT   11    6    6   10   29                                       
CONECT   12   13   13   29   40                                       
CONECT   13   10   12   12   41                                       
CONECT   14   15   15                                                 
CONECT   15   20   16   14   14                                       
CONECT   16    4   15   42                                            
CONECT   17   18    4    4                                            
CONECT   18   19   19   20   17                                       
CONECT   19   22   18   18   43                                       
CONECT   20    5    5   18   15                                       
CONECT   21   22   22    5                                            
CONECT   22   23   21   21   19                                       
CONECT   23   24   22   44                                            
CONECT   24   25   23   26   45                                       
CONECT   25    3   24   46   47                                       
CONECT   26   24    1   27   48                                       
CONECT   27   26   49   50                                            
CONECT   28    5    6   51                                            
CONECT   29   11   12   52                                            
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
