COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.947   3.935  -0.882  1.00  0.00           N  
HETATM    2  C   UNL     1       4.250  -1.230   1.324  1.00  0.00           C  
HETATM    3  O   UNL     1       0.514   1.728   1.531  1.00  0.00           O  
HETATM    4  C   UNL     1       3.083   0.009  -0.360  1.00  0.00           C  
HETATM    5  C   UNL     1       3.928  -0.503  -1.327  1.00  0.00           C  
HETATM    6  C   UNL     1       4.942  -1.371  -0.971  1.00  0.00           C  
HETATM    7  O   UNL     1       0.732  -0.978  -2.200  1.00  0.00           O  
HETATM    8  C   UNL     1       0.106  -0.620  -1.222  1.00  0.00           C  
HETATM    9  C   UNL     1       0.648   0.369  -0.379  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.001   0.779   0.726  1.00  0.00           C  
HETATM   11  C   UNL     1       1.440   2.576   1.056  1.00  0.00           C  
HETATM   12  N   UNL     1       1.637   3.778   1.689  1.00  0.00           N  
HETATM   13  C   UNL     1       2.184   2.272  -0.034  1.00  0.00           C  
HETATM   14  C   UNL     1       3.167   3.199  -0.507  1.00  0.00           C  
HETATM   15  C   UNL     1       1.985   0.965  -0.750  1.00  0.00           C  
HETATM   16  C   UNL     1       3.244  -0.354   0.965  1.00  0.00           C  
HETATM   17  C   UNL     1       5.102  -1.741   0.356  1.00  0.00           C  
HETATM   18  O   UNL     1       6.093  -2.603   0.708  1.00  0.00           O  
HETATM   19  C   UNL     1       6.932  -3.089  -0.341  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.234  -1.241  -0.933  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.091  -0.232  -0.161  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.335   0.179   1.104  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.404  -0.868   0.217  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.421  -2.037   0.914  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.625  -2.640   1.273  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.818  -2.077   0.938  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.840  -0.870   0.220  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.615  -0.254  -0.141  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.052  -0.258  -0.144  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.034   0.912  -0.839  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.830   1.514  -1.199  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.637   0.956  -0.855  1.00  0.00           C  
HETATM   33  H   UNL     1       4.375  -1.514   2.359  1.00  0.00           H  
HETATM   34  H   UNL     1       3.800  -0.219  -2.361  1.00  0.00           H  
HETATM   35  H   UNL     1       5.601  -1.771  -1.727  1.00  0.00           H  
HETATM   36  H   UNL     1       1.109   4.007   2.471  1.00  0.00           H  
HETATM   37  H   UNL     1       2.303   4.399   1.355  1.00  0.00           H  
HETATM   38  H   UNL     1       2.583   0.047   1.718  1.00  0.00           H  
HETATM   39  H   UNL     1       7.678  -3.766   0.075  1.00  0.00           H  
HETATM   40  H   UNL     1       6.326  -3.622  -1.074  1.00  0.00           H  
HETATM   41  H   UNL     1       7.432  -2.250  -0.825  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.727  -1.497  -1.871  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.097  -2.140  -0.333  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.274   0.644  -0.783  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.173  -0.698   1.730  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.921   0.914   1.654  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.489  -2.505   1.192  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.611  -3.569   1.825  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.744  -2.556   1.223  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.993  -0.714   0.128  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.967   1.380  -1.117  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.844   2.444  -1.748  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.712   1.435  -1.141  1.00  0.00           H  
HETATM   54  H   UNL     1       2.017   1.133  -1.826  1.00  0.00           H  
CONECT    1   14   14   14                                            
CONECT    2   17   17   16   33                                       
CONECT    3   11   10                                                 
CONECT    4   16   16    5   15                                       
CONECT    5    6    6    4   34                                       
CONECT    6   17    5    5   35                                       
CONECT    7    8    8                                                 
CONECT    8    7    7    9   20                                       
CONECT    9   15    8   10   10                                       
CONECT   10    9    9    3   22                                       
CONECT   11   13   13   12    3                                       
CONECT   12   11   36   37                                            
CONECT   13   14   15   11   11                                       
CONECT   14    1    1    1   13                                       
CONECT   15    4   13    9   54                                       
CONECT   16    2    4    4   38                                       
CONECT   17   18    2    2    6                                       
CONECT   18   19   17                                                 
CONECT   19   18   39   40   41                                       
CONECT   20    8   21   42   43                                       
CONECT   21   20   22   23   44                                       
CONECT   22   10   21   45   46                                       
CONECT   23   21   28   28   24                                       
CONECT   24   23   25   25   47                                       
CONECT   25   24   24   26   48                                       
CONECT   26   27   27   25   49                                       
CONECT   27   28   29   26   26                                       
CONECT   28   32   23   23   27                                       
CONECT   29   30   30   27   50                                       
CONECT   30   31   29   29   51                                       
CONECT   31   32   32   30   52                                       
CONECT   32   31   31   28   53                                       
CONECT   33    2                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   16                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   15                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
