COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.538   2.328   2.340  1.00  0.00           C  
HETATM    2  C   UNL     1       3.801   0.283  -0.346  1.00  0.00           C  
HETATM    3  C   UNL     1       4.860   0.932   0.261  1.00  0.00           C  
HETATM    4  C   UNL     1       4.634   1.761   1.344  1.00  0.00           C  
HETATM    5  C   UNL     1       3.348   1.941   1.820  1.00  0.00           C  
HETATM    6  C   UNL     1       2.289   1.291   1.214  1.00  0.00           C  
HETATM    7  C   UNL     1       1.146  -1.582   0.119  1.00  0.00           C  
HETATM    8  C   UNL     1       0.287  -1.696   1.197  1.00  0.00           C  
HETATM    9  C   UNL     1       0.086  -2.928   1.792  1.00  0.00           C  
HETATM   10  C   UNL     1       0.742  -4.044   1.310  1.00  0.00           C  
HETATM   11  C   UNL     1       1.600  -3.930   0.232  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.462   1.304   1.237  1.00  0.00           C  
HETATM   13  C   UNL     1       1.802  -2.699  -0.363  1.00  0.00           C  
HETATM   14  C   UNL     1       0.626  -1.114  -2.642  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.700  -1.045  -0.689  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.602   0.638   0.818  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.487  -0.296  -0.200  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.229   0.131  -0.311  1.00  0.00           C  
HETATM   19  C   UNL     1       0.095   0.606  -0.388  1.00  0.00           C  
HETATM   20  C   UNL     1       0.250   1.881  -1.176  1.00  0.00           C  
HETATM   21  C   UNL     1       1.360  -0.241  -0.534  1.00  0.00           C  
HETATM   22  C   UNL     1       2.516   0.462   0.131  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.299  -0.522  -0.736  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.305   1.033   0.655  1.00  0.00           N  
HETATM   25  O   UNL     1      -1.028  -0.126  -0.882  1.00  0.00           O  
HETATM   26  O   UNL     1       1.105   2.828  -0.759  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.395   2.051  -2.183  1.00  0.00           O  
HETATM   28  O   UNL     1       1.651  -0.428  -1.921  1.00  0.00           O  
HETATM   29  H   UNL     1      -3.735   3.310   1.911  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.343   2.064   3.026  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.592   2.351   2.881  1.00  0.00           H  
HETATM   32  H   UNL     1       3.977  -0.361  -1.195  1.00  0.00           H  
HETATM   33  H   UNL     1       5.864   0.792  -0.112  1.00  0.00           H  
HETATM   34  H   UNL     1       5.461   2.268   1.818  1.00  0.00           H  
HETATM   35  H   UNL     1       3.172   2.588   2.666  1.00  0.00           H  
HETATM   36  H   UNL     1       1.285   1.431   1.586  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.226  -0.824   1.573  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.584  -3.017   2.635  1.00  0.00           H  
HETATM   39  H   UNL     1       0.585  -5.006   1.776  1.00  0.00           H  
HETATM   40  H   UNL     1       2.112  -4.803  -0.145  1.00  0.00           H  
HETATM   41  H   UNL     1       2.473  -2.610  -1.205  1.00  0.00           H  
HETATM   42  H   UNL     1       0.364  -2.032  -2.116  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.254  -0.475  -2.719  1.00  0.00           H  
HETATM   44  H   UNL     1       0.986  -1.358  -3.642  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.166  -0.489  -1.503  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.399  -2.029  -1.047  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.412  -1.158   0.129  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.560   0.842   1.273  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.062   0.846   0.664  1.00  0.00           H  
HETATM   50  H   UNL     1       1.171   3.629  -1.298  1.00  0.00           H  
CONECT    1   12   29   30   31                                       
CONECT    2    3    3   22   32                                       
CONECT    3    2    2    4   33                                       
CONECT    4    3    5    5   34                                       
CONECT    5    4    4    6   35                                       
CONECT    6   22   22    5   36                                       
CONECT    7    8   21   13   13                                       
CONECT    8    9    9    7   37                                       
CONECT    9    8    8   10   38                                       
CONECT   10    9   11   11   39                                       
CONECT   11   10   10   13   40                                       
CONECT   12    1   16   16   24                                       
CONECT   13    7    7   11   41                                       
CONECT   14   28   42   43   44                                       
CONECT   15   17   45   46   47                                       
CONECT   16   12   12   17   48                                       
CONECT   17   16   15   23   23                                       
CONECT   18   24   24   23   25                                       
CONECT   19   25   20   21   49                                       
CONECT   20   27   27   19   26                                       
CONECT   21   19   22    7   28                                       
CONECT   22    2   21    6    6                                       
CONECT   23   17   17   18                                            
CONECT   24   12   18   18                                            
CONECT   25   18   19                                                 
CONECT   26   20   50                                                 
CONECT   27   20   20                                                 
CONECT   28   21   14                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   19                                                      
CONECT   50   26                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
