COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.321   3.501  -0.915  1.00  0.00           O  
HETATM    2  C   UNL     1       0.063   2.591  -0.005  1.00  0.00           C  
HETATM    3  O   UNL     1       0.333   2.938   1.120  1.00  0.00           O  
HETATM    4  C   UNL     1       0.157   1.136  -0.388  1.00  0.00           C  
HETATM    5  C   UNL     1       1.319   0.463   0.364  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.101   0.395   0.049  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.247   1.235   0.595  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.491   0.391   0.337  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.708   0.656   0.744  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.058  -0.812  -0.480  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.718  -0.378  -1.138  1.00  0.00           C  
HETATM   12  O   UNL     1      -4.037  -1.154  -1.463  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.718  -1.994   0.424  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.641  -1.687   1.440  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.664  -0.621   1.121  1.00  0.00           C  
HETATM   16  C   UNL     1       0.735  -0.963   0.705  1.00  0.00           C  
HETATM   17  O   UNL     1       0.799  -1.671  -0.565  1.00  0.00           O  
HETATM   18  C   UNL     1       1.680  -1.578   1.677  1.00  0.00           C  
HETATM   19  C   UNL     1       2.966  -1.388   1.484  1.00  0.00           C  
HETATM   20  C   UNL     1       3.542  -0.576   0.361  1.00  0.00           C  
HETATM   21  O   UNL     1       4.279   0.518   0.910  1.00  0.00           O  
HETATM   22  C   UNL     1       2.448  -0.023  -0.573  1.00  0.00           C  
HETATM   23  C   UNL     1       2.964   1.075  -1.506  1.00  0.00           C  
HETATM   24  C   UNL     1       1.814  -1.192  -1.306  1.00  0.00           C  
HETATM   25  O   UNL     1       2.164  -1.622  -2.379  1.00  0.00           O  
HETATM   26  H   UNL     1      -0.367   4.421  -0.623  1.00  0.00           H  
HETATM   27  H   UNL     1       0.298   1.039  -1.464  1.00  0.00           H  
HETATM   28  H   UNL     1       1.663   1.028   1.231  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.119   1.406   1.664  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.312   2.183   0.061  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.902   1.547   1.323  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.517  -0.016   0.500  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.887   0.275  -1.995  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.110  -1.240  -1.412  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.896  -1.399  -1.094  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.621  -2.298   0.955  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.386  -2.825  -0.197  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.133  -1.418   2.374  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.082  -2.606   1.618  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.547  -0.038   2.035  1.00  0.00           H  
HETATM   41  H   UNL     1       1.321  -2.161   2.513  1.00  0.00           H  
HETATM   42  H   UNL     1       3.654  -1.848   2.178  1.00  0.00           H  
HETATM   43  H   UNL     1       4.218  -1.203  -0.220  1.00  0.00           H  
HETATM   44  H   UNL     1       5.013   0.251   1.480  1.00  0.00           H  
HETATM   45  H   UNL     1       3.358   1.900  -0.913  1.00  0.00           H  
HETATM   46  H   UNL     1       3.755   0.672  -2.139  1.00  0.00           H  
HETATM   47  H   UNL     1       2.146   1.434  -2.131  1.00  0.00           H  
CONECT    1    2   26                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    6   27                                       
CONECT    5    4   16   22   28                                       
CONECT    6    4    7   11   15                                       
CONECT    7    6    8   29   30                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8   31   32                                       
CONECT   10    8   11   12   13                                       
CONECT   11    6   10   33   34                                       
CONECT   12   10   35                                                 
CONECT   13   10   14   36   37                                       
CONECT   14   13   15   38   39                                       
CONECT   15    6   14   16   40                                       
CONECT   16    5   15   17   18                                       
CONECT   17   16   24                                                 
CONECT   18   16   19   19   41                                       
CONECT   19   18   18   20   42                                       
CONECT   20   19   21   22   43                                       
CONECT   21   20   44                                                 
CONECT   22    5   20   23   24                                       
CONECT   23   22   45   46   47                                       
CONECT   24   17   22   25   25                                       
CONECT   25   24   24                                                 
CONECT   26    1                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
