COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.823   3.846   1.106  1.00  0.00           C  
HETATM    2  C   UNL     1       3.348   0.002  -0.191  1.00  0.00           C  
HETATM    3  C   UNL     1       5.835   0.152   0.288  1.00  0.00           C  
HETATM    4  C   UNL     1       6.371  -2.132  -0.210  1.00  0.00           C  
HETATM    5  C   UNL     1       2.286  -0.733  -0.700  1.00  0.00           C  
HETATM    6  C   UNL     1       1.026  -0.169  -0.774  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.475  -1.140   0.318  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.702  -1.700   0.410  1.00  0.00           C  
HETATM    9  N   UNL     1      -7.266  -1.590   0.300  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.944  -2.784   0.739  1.00  0.00           C  
HETATM   11  N   UNL     1       4.624  -0.572  -0.118  1.00  0.00           N  
HETATM   12  C   UNL     1       4.897  -1.855  -0.409  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.421  -0.347   0.130  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.759  -0.606   0.128  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.132  -1.639   0.348  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.245   2.706  -0.853  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.885   0.736  -0.255  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.581   0.914  -0.233  1.00  0.00           C  
HETATM   19  C   UNL     1       0.821   1.132  -0.341  1.00  0.00           C  
HETATM   20  C   UNL     1       1.886   1.871   0.170  1.00  0.00           C  
HETATM   21  C   UNL     1       3.148   1.307   0.238  1.00  0.00           C  
HETATM   22  C   UNL     1       6.870  -0.938   0.641  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.133   1.301  -0.452  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.779   1.453  -0.425  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.458   1.703  -0.417  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.625  -2.452   0.685  1.00  0.00           N  
HETATM   27  O   UNL     1       1.686   3.148   0.595  1.00  0.00           O  
HETATM   28  O   UNL     1       4.080  -2.672  -0.778  1.00  0.00           O  
HETATM   29  H   UNL     1       2.527   4.850   1.409  1.00  0.00           H  
HETATM   30  H   UNL     1       3.222   3.310   1.967  1.00  0.00           H  
HETATM   31  H   UNL     1       3.588   3.911   0.332  1.00  0.00           H  
HETATM   32  H   UNL     1       6.200   0.767  -0.535  1.00  0.00           H  
HETATM   33  H   UNL     1       5.629   0.773   1.160  1.00  0.00           H  
HETATM   34  H   UNL     1       6.514  -3.069   0.326  1.00  0.00           H  
HETATM   35  H   UNL     1       6.887  -2.158  -1.170  1.00  0.00           H  
HETATM   36  H   UNL     1       2.444  -1.747  -1.038  1.00  0.00           H  
HETATM   37  H   UNL     1       0.201  -0.743  -1.171  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.331  -3.757   1.002  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.786   3.339  -0.094  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.735   2.854  -1.806  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.297   2.971  -0.959  1.00  0.00           H  
HETATM   42  H   UNL     1       3.974   1.879   0.634  1.00  0.00           H  
HETATM   43  H   UNL     1       7.874  -0.637   0.340  1.00  0.00           H  
HETATM   44  H   UNL     1       6.839  -1.178   1.704  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.933   0.768  -0.325  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.555   2.651  -0.599  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.894  -3.059   0.878  1.00  0.00           H  
CONECT    1   27   29   30   31                                       
CONECT    2   21   11    5    5                                       
CONECT    3   22   11   32   33                                       
CONECT    4   12   22   34   35                                       
CONECT    5    2    2    6   36                                       
CONECT    6   19   19    5   37                                       
CONECT    7   13   26   14   14                                       
CONECT    8   14   10   10   15                                       
CONECT    9   15   15   15                                            
CONECT   10   26    8    8   38                                       
CONECT   11   12    2    3                                            
CONECT   12   28   28    4   11                                       
CONECT   13   18   18    7                                            
CONECT   14    7    7   17    8                                       
CONECT   15    8    9    9    9                                       
CONECT   16   23   39   40   41                                       
CONECT   17   24   24   14   23                                       
CONECT   18   25   13   13   24                                       
CONECT   19   20   25    6    6                                       
CONECT   20   27   21   21   19                                       
CONECT   21   20   20    2   42                                       
CONECT   22    4    3   43   44                                       
CONECT   23   17   16   45                                            
CONECT   24   18   17   17                                            
CONECT   25   19   18   46                                            
CONECT   26    7   10   47                                            
CONECT   27    1   20                                                 
CONECT   28   12   12                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38   10                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
