COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.971   0.000   0.055  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.377   0.389   0.037  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.496   0.251  -0.997  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.071   1.301   0.920  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.342   0.777   0.852  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.708  -0.252   0.432  1.00  0.00           C  
HETATM    7  C   UNL     1       6.183   2.226  -0.263  1.00  0.00           C  
HETATM    8  C   UNL     1       5.066   3.041  -0.252  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.604  -0.818  -0.799  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.614  -0.283  -0.007  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.330  -0.300  -0.736  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.053   0.766   0.125  1.00  0.00           C  
HETATM   13  C   UNL     1       1.311   1.324   0.195  1.00  0.00           C  
HETATM   14  C   UNL     1       3.806   2.480  -0.201  1.00  0.00           C  
HETATM   15  C   UNL     1       3.115  -3.122   0.224  1.00  0.00           C  
HETATM   16  C   UNL     1       3.298  -1.637   0.403  1.00  0.00           C  
HETATM   17  C   UNL     1       2.201  -0.888  -0.354  1.00  0.00           C  
HETATM   18  C   UNL     1       3.660   1.098  -0.163  1.00  0.00           C  
HETATM   19  C   UNL     1       4.780   0.282  -0.177  1.00  0.00           C  
HETATM   20  C   UNL     1       4.661  -1.219  -0.148  1.00  0.00           C  
HETATM   21  C   UNL     1       6.041   0.853  -0.231  1.00  0.00           C  
HETATM   22  N   UNL     1       2.373   0.549  -0.100  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.903  -0.812  -0.073  1.00  0.00           N  
HETATM   24  N   UNL     1      -6.216  -0.493  -0.102  1.00  0.00           N  
HETATM   25  O   UNL     1       2.195  -3.542  -0.438  1.00  0.00           O  
HETATM   26  O   UNL     1      -4.813   1.177   0.316  1.00  0.00           O  
HETATM   27  O   UNL     1       1.477   2.485   0.518  1.00  0.00           O  
HETATM   28  O   UNL     1       3.972  -3.978   0.801  1.00  0.00           O  
HETATM   29  H   UNL     1      -7.166   1.387   0.420  1.00  0.00           H  
HETATM   30  H   UNL     1      -9.021   1.159  -1.294  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.368  -0.496  -1.781  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.861   2.126   1.583  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.129   1.190   1.466  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.721  -1.331   0.589  1.00  0.00           H  
HETATM   35  H   UNL     1      -9.373   0.324   1.075  1.00  0.00           H  
HETATM   36  H   UNL     1       7.169   2.665  -0.301  1.00  0.00           H  
HETATM   37  H   UNL     1       5.179   4.115  -0.281  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.819  -1.642  -1.464  1.00  0.00           H  
HETATM   39  H   UNL     1       0.454  -0.715  -1.352  1.00  0.00           H  
HETATM   40  H   UNL     1       2.932   3.115  -0.192  1.00  0.00           H  
HETATM   41  H   UNL     1       3.240  -1.387   1.463  1.00  0.00           H  
HETATM   42  H   UNL     1       2.291  -1.083  -1.422  1.00  0.00           H  
HETATM   43  H   UNL     1       1.222  -1.212   0.000  1.00  0.00           H  
HETATM   44  H   UNL     1       5.447  -1.630   0.486  1.00  0.00           H  
HETATM   45  H   UNL     1       4.775  -1.609  -1.159  1.00  0.00           H  
HETATM   46  H   UNL     1       6.917   0.221  -0.240  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.031  -1.763  -0.210  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.342  -1.433  -0.306  1.00  0.00           H  
HETATM   49  H   UNL     1       3.814  -4.922   0.658  1.00  0.00           H  
CONECT    1   26   26   23   24                                       
CONECT    2   24    6    3   29                                       
CONECT    3    2    6   30   31                                       
CONECT    4   12   12    5   32                                       
CONECT    5    4   10   10   33                                       
CONECT    6    2    3   34   35                                       
CONECT    7   21   21    8   36                                       
CONECT    8   14   14    7   37                                       
CONECT    9   11   11   10   38                                       
CONECT   10    5    5    9   23                                       
CONECT   11   12    9    9   39                                       
CONECT   12   13    4    4   11                                       
CONECT   13   27   27   22   12                                       
CONECT   14   18    8    8   40                                       
CONECT   15   25   25   28   16                                       
CONECT   16   15   17   20   41                                       
CONECT   17   16   22   42   43                                       
CONECT   18   22   19   19   14                                       
CONECT   19   20   18   18   21                                       
CONECT   20   16   19   44   45                                       
CONECT   21   19    7    7   46                                       
CONECT   22   17   13   18                                            
CONECT   23   10    1   47                                            
CONECT   24    1    2   48                                            
CONECT   25   15   15                                                 
CONECT   26    1    1                                                 
CONECT   27   13   13                                                 
CONECT   28   15   49                                                 
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
