COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.567   2.128   0.310  1.00  0.00           C  
HETATM    2  N   UNL     1      -8.227   0.486   0.811  1.00  0.00           N  
HETATM    3  O   UNL     1       0.266  -0.962  -0.458  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.075   0.742  -0.020  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.123   0.371   0.027  1.00  0.00           O  
HETATM    6  C   UNL     1       0.220   0.356  -0.162  1.00  0.00           C  
HETATM    7  O   UNL     1       1.233   2.408   0.254  1.00  0.00           O  
HETATM    8  C   UNL     1      -0.985  -1.462  -0.516  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.490  -2.729  -0.778  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.852  -2.948  -0.769  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.734  -1.913  -0.500  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.258  -0.642  -0.236  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.517   0.083  -0.102  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.283   1.379  -0.382  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.780   1.075  -0.458  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.539  -0.784   1.078  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.034  -0.535   1.200  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.875  -0.406  -0.242  1.00  0.00           C  
HETATM   19  C   UNL     1       1.386   1.232  -0.016  1.00  0.00           C  
HETATM   20  C   UNL     1       8.743  -1.600   1.387  1.00  0.00           C  
HETATM   21  C   UNL     1       3.736   1.660  -0.022  1.00  0.00           C  
HETATM   22  C   UNL     1       5.036   0.930  -0.241  1.00  0.00           C  
HETATM   23  C   UNL     1       5.582   0.857  -1.509  1.00  0.00           C  
HETATM   24  C   UNL     1       6.774   0.188  -1.714  1.00  0.00           C  
HETATM   25  C   UNL     1       7.424  -0.410  -0.651  1.00  0.00           C  
HETATM   26  C   UNL     1       6.879  -0.337   0.623  1.00  0.00           C  
HETATM   27  C   UNL     1       5.685   0.340   0.826  1.00  0.00           C  
HETATM   28  O   UNL     1       7.515  -0.924   1.670  1.00  0.00           O  
HETATM   29  O   UNL     1       2.629   0.735  -0.181  1.00  0.00           O  
HETATM   30  H   UNL     1      -1.729   2.685  -0.612  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.504   2.059   0.863  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.823   2.642   0.920  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.100   1.133   1.574  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.814  -3.545  -0.990  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.235  -3.936  -0.975  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.797  -2.100  -0.497  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.670  -0.616  -0.924  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.097   2.093   0.421  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.948   1.802  -1.329  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.967   0.372  -1.270  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.330   1.998  -0.643  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.913  -1.211   2.009  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.727  -1.478   0.259  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.523  -1.480   1.383  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.845   0.148   2.028  1.00  0.00           H  
HETATM   46  H   UNL     1       8.560  -2.400   0.670  1.00  0.00           H  
HETATM   47  H   UNL     1       9.458  -0.892   0.968  1.00  0.00           H  
HETATM   48  H   UNL     1       9.145  -2.022   2.308  1.00  0.00           H  
HETATM   49  H   UNL     1       3.719   2.077   0.985  1.00  0.00           H  
HETATM   50  H   UNL     1       3.644   2.466  -0.750  1.00  0.00           H  
HETATM   51  H   UNL     1       5.075   1.323  -2.342  1.00  0.00           H  
HETATM   52  H   UNL     1       7.198   0.132  -2.706  1.00  0.00           H  
HETATM   53  H   UNL     1       8.355  -0.933  -0.812  1.00  0.00           H  
HETATM   54  H   UNL     1       5.261   0.401   1.818  1.00  0.00           H  
CONECT    1    4   30   31   32                                       
CONECT    2   15   16   33                                            
CONECT    3    6    8                                                 
CONECT    4    1    6    6   18                                       
CONECT    5   12   13                                                 
CONECT    6    3    4    4   19                                       
CONECT    7   19   19                                                 
CONECT    8    3    9    9   18                                       
CONECT    9    8    8   10   34                                       
CONECT   10    9   11   11   35                                       
CONECT   11   10   10   12   36                                       
CONECT   12    5   11   18   18                                       
CONECT   13    5   14   17   37                                       
CONECT   14   13   15   38   39                                       
CONECT   15    2   14   40   41                                       
CONECT   16    2   17   42   43                                       
CONECT   17   13   16   44   45                                       
CONECT   18    4    8   12   12                                       
CONECT   19    6    7    7   29                                       
CONECT   20   28   46   47   48                                       
CONECT   21   22   29   49   50                                       
CONECT   22   21   23   23   27                                       
CONECT   23   22   22   24   51                                       
CONECT   24   23   25   25   52                                       
CONECT   25   24   24   26   53                                       
CONECT   26   25   27   27   28                                       
CONECT   27   22   26   26   54                                       
CONECT   28   20   26                                                 
CONECT   29   19   21                                                 
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
