COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.948  -3.287   1.236  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.770  -3.125   0.045  1.00  0.00           C  
HETATM    3  O   UNL     1      -6.417  -3.902  -0.845  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.849  -2.071  -0.426  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.647  -1.878  -1.795  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.785  -0.893  -2.233  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.119  -0.095  -1.322  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.182  -1.261   0.493  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.314  -0.278   0.042  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.638   0.532   0.960  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.687   1.426   0.519  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.024   2.757   0.224  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.410   3.224   0.381  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.750   4.469  -0.008  1.00  0.00           N  
HETATM   15  O   UNL     1      -4.250   2.487   0.862  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.336   1.036   0.355  1.00  0.00           C  
HETATM   17  C   UNL     1       0.604   1.992  -0.101  1.00  0.00           C  
HETATM   18  N   UNL     1       0.215   3.247  -0.371  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.025   3.636  -0.223  1.00  0.00           C  
HETATM   20  C   UNL     1       0.075  -0.275   0.636  1.00  0.00           C  
HETATM   21  C   UNL     1       1.378  -0.628   0.471  1.00  0.00           C  
HETATM   22  C   UNL     1       2.322   0.308   0.021  1.00  0.00           C  
HETATM   23  C   UNL     1       1.942   1.609  -0.265  1.00  0.00           C  
HETATM   24  C   UNL     1       3.736  -0.099  -0.150  1.00  0.00           C  
HETATM   25  C   UNL     1       4.421   0.175  -1.334  1.00  0.00           C  
HETATM   26  N   UNL     1       5.683  -0.205  -1.449  1.00  0.00           N  
HETATM   27  C   UNL     1       6.299  -0.836  -0.462  1.00  0.00           C  
HETATM   28  O   UNL     1       7.589  -1.211  -0.625  1.00  0.00           O  
HETATM   29  C   UNL     1       8.206  -0.886  -1.873  1.00  0.00           C  
HETATM   30  N   UNL     1       5.689  -1.117   0.678  1.00  0.00           N  
HETATM   31  C   UNL     1       4.425  -0.766   0.877  1.00  0.00           C  
HETATM   32  O   UNL     1       3.805  -1.056   2.046  1.00  0.00           O  
HETATM   33  C   UNL     1       4.573  -1.747   3.033  1.00  0.00           C  
HETATM   34  H   UNL     1      -7.013  -4.575  -0.488  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.164  -2.500  -2.510  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.630  -0.746  -3.292  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.446   0.674  -1.671  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.338  -1.402   1.552  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.838   0.464   1.906  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.080   5.057  -0.392  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.664   4.778   0.096  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.287   4.658  -0.454  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.642  -1.004   0.984  1.00  0.00           H  
HETATM   44  H   UNL     1       1.690  -1.639   0.689  1.00  0.00           H  
HETATM   45  H   UNL     1       2.673   2.324  -0.611  1.00  0.00           H  
HETATM   46  H   UNL     1       3.928   0.689  -2.145  1.00  0.00           H  
HETATM   47  H   UNL     1       9.236  -1.242  -1.873  1.00  0.00           H  
HETATM   48  H   UNL     1       7.657  -1.364  -2.685  1.00  0.00           H  
HETATM   49  H   UNL     1       8.195   0.195  -2.013  1.00  0.00           H  
HETATM   50  H   UNL     1       3.959  -1.917   3.918  1.00  0.00           H  
HETATM   51  H   UNL     1       4.904  -2.705   2.631  1.00  0.00           H  
HETATM   52  H   UNL     1       5.442  -1.147   3.303  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    4    3                                       
CONECT    3    2   34                                                 
CONECT    4    5    2    8    8                                       
CONECT    5    6    6    4   35                                       
CONECT    6    5    5    7   36                                       
CONECT    7    6    9    9   37                                       
CONECT    8    4    4    9   38                                       
CONECT    9    7    7    8   10                                       
CONECT   10    9   11   39                                            
CONECT   11   16   10   12   12                                       
CONECT   12   11   11   19   13                                       
CONECT   13   12   15   15   14                                       
CONECT   14   13   40   41                                            
CONECT   15   13   13                                                 
CONECT   16   20   20   17   11                                       
CONECT   17   23   23   16   18                                       
CONECT   18   17   19   19                                            
CONECT   19   18   18   12   42                                       
CONECT   20   21   16   16   43                                       
CONECT   21   22   22   20   44                                       
CONECT   22   24   21   21   23                                       
CONECT   23   22   17   17   45                                       
CONECT   24   31   31   25   22                                       
CONECT   25   26   26   24   46                                       
CONECT   26   27   25   25                                            
CONECT   27   28   30   30   26                                       
CONECT   28   29   27                                                 
CONECT   29   28   47   48   49                                       
CONECT   30   27   27   31                                            
CONECT   31   30   32   24   24                                       
CONECT   32   33   31                                                 
CONECT   33   32   50   51   52                                       
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   29                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   33                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
