COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.611   0.430  -0.040  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.843   1.793  -0.172  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.780   2.677  -0.220  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.489   2.208  -0.136  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.241   0.839  -0.003  1.00  0.00           C  
HETATM    6  C   UNL     1       1.238   1.997  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       3.138   3.457   0.030  1.00  0.00           C  
HETATM    8  C   UNL     1       4.209  -0.138   0.080  1.00  0.00           C  
HETATM    9  C   UNL     1       4.900  -2.198   0.115  1.00  0.00           C  
HETATM   10  C   UNL     1       2.393  -1.910   0.073  1.00  0.00           C  
HETATM   11  C   UNL     1       2.125  -2.744   1.327  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.067  -2.270   1.461  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.348  -1.829   0.024  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.534  -2.622  -0.530  1.00  0.00           C  
HETATM   15  O   UNL     1      -5.659  -0.434   0.005  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.142   2.886  -0.156  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.143   1.818  -0.027  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.781   0.638   0.061  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.233  -0.441   0.177  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.315  -0.051   0.039  1.00  0.00           C  
HETATM   21  C   UNL     1       1.764   3.286   0.003  1.00  0.00           C  
HETATM   22  C   UNL     1       3.947   2.332   0.052  1.00  0.00           C  
HETATM   23  C   UNL     1       3.356   1.070   0.056  1.00  0.00           C  
HETATM   24  N   UNL     1       2.034   0.942   0.025  1.00  0.00           N  
HETATM   25  N   UNL     1       5.523  -0.168   0.103  1.00  0.00           N  
HETATM   26  N   UNL     1       5.925  -1.389   0.124  1.00  0.00           N  
HETATM   27  N   UNL     1       3.780  -1.438   0.087  1.00  0.00           N  
HETATM   28  C   UNL     1       2.159  -2.770  -1.171  1.00  0.00           C  
HETATM   29  O   UNL     1       0.779  -3.133  -1.246  1.00  0.00           O  
HETATM   30  H   UNL     1      -5.856   2.163  -0.239  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.963   3.737  -0.323  1.00  0.00           H  
HETATM   32  H   UNL     1       3.570   4.447   0.033  1.00  0.00           H  
HETATM   33  H   UNL     1       4.938  -3.278   0.128  1.00  0.00           H  
HETATM   34  H   UNL     1       1.718  -1.054   0.055  1.00  0.00           H  
HETATM   35  H   UNL     1       1.093  -3.095   1.316  1.00  0.00           H  
HETATM   36  H   UNL     1       2.800  -3.600   1.345  1.00  0.00           H  
HETATM   37  H   UNL     1       2.292  -2.132   2.213  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.830  -3.334   1.475  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.223  -1.705   1.856  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.947  -2.086   2.077  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.468  -2.013  -0.592  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.414  -2.438   0.085  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.734  -2.308  -1.555  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.297  -3.686  -0.516  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.003   3.416  -1.099  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.058   3.579   0.680  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.136  -1.111   0.142  1.00  0.00           H  
HETATM   48  H   UNL     1       1.108   4.143  -0.015  1.00  0.00           H  
HETATM   49  H   UNL     1       5.022   2.432   0.073  1.00  0.00           H  
HETATM   50  H   UNL     1       2.435  -2.204  -2.061  1.00  0.00           H  
HETATM   51  H   UNL     1       2.770  -3.671  -1.110  1.00  0.00           H  
HETATM   52  H   UNL     1       0.558  -3.680  -2.013  1.00  0.00           H  
CONECT    1    2    2   20   15                                       
CONECT    2    3    1    1   30                                       
CONECT    3    4    4    2   31                                       
CONECT    4   16    3    3    5                                       
CONECT    5    4   18   20   20                                       
CONECT    6   24   24   21   17                                       
CONECT    7   22   21   21   32                                       
CONECT    8   25   25   27   23                                       
CONECT    9   26   26   27   33                                       
CONECT   10   27   11   28   34                                       
CONECT   11   10   35   36   37                                       
CONECT   12   13   38   39   40                                       
CONECT   13   15   14   12   41                                       
CONECT   14   13   42   43   44                                       
CONECT   15    1   13                                                 
CONECT   16   17    4   45   46                                       
CONECT   17    6   16   18                                            
CONECT   18   17   19   19    5                                       
CONECT   19   18   18                                                 
CONECT   20    5    5    1   47                                       
CONECT   21    7    7    6   48                                       
CONECT   22   23   23    7   49                                       
CONECT   23    8   22   22   24                                       
CONECT   24   23    6    6                                            
CONECT   25   26    8    8                                            
CONECT   26    9    9   25                                            
CONECT   27    9    8   10                                            
CONECT   28   29   10   50   51                                       
CONECT   29   28   52                                                 
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
