COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.364  -2.829  -0.189  1.00  0.00           C  
HETATM    2  C   UNL     1       0.084  -3.224   0.306  1.00  0.00           C  
HETATM    3  C   UNL     1       0.433  -4.358   0.988  1.00  0.00           C  
HETATM    4  C   UNL     1       1.862  -4.711   1.047  1.00  0.00           C  
HETATM    5  N   UNL     1       2.751  -3.904   0.445  1.00  0.00           N  
HETATM    6  C   UNL     1       4.792  -2.566  -0.617  1.00  0.00           C  
HETATM    7  C   UNL     1       3.405  -1.964  -0.850  1.00  0.00           C  
HETATM    8  C   UNL     1       3.127  -1.890  -2.353  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.331  -2.816   0.200  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.045  -1.187  -0.389  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.136   0.161  -1.107  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.417   0.414  -2.137  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.604   0.958  -1.823  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.458   1.554  -0.496  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.304   2.256   0.377  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.557   2.408   1.877  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.131   1.309  -0.100  1.00  0.00           C  
HETATM   18  N   UNL     1       3.355  -0.616  -0.278  1.00  0.00           N  
HETATM   19  N   UNL     1       1.076  -2.470  -0.278  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.653  -1.644  -0.382  1.00  0.00           N  
HETATM   21  N   UNL     1      -4.528   0.618  -1.114  1.00  0.00           N  
HETATM   22  N   UNL     1      -8.617   2.521   0.032  1.00  0.00           N  
HETATM   23  N   UNL     1      -6.810   2.660   1.543  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.730   1.754   1.090  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.505  -5.135   1.583  1.00  0.00           O  
HETATM   26  O   UNL     1       2.232  -5.710   1.641  1.00  0.00           O  
HETATM   27  O   UNL     1      -2.206  -3.537   0.638  1.00  0.00           O  
HETATM   28  H   UNL     1       4.829  -3.569  -1.043  1.00  0.00           H  
HETATM   29  H   UNL     1       5.545  -1.940  -1.096  1.00  0.00           H  
HETATM   30  H   UNL     1       4.990  -2.618   0.453  1.00  0.00           H  
HETATM   31  H   UNL     1       2.139  -1.461  -2.520  1.00  0.00           H  
HETATM   32  H   UNL     1       3.880  -1.264  -2.832  1.00  0.00           H  
HETATM   33  H   UNL     1       3.164  -2.893  -2.779  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.396  -1.076   0.637  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.665  -1.918  -0.908  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.516   0.892  -0.588  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.785   0.050  -2.133  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.198  -0.110  -3.056  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.495   0.956  -2.434  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.196   2.754   2.834  1.00  0.00           H  
HETATM   41  H   UNL     1       2.713  -0.408   0.419  1.00  0.00           H  
HETATM   42  H   UNL     1       0.839  -1.664  -0.764  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.963  -1.103  -0.797  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.964   2.221  -0.822  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.190   3.008   0.645  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.145  -5.910   2.036  1.00  0.00           H  
HETATM   47  C   UNL     1       4.202   0.335  -0.720  1.00  0.00           C  
HETATM   48  O   UNL     1       4.156   1.574  -0.194  1.00  0.00           O  
HETATM   49  C   UNL     1       5.097   2.548  -0.717  1.00  0.00           C  
HETATM   50  C   UNL     1       4.899   3.866  -0.014  1.00  0.00           C  
HETATM   51  C   UNL     1       5.606   4.147   1.140  1.00  0.00           C  
HETATM   52  C   UNL     1       5.425   5.356   1.785  1.00  0.00           C  
HETATM   53  C   UNL     1       4.537   6.285   1.275  1.00  0.00           C  
HETATM   54  C   UNL     1       3.830   6.004   0.120  1.00  0.00           C  
HETATM   55  C   UNL     1       4.015   4.797  -0.527  1.00  0.00           C  
HETATM   56  O   UNL     1       5.006   0.075  -1.592  1.00  0.00           O  
HETATM   57  H   UNL     1       6.115   2.196  -0.550  1.00  0.00           H  
HETATM   58  H   UNL     1       4.929   2.677  -1.786  1.00  0.00           H  
HETATM   59  H   UNL     1       6.300   3.421   1.538  1.00  0.00           H  
HETATM   60  H   UNL     1       5.977   5.575   2.687  1.00  0.00           H  
HETATM   61  H   UNL     1       4.394   7.229   1.779  1.00  0.00           H  
HETATM   62  H   UNL     1       3.136   6.729  -0.278  1.00  0.00           H  
HETATM   63  H   UNL     1       3.463   4.577  -1.429  1.00  0.00           H  
CONECT    1    5    5   19    7                                       
CONECT    2    3    3    9   19                                       
CONECT    3   25    4    2    2                                       
CONECT    4   26   26    3    5                                       
CONECT    5    4    1    1                                            
CONECT    6    7   28   29   30                                       
CONECT    7   18    1    6    8                                       
CONECT    8    7   31   32   33                                       
CONECT    9   27   27    2   20                                       
CONECT   10   20   11   34   35                                       
CONECT   11   10   21   36   37                                       
CONECT   12   21   13   13   38                                       
CONECT   13   12   12   14   39                                       
CONECT   14   13   17   17   15                                       
CONECT   15   14   23   23   22                                       
CONECT   16   24   24   23   40                                       
CONECT   17   21   14   14   24                                       
CONECT   18    7   41   47                                            
CONECT   19    2    1   42                                            
CONECT   20    9   10   43                                            
CONECT   21   11   12   17                                            
CONECT   22   15   44   45                                            
CONECT   23   16   15   15                                            
CONECT   24   17   16   16                                            
CONECT   25    3   46                                                 
CONECT   26    4    4                                                 
CONECT   27    9    9                                                 
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   18   48   56   56                                       
CONECT   48   47   49                                                 
CONECT   49   48   50   57   58                                       
CONECT   50   49   51   55   55                                       
CONECT   51   50   52   52   59                                       
CONECT   52   51   51   53   60                                       
CONECT   53   52   54   54   61                                       
CONECT   54   53   53   55   62                                       
CONECT   55   54   50   50   63                                       
CONECT   56   47   47                                                 
CONECT   57   49                                                      
CONECT   58   49                                                      
CONECT   59   51                                                      
CONECT   60   52                                                      
CONECT   61   53                                                      
CONECT   62   54                                                      
CONECT   63   55                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
