COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.194   3.012   1.330  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.455   2.820   0.785  1.00  0.00           C  
HETATM    3  C   UNL     1       4.863  -0.206   0.377  1.00  0.00           C  
HETATM    4  C   UNL     1       3.836   0.739  -0.250  1.00  0.00           C  
HETATM    5  C   UNL     1       5.310  -1.734   2.303  1.00  0.00           C  
HETATM    6  C   UNL     1       0.115  -0.151  -0.359  1.00  0.00           C  
HETATM    7  C   UNL     1       1.407   0.591  -0.133  1.00  0.00           C  
HETATM    8  C   UNL     1       0.130  -1.457   0.437  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.107  -2.256   0.116  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.257  -2.079   0.862  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.391  -2.811   0.567  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.376  -3.721  -0.474  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.227  -3.897  -1.220  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.093  -3.162  -0.929  1.00  0.00           C  
HETATM   15  B   UNL     1       4.383   1.269  -1.623  1.00  0.00           B  
HETATM   16  C   UNL     1       4.357  -0.677   1.742  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.641   1.133  -0.530  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.370   1.331   0.007  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.234   0.493  -0.442  1.00  0.00           C  
HETATM   20  C   UNL     1       4.292   0.513   2.701  1.00  0.00           C  
HETATM   21  N   UNL     1       2.580   0.018  -0.469  1.00  0.00           N  
HETATM   22  N   UNL     1      -1.008   0.678   0.086  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.649   1.888  -0.130  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.181   2.268   0.933  1.00  0.00           N  
HETATM   25  O   UNL     1       3.478   1.618  -2.660  1.00  0.00           O  
HETATM   26  O   UNL     1       5.782   1.400  -1.827  1.00  0.00           O  
HETATM   27  O   UNL     1       1.392   1.702   0.352  1.00  0.00           O  
HETATM   28  O   UNL     1      -2.408  -0.363  -1.288  1.00  0.00           O  
HETATM   29  H   UNL     1      -4.041   3.776   2.078  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.281   3.435   1.110  1.00  0.00           H  
HETATM   31  H   UNL     1       5.009  -1.068  -0.274  1.00  0.00           H  
HETATM   32  H   UNL     1       5.811   0.319   0.503  1.00  0.00           H  
HETATM   33  H   UNL     1       3.660   1.581   0.421  1.00  0.00           H  
HETATM   34  H   UNL     1       6.305  -1.303   2.414  1.00  0.00           H  
HETATM   35  H   UNL     1       4.949  -2.069   3.275  1.00  0.00           H  
HETATM   36  H   UNL     1       5.356  -2.582   1.620  1.00  0.00           H  
HETATM   37  H   UNL     1       0.004  -0.373  -1.420  1.00  0.00           H  
HETATM   38  H   UNL     1       1.015  -2.035   0.170  1.00  0.00           H  
HETATM   39  H   UNL     1       0.151  -1.233   1.503  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.269  -1.368   1.675  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.290  -2.674   1.151  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.263  -4.293  -0.703  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.215  -4.608  -2.033  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.196  -3.297  -1.514  1.00  0.00           H  
HETATM   45  H   UNL     1       3.362  -1.108   1.631  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.799   0.371  -1.279  1.00  0.00           H  
HETATM   47  H   UNL     1       5.258   1.019   2.717  1.00  0.00           H  
HETATM   48  H   UNL     1       3.523   1.208   2.366  1.00  0.00           H  
HETATM   49  H   UNL     1       4.051   0.159   3.704  1.00  0.00           H  
HETATM   50  H   UNL     1       2.592  -0.871  -0.857  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.869   1.361   0.761  1.00  0.00           H  
HETATM   52  H   UNL     1       2.547   1.495  -2.428  1.00  0.00           H  
HETATM   53  H   UNL     1       6.314   1.189  -1.048  1.00  0.00           H  
CONECT    1   24    2    2   29                                       
CONECT    2    1    1   23   30                                       
CONECT    3   16    4   31   32                                       
CONECT    4    3   15   21   33                                       
CONECT    5   16   34   35   36                                       
CONECT    6    7    8   22   37                                       
CONECT    7   21   27   27    6                                       
CONECT    8    6    9   38   39                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   40                                       
CONECT   11   10   12   12   41                                       
CONECT   12   11   11   13   42                                       
CONECT   13   14   14   12   43                                       
CONECT   14    9   13   13   44                                       
CONECT   15   26    4   25                                            
CONECT   16    5    3   20   45                                       
CONECT   17   18   23   23   46                                       
CONECT   18   19   24   24   17                                       
CONECT   19   22   28   28   18                                       
CONECT   20   16   47   48   49                                       
CONECT   21    4    7   50                                            
CONECT   22    6   19   51                                            
CONECT   23   17   17    2                                            
CONECT   24   18   18    1                                            
CONECT   25   15   52                                                 
CONECT   26   15   53                                                 
CONECT   27    7    7                                                 
CONECT   28   19   19                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
