COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.199   2.385  -0.299  1.00  0.00           C  
HETATM    2  C   UNL     1       2.585   2.243  -0.127  1.00  0.00           C  
HETATM    3  C   UNL     1       3.110   0.963   0.067  1.00  0.00           C  
HETATM    4  C   UNL     1       2.080   4.364  -0.406  1.00  0.00           C  
HETATM    5  C   UNL     1       0.970   0.098  -0.086  1.00  0.00           C  
HETATM    6  C   UNL     1       5.238  -1.238  -0.914  1.00  0.00           C  
HETATM    7  C   UNL     1       5.796  -2.647  -0.703  1.00  0.00           C  
HETATM    8  C   UNL     1       7.121  -2.562   0.056  1.00  0.00           C  
HETATM    9  C   UNL     1       6.889  -1.896   1.414  1.00  0.00           C  
HETATM   10  C   UNL     1       6.331  -0.488   1.203  1.00  0.00           C  
HETATM   11  C   UNL     1       5.006  -0.572   0.444  1.00  0.00           C  
HETATM   12  N   UNL     1       4.471   0.776   0.242  1.00  0.00           N  
HETATM   13  N   UNL     1       2.276  -0.072   0.080  1.00  0.00           N  
HETATM   14  N   UNL     1       3.113   3.516  -0.200  1.00  0.00           N  
HETATM   15  N   UNL     1       0.959   3.701  -0.459  1.00  0.00           N  
HETATM   16  N   UNL     1       0.431   1.291  -0.273  1.00  0.00           N  
HETATM   17  N   UNL     1       0.142  -1.014  -0.064  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.249  -0.852  -0.113  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.050  -1.877  -0.599  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.423  -3.163  -1.074  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.421  -1.718  -0.646  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.827   0.331   0.330  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.197   0.489   0.282  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.998  -0.534  -0.208  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.388  -0.373  -0.256  1.00  0.00           N  
HETATM   26  C   UNL     1      -5.783   0.948   0.253  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.301   1.105   0.127  1.00  0.00           C  
HETATM   28  O   UNL     1      -7.944   0.039   0.831  1.00  0.00           O  
HETATM   29  C   UNL     1      -7.583  -1.262   0.361  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.068  -1.443   0.489  1.00  0.00           C  
HETATM   31  H   UNL     1       2.170   5.436  -0.507  1.00  0.00           H  
HETATM   32  H   UNL     1       5.950  -0.648  -1.491  1.00  0.00           H  
HETATM   33  H   UNL     1       5.084  -3.237  -0.127  1.00  0.00           H  
HETATM   34  H   UNL     1       7.519  -3.565   0.206  1.00  0.00           H  
HETATM   35  H   UNL     1       7.833  -1.972  -0.521  1.00  0.00           H  
HETATM   36  H   UNL     1       6.177  -2.487   1.991  1.00  0.00           H  
HETATM   37  H   UNL     1       7.834  -1.836   1.955  1.00  0.00           H  
HETATM   38  H   UNL     1       6.166  -0.014   2.171  1.00  0.00           H  
HETATM   39  H   UNL     1       7.043   0.103   0.626  1.00  0.00           H  
HETATM   40  H   UNL     1       4.294  -1.163   1.021  1.00  0.00           H  
HETATM   41  H   UNL     1       5.071   1.539   0.230  1.00  0.00           H  
HETATM   42  H   UNL     1       4.049   3.757  -0.121  1.00  0.00           H  
HETATM   43  H   UNL     1       0.525  -1.903  -0.015  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.350  -3.861  -0.240  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.040  -3.599  -1.860  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.427  -2.958  -1.465  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.044  -2.515  -1.024  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.204   1.126   0.712  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.646   1.409   0.627  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.493   1.037   1.300  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.288   1.726  -0.329  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.605   2.060   0.555  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.584   1.070  -0.925  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.091  -2.019   0.958  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.875  -1.366  -0.684  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.781  -2.411   0.079  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.783  -1.392   1.540  1.00  0.00           H  
HETATM   58  H   UNL     1       4.293  -1.298  -1.455  1.00  0.00           H  
HETATM   59  H   UNL     1       5.961  -3.121  -1.671  1.00  0.00           H  
CONECT    1   15   16   16    2                                       
CONECT    2    1   14    3    3                                       
CONECT    3    2    2   13   12                                       
CONECT    4   15   15   14   31                                       
CONECT    5   16   17   13   13                                       
CONECT    6   11    7   32   58                                       
CONECT    7    6    8   33   59                                       
CONECT    8    9    7   34   35                                       
CONECT    9   10    8   36   37                                       
CONECT   10   11    9   38   39                                       
CONECT   11   12   10    6   40                                       
CONECT   12    3   11   41                                            
CONECT   13    5    5    3                                            
CONECT   14    4    2   42                                            
CONECT   15    4    4    1                                            
CONECT   16    1    1    5                                            
CONECT   17    5   18   43                                            
CONECT   18   17   19   19   22                                       
CONECT   19   20   18   18   21                                       
CONECT   20   19   44   45   46                                       
CONECT   21   19   24   24   47                                       
CONECT   22   18   23   23   48                                       
CONECT   23   22   22   24   49                                       
CONECT   24   21   21   23   25                                       
CONECT   25   24   26   30                                            
CONECT   26   25   27   50   51                                       
CONECT   27   26   28   52   53                                       
CONECT   28   27   29                                                 
CONECT   29   30   28   54   55                                       
CONECT   30   25   29   56   57                                       
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58    6                                                      
CONECT   59    7                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
