COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.388  -2.107  -0.123  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.447   1.171  -0.102  1.00  0.00           O  
HETATM    3  C   UNL     1       3.181  -3.026  -0.796  1.00  0.00           C  
HETATM    4  C   UNL     1       4.558  -2.922  -0.740  1.00  0.00           C  
HETATM    5  C   UNL     1       5.140  -1.901  -0.010  1.00  0.00           C  
HETATM    6  C   UNL     1       6.649  -1.788   0.053  1.00  0.00           C  
HETATM    7  C   UNL     1       7.071  -0.543  -0.734  1.00  0.00           C  
HETATM    8  C   UNL     1       5.662   1.099   0.467  1.00  0.00           C  
HETATM    9  C   UNL     1       5.007   0.124   1.451  1.00  0.00           C  
HETATM   10  N   UNL     1       0.994  -2.211  -0.179  1.00  0.00           N  
HETATM   11  C   UNL     1       0.233  -1.099  -0.155  1.00  0.00           C  
HETATM   12  O   UNL     1       0.759  -0.002  -0.182  1.00  0.00           O  
HETATM   13  N   UNL     1       6.993   0.646   0.098  1.00  0.00           N  
HETATM   14  C   UNL     1       4.357  -0.989   0.656  1.00  0.00           C  
HETATM   15  N   UNL     1      -7.488  -2.400   0.206  1.00  0.00           N  
HETATM   16  C   UNL     1       0.001   5.889  -0.188  1.00  0.00           C  
HETATM   17  C   UNL     1       2.980  -1.086   0.612  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.840  -2.472  -0.065  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.199  -2.578   0.001  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.995  -1.430   0.032  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.405  -0.169  -0.004  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.028  -0.054  -0.071  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.319   2.303  -0.074  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.500   3.568  -0.114  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.234  -1.211  -0.096  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.087   4.162   1.064  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.332   5.319   1.027  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.423   5.302  -1.366  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.173   4.141  -1.329  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.471  -1.556   0.104  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.181  -2.721   0.145  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.396  -0.493   0.138  1.00  0.00           C  
HETATM   33  N   UNL     1      -7.597  -1.004   0.197  1.00  0.00           N  
HETATM   34  H   UNL     1       2.723  -3.822  -1.364  1.00  0.00           H  
HETATM   35  H   UNL     1       5.178  -3.636  -1.262  1.00  0.00           H  
HETATM   36  H   UNL     1       6.967  -1.692   1.091  1.00  0.00           H  
HETATM   37  H   UNL     1       7.103  -2.675  -0.390  1.00  0.00           H  
HETATM   38  H   UNL     1       8.097  -0.670  -1.082  1.00  0.00           H  
HETATM   39  H   UNL     1       6.414  -0.422  -1.594  1.00  0.00           H  
HETATM   40  H   UNL     1       5.046   1.169  -0.430  1.00  0.00           H  
HETATM   41  H   UNL     1       5.733   2.082   0.930  1.00  0.00           H  
HETATM   42  H   UNL     1       5.765  -0.292   2.115  1.00  0.00           H  
HETATM   43  H   UNL     1       4.252   0.647   2.038  1.00  0.00           H  
HETATM   44  H   UNL     1       0.575  -3.084  -0.235  1.00  0.00           H  
HETATM   45  H   UNL     1       7.583   0.558   0.913  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.226  -3.027   0.244  1.00  0.00           H  
HETATM   47  H   UNL     1       0.587   6.795  -0.217  1.00  0.00           H  
HETATM   48  H   UNL     1       2.367  -0.368   1.137  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.230  -3.363  -0.088  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.661  -3.553   0.029  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.022   0.717   0.020  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.983   2.272  -0.938  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.911   2.283   0.841  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.350   3.719   2.013  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.001   5.778   1.947  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.168   5.750  -2.315  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.497   3.678  -2.249  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.770  -3.720   0.131  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.155   0.559   0.118  1.00  0.00           H  
CONECT    1    3    3   17   10                                       
CONECT    2   23   22                                                 
CONECT    3    4    1    1   34                                       
CONECT    4    5    5    3   35                                       
CONECT    5    6    4    4   14                                       
CONECT    6    7    5   36   37                                       
CONECT    7    6   13   38   39                                       
CONECT    8   13    9   40   41                                       
CONECT    9   14    8   42   43                                       
CONECT   10    1   11   44                                            
CONECT   11   10   12   12   25                                       
CONECT   12   11   11                                                 
CONECT   13    7    8   45                                            
CONECT   14    5    9   17   17                                       
CONECT   15   33   31   46                                            
CONECT   16   27   28   28   47                                       
CONECT   17   14   14    1   48                                       
CONECT   18   25   19   19   49                                       
CONECT   19   18   18   20   50                                       
CONECT   20   21   21   19   30                                       
CONECT   21   22   20   20   51                                       
CONECT   22    2   25   25   21                                       
CONECT   23   24    2   52   53                                       
CONECT   24   26   23   29   29                                       
CONECT   25   11   22   22   18                                       
CONECT   26   27   27   24   54                                       
CONECT   27   26   26   16   55                                       
CONECT   28   16   16   29   56                                       
CONECT   29   24   24   28   57                                       
CONECT   30   20   32   31   31                                       
CONECT   31   30   30   15   58                                       
CONECT   32   30   33   33   59                                       
CONECT   33   32   32   15                                            
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   13                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
