COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.632  -5.543   2.230  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.162  -4.561   1.908  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.553  -3.288   1.489  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.582  -2.342   1.192  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.187  -1.108   0.789  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.144  -0.125   0.479  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.574  -0.429   0.590  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.492   0.518   0.292  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.875   0.224   0.400  1.00  0.00           C  
HETATM   10  O   UNL     1      -7.236  -0.881   0.762  1.00  0.00           O  
HETATM   11  N   UNL     1      -7.790   1.168   0.102  1.00  0.00           N  
HETATM   12  C   UNL     1      -9.218   0.864   0.214  1.00  0.00           C  
HETATM   13  C   UNL     1     -10.034   2.098  -0.178  1.00  0.00           C  
HETATM   14  O   UNL     1      -9.817   2.392  -1.559  1.00  0.00           O  
HETATM   15  C   UNL     1     -10.537   3.534  -2.030  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.841  -0.808   0.685  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.442   0.458   0.271  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.394   1.427  -0.039  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.725   1.145   0.064  1.00  0.00           C  
HETATM   20  N   UNL     1       0.914   0.758   0.168  1.00  0.00           N  
HETATM   21  C   UNL     1       1.786  -0.159  -0.400  1.00  0.00           C  
HETATM   22  N   UNL     1       3.093   0.064  -0.345  1.00  0.00           N  
HETATM   23  C   UNL     1       3.969  -0.778  -0.870  1.00  0.00           C  
HETATM   24  C   UNL     1       3.535  -1.951  -1.510  1.00  0.00           C  
HETATM   25  C   UNL     1       4.481  -2.863  -2.078  1.00  0.00           C  
HETATM   26  N   UNL     1       5.232  -3.587  -2.529  1.00  0.00           N  
HETATM   27  C   UNL     1       2.151  -2.213  -1.584  1.00  0.00           C  
HETATM   28  N   UNL     1       1.676  -3.358  -2.206  1.00  0.00           N  
HETATM   29  C   UNL     1       1.276  -1.298  -1.011  1.00  0.00           C  
HETATM   30  N   UNL     1       5.322  -0.501  -0.787  1.00  0.00           N  
HETATM   31  C   UNL     1       5.780   0.721  -0.120  1.00  0.00           C  
HETATM   32  C   UNL     1       5.196   1.941  -0.835  1.00  0.00           C  
HETATM   33  C   UNL     1       5.674   3.217  -0.139  1.00  0.00           C  
HETATM   34  C   UNL     1       7.202   3.282  -0.186  1.00  0.00           C  
HETATM   35  C   UNL     1       5.209   3.208   1.319  1.00  0.00           C  
HETATM   36  C   UNL     1       5.793   1.988   2.033  1.00  0.00           C  
HETATM   37  C   UNL     1       5.315   0.712   1.337  1.00  0.00           C  
HETATM   38  C   UNL     1       7.321   2.052   1.986  1.00  0.00           C  
HETATM   39  C   UNL     1       7.786   2.061   0.528  1.00  0.00           C  
HETATM   40  C   UNL     1       7.308   0.785  -0.168  1.00  0.00           C  
HETATM   41  H   UNL     1      -0.927  -2.903   2.294  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.942  -3.452   0.601  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.894  -1.410   0.911  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.172   1.498  -0.029  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.502   2.048  -0.185  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.467   0.037  -0.451  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.451   0.586   1.242  1.00  0.00           H  
HETATM   48  H   UNL     1     -11.093   1.901  -0.011  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.722   2.948   0.428  1.00  0.00           H  
HETATM   50  H   UNL     1     -10.235   4.413  -1.462  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.319   3.691  -3.086  1.00  0.00           H  
HETATM   52  H   UNL     1     -11.607   3.367  -1.901  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.100  -1.557   0.925  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.076   2.408  -0.359  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.457   1.902  -0.179  1.00  0.00           H  
HETATM   56  H   UNL     1       1.248   1.609   0.492  1.00  0.00           H  
HETATM   57  H   UNL     1       2.298  -3.990  -2.598  1.00  0.00           H  
HETATM   58  H   UNL     1       0.721  -3.526  -2.249  1.00  0.00           H  
HETATM   59  H   UNL     1       0.210  -1.466  -1.048  1.00  0.00           H  
HETATM   60  H   UNL     1       5.967  -1.115  -1.170  1.00  0.00           H  
HETATM   61  H   UNL     1       5.527   1.948  -1.873  1.00  0.00           H  
HETATM   62  H   UNL     1       4.107   1.895  -0.801  1.00  0.00           H  
HETATM   63  H   UNL     1       5.258   4.087  -0.647  1.00  0.00           H  
HETATM   64  H   UNL     1       7.534   3.288  -1.224  1.00  0.00           H  
HETATM   65  H   UNL     1       7.543   4.190   0.310  1.00  0.00           H  
HETATM   66  H   UNL     1       5.550   4.117   1.815  1.00  0.00           H  
HETATM   67  H   UNL     1       4.121   3.162   1.352  1.00  0.00           H  
HETATM   68  H   UNL     1       5.462   1.981   3.071  1.00  0.00           H  
HETATM   69  H   UNL     1       4.226   0.666   1.371  1.00  0.00           H  
HETATM   70  H   UNL     1       5.731  -0.158   1.846  1.00  0.00           H  
HETATM   71  H   UNL     1       7.662   2.961   2.482  1.00  0.00           H  
HETATM   72  H   UNL     1       7.738   1.183   2.495  1.00  0.00           H  
HETATM   73  H   UNL     1       8.875   2.107   0.495  1.00  0.00           H  
HETATM   74  H   UNL     1       7.724  -0.084   0.341  1.00  0.00           H  
HETATM   75  H   UNL     1       7.639   0.792  -1.206  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    3    1    1    1                                       
CONECT    3    4    2   41   42                                       
CONECT    4    5    3                                                 
CONECT    5   16   16    6    4                                       
CONECT    6   19   19    5    7                                       
CONECT    7    6    8    8   43                                       
CONECT    8    7    7    9   44                                       
CONECT    9    8   11   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   12    9   45                                            
CONECT   12   13   11   46   47                                       
CONECT   13   12   14   48   49                                       
CONECT   14   13   15                                                 
CONECT   15   14   50   51   52                                       
CONECT   16   17    5    5   53                                       
CONECT   17   20   18   18   16                                       
CONECT   18   17   17   19   54                                       
CONECT   19   18    6    6   55                                       
CONECT   20   21   17   56                                            
CONECT   21   22   22   29   20                                       
CONECT   22   23   21   21                                            
CONECT   23   30   24   24   22                                       
CONECT   24   25   23   23   27                                       
CONECT   25   26   26   26   24                                       
CONECT   26   25   25   25                                            
CONECT   27   24   28   29   29                                       
CONECT   28   27   57   58                                            
CONECT   29   27   27   21   59                                       
CONECT   30   31   23   60                                            
CONECT   31   32   30   40   37                                       
CONECT   32   33   31   61   62                                       
CONECT   33   32   34   35   63                                       
CONECT   34   33   39   64   65                                       
CONECT   35   33   36   66   67                                       
CONECT   36   35   37   38   68                                       
CONECT   37   31   36   69   70                                       
CONECT   38   39   36   71   72                                       
CONECT   39   34   40   38   73                                       
CONECT   40   31   39   74   75                                       
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   32                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
CONECT   70   37                                                      
CONECT   71   38                                                      
CONECT   72   38                                                      
CONECT   73   39                                                      
CONECT   74   40                                                      
CONECT   75   40                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
