COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.133  -0.276  -2.464  1.00  0.00           C  
HETATM    2  O   UNL     1       0.248   0.814  -2.202  1.00  0.00           O  
HETATM    3  C   UNL     1       2.351   0.231  -3.239  1.00  0.00           C  
HETATM    4  N   UNL     1       3.066   1.229  -2.433  1.00  0.00           N  
HETATM    5  C   UNL     1       1.880   0.873  -4.548  1.00  0.00           C  
HETATM    6  O   UNL     1       3.010   1.218  -5.351  1.00  0.00           O  
HETATM    7  C   UNL     1       1.003  -0.135  -5.300  1.00  0.00           C  
HETATM    8  O   UNL     1       0.431   0.489  -6.450  1.00  0.00           O  
HETATM    9  C   UNL     1      -0.112  -0.616  -4.370  1.00  0.00           C  
HETATM   10  O   UNL     1       0.452  -1.266  -3.233  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.011  -1.599  -5.123  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.578  -0.949  -6.262  1.00  0.00           O  
HETATM   13  C   UNL     1      -2.133  -2.075  -4.198  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.375   0.942   1.116  1.00  0.00           C  
HETATM   15  N   UNL     1      -3.307   0.491   2.158  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.963   0.636  -0.262  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.993   1.105  -1.347  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.558   0.811  -2.670  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.658   0.375  -1.188  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.069   0.682   0.189  1.00  0.00           C  
HETATM   21  O   UNL     1       1.177   0.000   0.338  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.040   0.212   1.275  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.490   0.498   2.562  1.00  0.00           O  
HETATM   24  C   UNL     1      -1.023  -0.472   3.464  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.810   0.000   4.904  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.497   1.235   5.111  1.00  0.00           O  
HETATM   27  C   UNL     1       0.690   0.199   5.147  1.00  0.00           C  
HETATM   28  N   UNL     1       0.923   0.501   6.566  1.00  0.00           N  
HETATM   29  C   UNL     1       0.858   1.962   6.703  1.00  0.00           C  
HETATM   30  C   UNL     1       1.428  -1.088   4.767  1.00  0.00           C  
HETATM   31  O   UNL     1       1.053  -2.133   5.667  1.00  0.00           O  
HETATM   32  C   UNL     1       2.939  -0.861   4.845  1.00  0.00           C  
HETATM   33  C   UNL     1       1.042  -1.480   3.338  1.00  0.00           C  
HETATM   34  O   UNL     1      -0.361  -1.719   3.262  1.00  0.00           O  
HETATM   35  H   UNL     1       1.461  -0.712  -1.520  1.00  0.00           H  
HETATM   36  H   UNL     1       3.017  -0.602  -3.461  1.00  0.00           H  
HETATM   37  H   UNL     1       3.356   0.764  -1.586  1.00  0.00           H  
HETATM   38  H   UNL     1       3.907   1.462  -2.938  1.00  0.00           H  
HETATM   39  H   UNL     1       1.299   1.769  -4.328  1.00  0.00           H  
HETATM   40  H   UNL     1       2.665   1.606  -6.167  1.00  0.00           H  
HETATM   41  H   UNL     1       1.611  -0.985  -5.610  1.00  0.00           H  
HETATM   42  H   UNL     1       1.168   0.776  -7.007  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.704   0.238  -4.042  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.421  -2.455  -5.449  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.091  -0.199  -5.930  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.773  -2.775  -4.734  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.701  -2.571  -3.328  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.723  -1.219  -3.871  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.215   2.016   1.212  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.168   0.997   2.015  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.505  -0.479   1.969  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.123  -0.437  -0.358  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.914   1.156  -0.375  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.833   2.179  -1.251  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.484   1.211  -2.686  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.008   1.326  -3.342  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.818  -0.698  -1.284  1.00  0.00           H  
HETATM   58  H   UNL     1       0.090   1.755   0.285  1.00  0.00           H  
HETATM   59  H   UNL     1       1.583   0.333   1.149  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.200  -0.861   1.179  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.090  -0.594   3.277  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.194  -0.751   5.595  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.435   1.064   4.948  1.00  0.00           H  
HETATM   64  H   UNL     1       1.052   1.024   4.534  1.00  0.00           H  
HETATM   65  H   UNL     1       1.875   0.233   6.766  1.00  0.00           H  
HETATM   66  H   UNL     1       1.027   2.237   7.744  1.00  0.00           H  
HETATM   67  H   UNL     1       1.625   2.420   6.078  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.124   2.313   6.389  1.00  0.00           H  
HETATM   69  H   UNL     1       1.530  -2.926   5.389  1.00  0.00           H  
HETATM   70  H   UNL     1       3.459  -1.778   4.567  1.00  0.00           H  
HETATM   71  H   UNL     1       3.222  -0.061   4.160  1.00  0.00           H  
HETATM   72  H   UNL     1       3.212  -0.582   5.862  1.00  0.00           H  
HETATM   73  H   UNL     1       1.580  -2.384   3.053  1.00  0.00           H  
HETATM   74  H   UNL     1       1.309  -0.671   2.658  1.00  0.00           H  
CONECT    1    2    3   10   35                                       
CONECT    2    1   19                                                 
CONECT    3    1    4    5   36                                       
CONECT    4    3   37   38                                            
CONECT    5    3    6    7   39                                       
CONECT    6    5   40                                                 
CONECT    7    5    8    9   41                                       
CONECT    8    7   42                                                 
CONECT    9    7   10   11   43                                       
CONECT   10    1    9                                                 
CONECT   11    9   12   13   44                                       
CONECT   12   11   45                                                 
CONECT   13   11   46   47   48                                       
CONECT   14   15   16   22   49                                       
CONECT   15   14   50   51                                            
CONECT   16   14   17   52   53                                       
CONECT   17   16   18   19   54                                       
CONECT   18   17   55   56                                            
CONECT   19    2   17   20   57                                       
CONECT   20   19   21   22   58                                       
CONECT   21   20   59                                                 
CONECT   22   14   20   23   60                                       
CONECT   23   22   24                                                 
CONECT   24   23   25   34   61                                       
CONECT   25   24   26   27   62                                       
CONECT   26   25   63                                                 
CONECT   27   25   28   30   64                                       
CONECT   28   27   29   65                                            
CONECT   29   28   66   67   68                                       
CONECT   30   27   31   32   33                                       
CONECT   31   30   69                                                 
CONECT   32   30   70   71   72                                       
CONECT   33   30   34   73   74                                       
CONECT   34   24   33                                                 
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
CONECT   68   29                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
CONECT   74   33                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
