COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -7.211  -2.077   0.690  1.00  0.00           N  
HETATM    2  C   UNL     1      -8.186  -2.310   1.764  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.850  -1.957   1.232  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.241  -3.351   1.394  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.003  -1.144   0.287  1.00  0.00           C  
HETATM    6  O   UNL     1      -5.485  -0.708  -0.737  1.00  0.00           O  
HETATM    7  N   UNL     1      -3.710  -0.902   0.580  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.886  -0.112  -0.338  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.436  -0.477  -0.153  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.998  -0.674   0.961  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.079   1.377  -0.045  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.560   1.737  -0.185  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.753   3.226   0.109  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.930   4.052  -0.882  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.450   3.692  -0.742  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.257   2.203  -1.036  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.626  -0.584  -1.224  1.00  0.00           N  
HETATM   18  C   UNL     1       0.779  -1.019  -1.197  1.00  0.00           C  
HETATM   19  C   UNL     1       1.584  -0.094  -0.321  1.00  0.00           C  
HETATM   20  O   UNL     1       1.045   0.841   0.230  1.00  0.00           O  
HETATM   21  C   UNL     1       1.305  -0.961  -2.646  1.00  0.00           C  
HETATM   22  C   UNL     1       0.337   0.042  -3.327  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.002  -0.291  -2.619  1.00  0.00           C  
HETATM   24  N   UNL     1       2.905  -0.307  -0.152  1.00  0.00           N  
HETATM   25  C   UNL     1       3.649   0.547   0.656  1.00  0.00           C  
HETATM   26  C   UNL     1       4.998   0.482   0.941  1.00  0.00           C  
HETATM   27  N   UNL     1       5.441   1.431   1.744  1.00  0.00           N  
HETATM   28  N   UNL     1       4.615   2.306   2.181  1.00  0.00           N  
HETATM   29  S   UNL     1       3.096   1.931   1.523  1.00  0.00           S  
HETATM   30  C   UNL     1       5.881  -0.573   0.387  1.00  0.00           C  
HETATM   31  C   UNL     1       7.202  -0.277   0.056  1.00  0.00           C  
HETATM   32  C   UNL     1       8.019  -1.263  -0.459  1.00  0.00           C  
HETATM   33  C   UNL     1       7.529  -2.543  -0.647  1.00  0.00           C  
HETATM   34  C   UNL     1       6.219  -2.842  -0.320  1.00  0.00           C  
HETATM   35  C   UNL     1       5.394  -1.866   0.202  1.00  0.00           C  
HETATM   36  H   UNL     1      -7.259  -2.804  -0.007  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.162  -1.476   2.465  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.185  -2.395   1.335  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.936  -3.233   2.288  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.888  -1.462   2.203  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.203  -3.845   0.423  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.232  -3.262   1.796  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.854  -3.938   2.077  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.325  -1.251   1.399  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.185  -0.322  -1.366  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.748   1.592   0.971  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.891   1.521  -1.201  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.145   1.148   0.521  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.807   3.482   0.008  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.421   3.441   1.124  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.262   3.836  -1.898  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.068   5.113  -0.673  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.864   4.280  -1.448  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.118   3.908   0.274  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.202   1.946  -0.935  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.588   1.987  -2.051  1.00  0.00           H  
HETATM   57  H   UNL     1       0.843  -2.039  -0.817  1.00  0.00           H  
HETATM   58  H   UNL     1       2.328  -0.587  -2.670  1.00  0.00           H  
HETATM   59  H   UNL     1       1.240  -1.941  -3.119  1.00  0.00           H  
HETATM   60  H   UNL     1       0.641   1.071  -3.133  1.00  0.00           H  
HETATM   61  H   UNL     1       0.269  -0.147  -4.399  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.470  -1.163  -3.077  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.675   0.566  -2.658  1.00  0.00           H  
HETATM   64  H   UNL     1       3.336  -1.055  -0.593  1.00  0.00           H  
HETATM   65  H   UNL     1       7.586   0.722   0.202  1.00  0.00           H  
HETATM   66  H   UNL     1       9.043  -1.034  -0.716  1.00  0.00           H  
HETATM   67  H   UNL     1       8.172  -3.311  -1.051  1.00  0.00           H  
HETATM   68  H   UNL     1       5.843  -3.844  -0.464  1.00  0.00           H  
HETATM   69  H   UNL     1       4.372  -2.101   0.457  1.00  0.00           H  
CONECT    1    2    3   36                                            
CONECT    2    1   37   38   39                                       
CONECT    3    1    4    5   40                                       
CONECT    4    3   41   42   43                                       
CONECT    5    3    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    8   44    5                                            
CONECT    8    7   11    9   45                                       
CONECT    9    8   10   10   17                                       
CONECT   10    9    9                                                 
CONECT   11    8   16   12   46                                       
CONECT   12   11   13   47   48                                       
CONECT   13   12   14   49   50                                       
CONECT   14   13   15   51   52                                       
CONECT   15   14   16   53   54                                       
CONECT   16   11   15   55   56                                       
CONECT   17   18   23    9                                            
CONECT   18   17   19   21   57                                       
CONECT   19   18   20   20   24                                       
CONECT   20   19   19                                                 
CONECT   21   18   22   58   59                                       
CONECT   22   21   23   60   61                                       
CONECT   23   17   22   62   63                                       
CONECT   24   25   64   19                                            
CONECT   25   26   26   29   24                                       
CONECT   26   27   30   25   25                                       
CONECT   27   28   28   26                                            
CONECT   28   27   27   29                                            
CONECT   29   28   25                                                 
CONECT   30   35   26   31   31                                       
CONECT   31   30   30   32   65                                       
CONECT   32   33   33   31   66                                       
CONECT   33   34   32   32   67                                       
CONECT   34   35   35   33   68                                       
CONECT   35   34   34   30   69                                       
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    4                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   18                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   35                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
