COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.036  -1.451   0.742  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.628  -0.354   0.424  1.00  0.00           C  
HETATM    3  N   UNL     1      -0.350  -0.199   0.027  1.00  0.00           N  
HETATM    4  C   UNL     1       0.107   1.095  -0.486  1.00  0.00           C  
HETATM    5  C   UNL     1       1.227   1.612   0.380  1.00  0.00           C  
HETATM    6  O   UNL     1       1.831   0.853   1.107  1.00  0.00           O  
HETATM    7  N   UNL     1       1.556   2.919   0.346  1.00  0.00           N  
HETATM    8  C   UNL     1       2.703   3.405   1.117  1.00  0.00           C  
HETATM    9  C   UNL     1       3.973   2.691   0.650  1.00  0.00           C  
HETATM   10  C   UNL     1       2.858   4.912   0.906  1.00  0.00           C  
HETATM   11  C   UNL     1       4.055   5.420   1.712  1.00  0.00           C  
HETATM   12  C   UNL     1       2.475   3.120   2.603  1.00  0.00           C  
HETATM   13  C   UNL     1       0.600   0.930  -1.900  1.00  0.00           C  
HETATM   14  C   UNL     1       0.637  -0.226  -2.595  1.00  0.00           C  
HETATM   15  C   UNL     1       1.166   0.064  -3.868  1.00  0.00           C  
HETATM   16  C   UNL     1       1.432   1.385  -3.903  1.00  0.00           C  
HETATM   17  N   UNL     1       1.082   1.923  -2.701  1.00  0.00           N  
HETATM   18  C   UNL     1       1.206   3.335  -2.328  1.00  0.00           C  
HETATM   19  C   UNL     1       0.543  -1.275   0.104  1.00  0.00           C  
HETATM   20  C   UNL     1       0.154  -2.457   0.723  1.00  0.00           C  
HETATM   21  C   UNL     1       1.034  -3.518   0.798  1.00  0.00           C  
HETATM   22  C   UNL     1       1.815  -1.164  -0.443  1.00  0.00           C  
HETATM   23  C   UNL     1       2.694  -2.225  -0.367  1.00  0.00           C  
HETATM   24  C   UNL     1       2.307  -3.404   0.256  1.00  0.00           C  
HETATM   25  N   UNL     1       3.200  -4.481   0.333  1.00  0.00           N  
HETATM   26  C   UNL     1       4.521  -4.252   0.473  1.00  0.00           C  
HETATM   27  C   UNL     1       5.493  -5.403   0.436  1.00  0.00           C  
HETATM   28  O   UNL     1       4.927  -3.120   0.629  1.00  0.00           O  
HETATM   29  C   UNL     1      -2.553   0.836   0.468  1.00  0.00           C  
HETATM   30  N   UNL     1      -3.878   0.407   0.923  1.00  0.00           N  
HETATM   31  N   UNL     1      -4.335   0.359   2.248  1.00  0.00           N  
HETATM   32  N   UNL     1      -5.549  -0.067   2.267  1.00  0.00           N  
HETATM   33  C   UNL     1      -5.975  -0.323   1.013  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.920  -0.020   0.135  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.186  -0.794   0.492  1.00  0.00           C  
HETATM   36  C   UNL     1      -7.330  -0.959  -0.854  1.00  0.00           C  
HETATM   37  C   UNL     1      -6.286  -0.665  -1.722  1.00  0.00           C  
HETATM   38  C   UNL     1      -5.087  -0.193  -1.235  1.00  0.00           C  
HETATM   39  H   UNL     1      -0.721   1.804  -0.471  1.00  0.00           H  
HETATM   40  H   UNL     1       1.035   3.537  -0.190  1.00  0.00           H  
HETATM   41  H   UNL     1       4.135   2.894  -0.409  1.00  0.00           H  
HETATM   42  H   UNL     1       4.825   3.053   1.224  1.00  0.00           H  
HETATM   43  H   UNL     1       3.862   1.617   0.800  1.00  0.00           H  
HETATM   44  H   UNL     1       3.020   5.116  -0.153  1.00  0.00           H  
HETATM   45  H   UNL     1       1.954   5.421   1.239  1.00  0.00           H  
HETATM   46  H   UNL     1       3.893   5.217   2.770  1.00  0.00           H  
HETATM   47  H   UNL     1       4.960   4.911   1.378  1.00  0.00           H  
HETATM   48  H   UNL     1       4.166   6.494   1.561  1.00  0.00           H  
HETATM   49  H   UNL     1       2.365   2.046   2.754  1.00  0.00           H  
HETATM   50  H   UNL     1       3.328   3.481   3.178  1.00  0.00           H  
HETATM   51  H   UNL     1       1.571   3.628   2.937  1.00  0.00           H  
HETATM   52  H   UNL     1       0.320  -1.195  -2.240  1.00  0.00           H  
HETATM   53  H   UNL     1       1.328  -0.643  -4.668  1.00  0.00           H  
HETATM   54  H   UNL     1       1.847   1.925  -4.741  1.00  0.00           H  
HETATM   55  H   UNL     1       2.175   3.503  -1.858  1.00  0.00           H  
HETATM   56  H   UNL     1       1.123   3.955  -3.221  1.00  0.00           H  
HETATM   57  H   UNL     1       0.412   3.597  -1.628  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.836  -2.545   1.145  1.00  0.00           H  
HETATM   59  H   UNL     1       0.732  -4.436   1.280  1.00  0.00           H  
HETATM   60  H   UNL     1       2.115  -0.247  -0.928  1.00  0.00           H  
HETATM   61  H   UNL     1       3.683  -2.138  -0.792  1.00  0.00           H  
HETATM   62  H   UNL     1       2.868  -5.391   0.287  1.00  0.00           H  
HETATM   63  H   UNL     1       5.817  -5.573  -0.591  1.00  0.00           H  
HETATM   64  H   UNL     1       6.359  -5.168   1.056  1.00  0.00           H  
HETATM   65  H   UNL     1       5.007  -6.302   0.817  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.155   1.580   1.157  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.634   1.270  -0.529  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.006  -1.027   1.156  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.267  -1.323  -1.251  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.417  -0.801  -2.785  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.278   0.034  -1.913  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   29    1    1    3                                       
CONECT    3    2   19    4                                            
CONECT    4    5    3   13   39                                       
CONECT    5    6    6    7    4                                       
CONECT    6    5    5                                                 
CONECT    7    8    5   40                                            
CONECT    8   10    9    7   12                                       
CONECT    9    8   41   42   43                                       
CONECT   10   11    8   44   45                                       
CONECT   11   10   46   47   48                                       
CONECT   12    8   49   50   51                                       
CONECT   13   14   14    4   17                                       
CONECT   14   13   13   15   52                                       
CONECT   15   14   16   16   53                                       
CONECT   16   15   15   17   54                                       
CONECT   17   13   16   18                                            
CONECT   18   17   55   56   57                                       
CONECT   19   20    3   22   22                                       
CONECT   20   21   21   19   58                                       
CONECT   21   20   20   24   59                                       
CONECT   22   19   19   23   60                                       
CONECT   23   24   24   22   61                                       
CONECT   24   21   25   23   23                                       
CONECT   25   26   24   62                                            
CONECT   26   28   28   27   25                                       
CONECT   27   26   63   64   65                                       
CONECT   28   26   26                                                 
CONECT   29   30    2   66   67                                       
CONECT   30   34   29   31                                            
CONECT   31   30   32   32                                            
CONECT   32   33   31   31                                            
CONECT   33   35   35   34   32                                       
CONECT   34   38   38   33   30                                       
CONECT   35   36   33   33   68                                       
CONECT   36   37   37   35   69                                       
CONECT   37   36   36   38   70                                       
CONECT   38   37   34   34   71                                       
CONECT   39    4                                                      
CONECT   40    7                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   25                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
CONECT   68   35                                                      
CONECT   69   36                                                      
CONECT   70   37                                                      
CONECT   71   38                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
