COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.016  -0.678  -0.101  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.307  -1.878  -0.018  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.958  -1.869   0.184  1.00  0.00           C  
HETATM    4  N   UNL     1       1.410   0.946  -0.268  1.00  0.00           N  
HETATM    5  N   UNL     1      10.311  -1.263   0.259  1.00  0.00           N  
HETATM    6  C   UNL     1      -9.092  -1.984  -0.431  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.451   2.859   0.632  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.003   1.777   0.534  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.330   1.736   0.335  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.989   0.563   0.220  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.359   0.538   0.015  1.00  0.00           C  
HETATM   12  N   UNL     1      -8.392  -0.702  -0.308  1.00  0.00           N  
HETATM   13  C   UNL     1      -9.550  -2.450   0.953  1.00  0.00           C  
HETATM   14  C   UNL     1      -9.141   0.553  -0.402  1.00  0.00           C  
HETATM   15  C   UNL     1      -9.188   1.011  -1.861  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.233   0.601   0.638  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.833  -0.613   0.525  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.031  -1.885   0.621  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.280  -0.651   0.308  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.745   0.690   0.861  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.036   0.859  -0.485  1.00  0.00           C  
HETATM   22  C   UNL     1       2.073   2.090  -0.054  1.00  0.00           C  
HETATM   23  O   UNL     1       1.542   3.183  -0.022  1.00  0.00           O  
HETATM   24  N   UNL     1       3.396   1.892   0.122  1.00  0.00           N  
HETATM   25  C   UNL     1       3.606   0.452   0.007  1.00  0.00           C  
HETATM   26  C   UNL     1       2.241  -0.120  -0.253  1.00  0.00           C  
HETATM   27  O   UNL     1       1.949  -1.286  -0.414  1.00  0.00           O  
HETATM   28  C   UNL     1       4.233  -0.136   1.284  1.00  0.00           C  
HETATM   29  C   UNL     1       5.746   0.057   1.002  1.00  0.00           C  
HETATM   30  N   UNL     1       5.895  -0.167  -0.449  1.00  0.00           N  
HETATM   31  C   UNL     1       4.600   0.097  -1.101  1.00  0.00           C  
HETATM   32  C   UNL     1       7.026  -0.549  -1.073  1.00  0.00           C  
HETATM   33  O   UNL     1       7.032  -0.703  -2.280  1.00  0.00           O  
HETATM   34  C   UNL     1       8.255  -0.781  -0.295  1.00  0.00           C  
HETATM   35  N   UNL     1       8.389  -0.653   1.050  1.00  0.00           N  
HETATM   36  C   UNL     1       9.616  -0.936   1.380  1.00  0.00           C  
HETATM   37  C   UNL     1       9.464  -1.168  -0.793  1.00  0.00           C  
HETATM   38  H   UNL     1      -6.830  -2.818  -0.113  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.415  -2.800   0.248  1.00  0.00           H  
HETATM   40  H   UNL     1      11.246  -1.516   0.220  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.960  -1.863  -1.079  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.419  -2.726  -0.860  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.913   1.462  -0.055  1.00  0.00           H  
HETATM   44  H   UNL     1     -10.070  -3.403   0.861  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.681  -2.571   1.601  1.00  0.00           H  
HETATM   46  H   UNL     1     -10.223  -1.708   1.382  1.00  0.00           H  
HETATM   47  H   UNL     1     -10.157   0.399  -0.037  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.650   1.316   0.202  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.680   0.248  -2.465  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.745   1.945  -1.931  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.173   1.165  -2.227  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.695  -2.742   0.506  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.278  -1.900  -0.166  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.541  -1.933   1.594  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.523   1.546   1.498  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.395  -0.223   1.343  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.387   1.772  -0.967  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.258   0.004  -1.122  1.00  0.00           H  
HETATM   59  H   UNL     1       4.070   2.569   0.290  1.00  0.00           H  
HETATM   60  H   UNL     1       3.925   0.427   2.166  1.00  0.00           H  
HETATM   61  H   UNL     1       3.986  -1.192   1.390  1.00  0.00           H  
HETATM   62  H   UNL     1       6.055   1.069   1.263  1.00  0.00           H  
HETATM   63  H   UNL     1       6.332  -0.673   1.561  1.00  0.00           H  
HETATM   64  H   UNL     1       4.263  -0.793  -1.633  1.00  0.00           H  
HETATM   65  H   UNL     1       4.697   0.932  -1.796  1.00  0.00           H  
HETATM   66  H   UNL     1      10.017  -0.915   2.382  1.00  0.00           H  
HETATM   67  H   UNL     1       9.702  -1.359  -1.829  1.00  0.00           H  
CONECT    1    2   12   11   11                                       
CONECT    2    3    3    1   38                                       
CONECT    3    2    2   19   39                                       
CONECT    4   21   26   22                                            
CONECT    5   37   36   40                                            
CONECT    6   13   12   41   42                                       
CONECT    7    8    8                                                 
CONECT    8   16    9    7    7                                       
CONECT    9   10    8                                                 
CONECT   10   19   19   11    9                                       
CONECT   11    1    1   10   43                                       
CONECT   12    6    1   14                                            
CONECT   13    6   44   45   46                                       
CONECT   14   12   15   47   48                                       
CONECT   15   14   49   50   51                                       
CONECT   16   17   17   20    8                                       
CONECT   17   18   19   16   16                                       
CONECT   18   17   52   53   54                                       
CONECT   19    3   17   10   10                                       
CONECT   20   16   21   55   56                                       
CONECT   21   20    4   57   58                                       
CONECT   22    4   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   59                                            
CONECT   25   26   24   31   28                                       
CONECT   26    4   27   27   25                                       
CONECT   27   26   26                                                 
CONECT   28   25   29   60   61                                       
CONECT   29   28   30   62   63                                       
CONECT   30   31   29   32                                            
CONECT   31   25   30   64   65                                       
CONECT   32   30   33   33   34                                       
CONECT   33   32   32                                                 
CONECT   34   32   37   37   35                                       
CONECT   35   34   36   36                                            
CONECT   36   35   35    5   66                                       
CONECT   37   34   34    5   67                                       
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   24                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   31                                                      
CONECT   65   31                                                      
CONECT   66   36                                                      
CONECT   67   37                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
