COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.414   2.876   0.272  1.00  0.00           C  
HETATM    2  C   UNL     1       5.384   2.000  -0.005  1.00  0.00           C  
HETATM    3  C   UNL     1       0.236  -1.139   0.121  1.00  0.00           C  
HETATM    4  C   UNL     1       2.951  -3.535  -0.742  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.286   3.894  -0.031  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.407   3.931  -1.086  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.871   2.588  -0.493  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.706   1.377   0.299  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.239   0.017   0.193  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.559  -1.139   0.381  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.662  -0.378  -0.141  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.930  -3.617   0.336  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.121  -1.217   0.735  1.00  0.00           C  
HETATM   14  N   UNL     1       3.337  -2.127  -0.617  1.00  0.00           N  
HETATM   15  C   UNL     1       2.541  -1.056  -0.789  1.00  0.00           C  
HETATM   16  N   UNL     1       3.253   0.021  -0.585  1.00  0.00           N  
HETATM   17  C   UNL     1       4.512  -0.320  -0.280  1.00  0.00           C  
HETATM   18  N   UNL     1       4.609  -1.631  -0.288  1.00  0.00           N  
HETATM   19  C   UNL     1       5.616   0.627   0.019  1.00  0.00           C  
HETATM   20  C   UNL     1       6.887   0.145   0.324  1.00  0.00           C  
HETATM   21  C   UNL     1       7.910   1.030   0.600  1.00  0.00           C  
HETATM   22  C   UNL     1       7.676   2.392   0.570  1.00  0.00           C  
HETATM   23  C   UNL     1       1.079  -1.092  -1.154  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.185  -1.173  -0.234  1.00  0.00           N  
HETATM   25  N   UNL     1      -4.483   2.432  -0.018  1.00  0.00           N  
HETATM   26  O   UNL     1      -2.562   1.555   0.674  1.00  0.00           O  
HETATM   27  N   UNL     1      -4.372  -2.226   0.202  1.00  0.00           N  
HETATM   28  N   UNL     1      -5.646  -1.853  -0.113  1.00  0.00           N  
HETATM   29  O   UNL     1      -1.786  -1.321   1.898  1.00  0.00           O  
HETATM   30  H   UNL     1       6.236   3.941   0.254  1.00  0.00           H  
HETATM   31  H   UNL     1       4.401   2.379  -0.241  1.00  0.00           H  
HETATM   32  H   UNL     1       0.490  -2.032   0.692  1.00  0.00           H  
HETATM   33  H   UNL     1       0.438  -0.253   0.723  1.00  0.00           H  
HETATM   34  H   UNL     1       3.100  -3.862  -1.771  1.00  0.00           H  
HETATM   35  H   UNL     1       3.564  -4.141  -0.076  1.00  0.00           H  
HETATM   36  H   UNL     1       1.901  -3.649  -0.473  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.313   4.203  -0.413  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.550   4.381   0.908  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.119   4.744  -0.942  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.047   3.856  -2.112  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.601   2.691   0.310  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.164   1.854  -1.244  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.352   0.010   0.609  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.935  -0.016  -1.132  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.145  -3.971   1.344  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.459  -4.237  -0.388  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.858  -3.676   0.150  1.00  0.00           H  
HETATM   48  H   UNL     1       7.072  -0.919   0.345  1.00  0.00           H  
HETATM   49  H   UNL     1       8.895   0.657   0.837  1.00  0.00           H  
HETATM   50  H   UNL     1       8.479   3.081   0.786  1.00  0.00           H  
HETATM   51  H   UNL     1       0.877  -1.978  -1.756  1.00  0.00           H  
HETATM   52  H   UNL     1       0.826  -0.199  -1.725  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.452  -1.165  -1.166  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.925  -2.235  -1.005  1.00  0.00           H  
CONECT    1   22    2    2   30                                       
CONECT    2   19    1    1   31                                       
CONECT    3   23   24   32   33                                       
CONECT    4   14   34   35   36                                       
CONECT    5    6   25   37   38                                       
CONECT    6    5    7   39   40                                       
CONECT    7    6   25   41   42                                       
CONECT    8   25   26   26    9                                       
CONECT    9    8   10   10   11                                       
CONECT   10    9    9   27   13                                       
CONECT   11    9   28   43   44                                       
CONECT   12   27   45   46   47                                       
CONECT   13   24   10   29   29                                       
CONECT   14   15   18    4                                            
CONECT   15   14   16   16   23                                       
CONECT   16   15   15   17                                            
CONECT   17   16   18   18   19                                       
CONECT   18   14   17   17                                            
CONECT   19   17   20   20    2                                       
CONECT   20   19   19   21   48                                       
CONECT   21   20   22   22   49                                       
CONECT   22   21   21    1   50                                       
CONECT   23   15    3   51   52                                       
CONECT   24    3   13   53                                            
CONECT   25    5    7    8                                            
CONECT   26    8    8                                                 
CONECT   27   10   28   12                                            
CONECT   28   27   11   54                                            
CONECT   29   13   13                                                 
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   28                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
