COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.204  -0.402   0.170  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.182  -1.043  -1.152  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.721   1.372  -0.443  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.004   2.720  -0.549  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.066   3.658  -0.160  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.842   3.251   0.337  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.552   1.906   0.447  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.434  -4.617   0.010  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.739  -3.185  -0.104  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.761  -2.543   1.218  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.160  -1.074   1.062  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.784  -2.513  -0.996  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.494   0.960   0.061  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.217   1.463   0.988  1.00  0.00           C  
HETATM   15  N   UNL     1       0.664   1.098  -0.123  1.00  0.00           N  
HETATM   16  C   UNL     1       1.951   0.658   0.130  1.00  0.00           C  
HETATM   17  C   UNL     1       2.420   0.552   1.458  1.00  0.00           C  
HETATM   18  N   UNL     1       3.632   0.138   1.698  1.00  0.00           N  
HETATM   19  N   UNL     1       4.494  -0.212   0.654  1.00  0.00           N  
HETATM   20  C   UNL     1       5.851  -0.675   0.957  1.00  0.00           C  
HETATM   21  C   UNL     1       4.088  -0.127  -0.628  1.00  0.00           C  
HETATM   22  O   UNL     1       4.847  -0.434  -1.534  1.00  0.00           O  
HETATM   23  C   UNL     1       2.788   0.311  -0.914  1.00  0.00           C  
HETATM   24  C   UNL     1       2.311   0.409  -2.341  1.00  0.00           C  
HETATM   25  H   UNL     1      -3.172  -0.980  -1.603  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.458  -0.536  -1.790  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.454   0.640  -0.747  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.960   3.041  -0.937  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.290   4.711  -0.245  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.109   3.987   0.636  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.195  -5.103   0.622  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.424  -5.067  -0.982  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.458  -4.744   0.477  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.485  -3.051   1.856  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.771  -2.606   1.669  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.149  -0.589   2.039  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.161  -1.011   0.636  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.795  -2.998  -1.972  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.783  -2.575  -0.570  1.00  0.00           H  
HETATM   40  H   UNL     1       0.233   2.277   1.556  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.357   0.600   1.640  1.00  0.00           H  
HETATM   42  H   UNL     1       0.345   1.164  -1.037  1.00  0.00           H  
HETATM   43  H   UNL     1       1.770   0.818   2.279  1.00  0.00           H  
HETATM   44  H   UNL     1       6.000  -0.680   2.037  1.00  0.00           H  
HETATM   45  H   UNL     1       5.986  -1.684   0.567  1.00  0.00           H  
HETATM   46  H   UNL     1       6.575  -0.007   0.493  1.00  0.00           H  
HETATM   47  H   UNL     1       2.537   1.400  -2.733  1.00  0.00           H  
HETATM   48  H   UNL     1       2.817  -0.345  -2.945  1.00  0.00           H  
HETATM   49  H   UNL     1       1.235   0.241  -2.376  1.00  0.00           H  
CONECT    1    2   13   11                                            
CONECT    2   12    1   25   26                                       
CONECT    3   13   13    4   27                                       
CONECT    4    5    5    3   28                                       
CONECT    5    6    4    4   29                                       
CONECT    6    7    7    5   30                                       
CONECT    7   14    6    6   13                                       
CONECT    8    9   31   32   33                                       
CONECT    9   12    8   10                                            
CONECT   10    9   11   34   35                                       
CONECT   11    1   10   36   37                                       
CONECT   12    2    9   38   39                                       
CONECT   13    7    1    3    3                                       
CONECT   14   15    7   40   41                                       
CONECT   15   14   16   42                                            
CONECT   16   15   23   23   17                                       
CONECT   17   16   18   18   43                                       
CONECT   18   17   17   19                                            
CONECT   19   21   18   20                                            
CONECT   20   19   44   45   46                                       
CONECT   21   23   22   22   19                                       
CONECT   22   21   21                                                 
CONECT   23   24   16   16   21                                       
CONECT   24   23   47   48   49                                       
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
