COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.176   0.111  -0.008  1.00  0.00           N  
HETATM    2  C   UNL     1       4.673   0.011   0.002  1.00  0.00           C  
HETATM    3  C   UNL     1       3.458  -0.644   0.003  1.00  0.00           C  
HETATM    4  C   UNL     1       2.272   0.092  -0.004  1.00  0.00           C  
HETATM    5  C   UNL     1       5.954  -0.782   0.009  1.00  0.00           C  
HETATM    6  C   UNL     1       6.770  -0.445  -1.241  1.00  0.00           C  
HETATM    7  C   UNL     1       0.967  -0.603  -0.001  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.948  -0.263  -0.005  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.446   1.138  -0.007  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.479  -0.796   1.246  1.00  0.00           C  
HETATM   11  C   UNL     1       2.324   1.487  -0.012  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.469  -0.577  -0.006  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.597   0.456  -0.008  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.346   0.074  -0.005  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.481  -0.802  -1.252  1.00  0.00           C  
HETATM   16  C   UNL     1       3.545   2.129  -0.014  1.00  0.00           C  
HETATM   17  C   UNL     1       4.717   1.393  -0.013  1.00  0.00           C  
HETATM   18  C   UNL     1       6.765  -0.430   1.258  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.031   0.730  -0.007  1.00  0.00           N  
HETATM   20  O   UNL     1       0.925  -1.817   0.007  1.00  0.00           O  
HETATM   21  H   UNL     1      -0.143   1.080  -0.010  1.00  0.00           H  
HETATM   22  H   UNL     1       3.425  -1.723   0.010  1.00  0.00           H  
HETATM   23  H   UNL     1       5.722  -1.847   0.015  1.00  0.00           H  
HETATM   24  H   UNL     1       6.192  -0.697  -2.130  1.00  0.00           H  
HETATM   25  H   UNL     1       7.002   0.620  -1.247  1.00  0.00           H  
HETATM   26  H   UNL     1       7.697  -1.019  -1.235  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.028  -0.889  -0.894  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.027  -0.885   0.886  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.349   1.762   0.882  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.350   1.758  -0.899  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.421   0.651  -0.005  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.455  -1.282   1.248  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.696  -1.554   1.248  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.383  -0.172   2.135  1.00  0.00           H  
HETATM   35  H   UNL     1       1.410   2.062  -0.018  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.549  -1.204  -0.894  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.548  -1.200   0.886  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.519   1.078  -0.899  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.518   1.082   0.881  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.456  -1.288  -1.251  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.385  -0.182  -2.144  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.697  -1.559  -1.251  1.00  0.00           H  
HETATM   43  H   UNL     1       3.586   3.208  -0.021  1.00  0.00           H  
HETATM   44  H   UNL     1       5.670   1.901  -0.014  1.00  0.00           H  
HETATM   45  H   UNL     1       6.184  -0.670   2.148  1.00  0.00           H  
HETATM   46  H   UNL     1       7.692  -1.003   1.263  1.00  0.00           H  
HETATM   47  H   UNL     1       6.997   0.635   1.252  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.942   1.364   0.773  1.00  0.00           H  
CONECT    1    7   12   21                                            
CONECT    2   17   17    3    5                                       
CONECT    3    4    4    2   22                                       
CONECT    4   11    7    3    3                                       
CONECT    5    6    2   18   23                                       
CONECT    6    5   24   25   26                                       
CONECT    7   20   20    4    1                                       
CONECT    8   13   19   27   28                                       
CONECT    9   14   29   30   31                                       
CONECT   10   14   32   33   34                                       
CONECT   11   16   16    4   35                                       
CONECT   12    1   13   36   37                                       
CONECT   13   12    8   38   39                                       
CONECT   14   19   10    9   15                                       
CONECT   15   14   40   41   42                                       
CONECT   16   11   11   17   43                                       
CONECT   17   16    2    2   44                                       
CONECT   18    5   45   46   47                                       
CONECT   19    8   14   48                                            
CONECT   20    7    7                                                 
CONECT   21    1                                                      
CONECT   22    3                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    6                                                      
CONECT   26    6                                                      
CONECT   27    8                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
