COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.804   0.853  -0.337  1.00  0.00           N  
HETATM    2  N   UNL     1       5.378  -1.151   0.668  1.00  0.00           N  
HETATM    3  C   UNL     1       6.688  -0.786   0.747  1.00  0.00           C  
HETATM    4  C   UNL     1       7.066   0.424   0.275  1.00  0.00           C  
HETATM    5  C   UNL     1       6.081   1.271  -0.287  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.788  -0.744  -0.394  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.102  -0.445  -0.076  1.00  0.00           C  
HETATM    8  O   UNL     1      -6.078  -1.352  -0.355  1.00  0.00           O  
HETATM    9  C   UNL     1      -7.331  -1.177   0.315  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.724   0.303   0.218  1.00  0.00           C  
HETATM   11  O   UNL     1      -6.698   1.081   0.844  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.412   0.773   0.520  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.405   1.689   0.793  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.095   1.395   0.476  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.778   0.173  -0.114  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.368  -0.145  -0.454  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.266   0.607  -0.168  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.920  -1.236  -1.101  1.00  0.00           N  
HETATM   19  N   UNL     1       0.359  -1.157  -1.209  1.00  0.00           N  
HETATM   20  N   UNL     1       0.791  -0.074  -0.666  1.00  0.00           N  
HETATM   21  C   UNL     1       2.192   0.349  -0.596  1.00  0.00           C  
HETATM   22  C   UNL     1       3.026  -0.756   0.054  1.00  0.00           C  
HETATM   23  C   UNL     1       4.467  -0.321   0.127  1.00  0.00           C  
HETATM   24  C   UNL     1       7.704  -1.720   1.354  1.00  0.00           C  
HETATM   25  O   UNL     1       6.387   2.370  -0.724  1.00  0.00           O  
HETATM   26  H   UNL     1       8.099   0.738   0.326  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.545  -1.690  -0.856  1.00  0.00           H  
HETATM   28  H   UNL     1      -8.093  -1.792  -0.164  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.232  -1.464   1.362  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.816   0.591  -0.830  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.673   0.466   0.729  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.649   2.636   1.250  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.315   2.110   0.689  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.243   1.554   0.351  1.00  0.00           H  
HETATM   35  H   UNL     1       2.564   0.541  -1.602  1.00  0.00           H  
HETATM   36  H   UNL     1       2.267   1.259  -0.001  1.00  0.00           H  
HETATM   37  H   UNL     1       2.654  -0.948   1.061  1.00  0.00           H  
HETATM   38  H   UNL     1       2.951  -1.666  -0.541  1.00  0.00           H  
HETATM   39  H   UNL     1       8.120  -2.359   0.576  1.00  0.00           H  
HETATM   40  H   UNL     1       8.503  -1.138   1.813  1.00  0.00           H  
HETATM   41  H   UNL     1       7.222  -2.337   2.112  1.00  0.00           H  
HETATM   42  H   UNL     1       5.099  -2.017   1.004  1.00  0.00           H  
CONECT    1   23   23    5                                            
CONECT    2   23    3   42                                            
CONECT    3    2    4    4   24                                       
CONECT    4    5    3    3   26                                       
CONECT    5    1   25   25    4                                       
CONECT    6   15   15    7   27                                       
CONECT    7   12   12    6    8                                       
CONECT    8    7    9                                                 
CONECT    9   10    8   28   29                                       
CONECT   10   11    9   30   31                                       
CONECT   11   10   12                                                 
CONECT   12   13   11    7    7                                       
CONECT   13   14   14   12   32                                       
CONECT   14   13   13   15   33                                       
CONECT   15   14   16    6    6                                       
CONECT   16   15   17   17   18                                       
CONECT   17   16   16   20   34                                       
CONECT   18   16   19   19                                            
CONECT   19   18   18   20                                            
CONECT   20   17   19   21                                            
CONECT   21   20   22   35   36                                       
CONECT   22   21   23   37   38                                       
CONECT   23   22    1    1    2                                       
CONECT   24    3   39   40   41                                       
CONECT   25    5    5                                                 
CONECT   26    4                                                      
CONECT   27    6                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   17                                                      
CONECT   35   21                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42    2                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
