COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.552  -3.996  -1.216  1.00  0.00           C  
HETATM    2  N   UNL     1       0.635  -4.511  -1.486  1.00  0.00           N  
HETATM    3  C   UNL     1       1.760  -3.873  -1.235  1.00  0.00           C  
HETATM    4  C   UNL     1       1.737  -2.608  -0.664  1.00  0.00           C  
HETATM    5  C   UNL     1       0.486  -2.033  -0.364  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.674  -2.754  -0.653  1.00  0.00           C  
HETATM    7  O   UNL     1       2.688  -1.728  -0.298  1.00  0.00           O  
HETATM    8  C   UNL     1       2.138  -0.610   0.224  1.00  0.00           C  
HETATM    9  C   UNL     1       0.779  -0.721   0.217  1.00  0.00           C  
HETATM   10  C   UNL     1       2.892   0.552   0.724  1.00  0.00           C  
HETATM   11  N   UNL     1       4.220   0.498   0.762  1.00  0.00           N  
HETATM   12  C   UNL     1       4.924   1.524   1.206  1.00  0.00           C  
HETATM   13  C   UNL     1       4.263   2.666   1.633  1.00  0.00           C  
HETATM   14  C   UNL     1       2.877   2.691   1.580  1.00  0.00           C  
HETATM   15  N   UNL     1       2.229   1.635   1.121  1.00  0.00           N  
HETATM   16  N   UNL     1      -0.143   0.222   0.671  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.428  -0.178   1.033  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.616  -1.336   1.764  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.893  -1.739   2.127  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.994  -0.994   1.767  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.833   0.177   1.030  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.542   0.597   0.661  1.00  0.00           C  
HETATM   23  N   UNL     1      -4.705   1.111   0.533  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.960   2.089  -0.137  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.693   1.803  -0.063  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.572   2.615  -0.661  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.253   2.089  -2.062  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.116   2.913  -2.669  1.00  0.00           C  
HETATM   29  O   UNL     1       0.182   2.422  -3.977  1.00  0.00           O  
HETATM   30  H   UNL     1      -1.441  -4.563  -1.447  1.00  0.00           H  
HETATM   31  H   UNL     1       2.705  -4.337  -1.474  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.648  -2.339  -0.440  1.00  0.00           H  
HETATM   33  H   UNL     1       6.003   1.474   1.235  1.00  0.00           H  
HETATM   34  H   UNL     1       4.816   3.518   2.000  1.00  0.00           H  
HETATM   35  H   UNL     1       2.333   3.566   1.906  1.00  0.00           H  
HETATM   36  H   UNL     1       0.110   1.156   0.734  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.763  -1.931   2.054  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.026  -2.646   2.698  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.983  -1.319   2.055  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.875   3.660  -0.725  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.687   2.531  -0.031  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.951   1.044  -1.997  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.139   2.173  -2.692  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.419   3.958  -2.733  1.00  0.00           H  
HETATM   45  H   UNL     1       0.770   2.829  -2.039  1.00  0.00           H  
HETATM   46  H   UNL     1       0.895   2.899  -4.423  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.670   1.096   0.628  1.00  0.00           H  
CONECT    1    2    2    6   30                                       
CONECT    2    1    1    3                                            
CONECT    3    2    4    4   31                                       
CONECT    4    3    3    7    5                                       
CONECT    5    4    6    6    9                                       
CONECT    6    1    5    5   32                                       
CONECT    7    4    8                                                 
CONECT    8    7   10    9    9                                       
CONECT    9    5    8    8   16                                       
CONECT   10    8   15   15   11                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   13   33                                       
CONECT   13   12   14   14   34                                       
CONECT   14   13   13   15   35                                       
CONECT   15   10   10   14                                            
CONECT   16    9   17   36                                            
CONECT   17   16   18   18   22                                       
CONECT   18   17   17   19   37                                       
CONECT   19   18   20   20   38                                       
CONECT   20   19   19   21   39                                       
CONECT   21   20   22   22   23                                       
CONECT   22   17   21   21   25                                       
CONECT   23   21   24   47                                            
CONECT   24   23   25   25                                            
CONECT   25   22   24   24   26                                       
CONECT   26   25   27   40   41                                       
CONECT   27   26   28   42   43                                       
CONECT   28   27   29   44   45                                       
CONECT   29   28   46                                                 
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   26                                                      
CONECT   41   26                                                      
CONECT   42   27                                                      
CONECT   43   27                                                      
CONECT   44   28                                                      
CONECT   45   28                                                      
CONECT   46   29                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
