COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  N   UNL     1      -3.477   2.527  -0.324  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.708   1.166  -0.148  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.636   0.269  -0.072  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.886  -1.164   0.113  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.188  -1.648   0.216  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.258  -0.758   0.141  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.595  -1.194   0.239  1.00  0.00           C  
HETATM    8  N   UNL     1      -7.570  -0.321   0.163  1.00  0.00           N  
HETATM    9  C   UNL     1      -7.376   0.980  -0.004  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.137   1.529  -0.114  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.014   0.678  -0.039  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.362   0.683  -0.165  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.378  -0.188  -0.089  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.568  -1.496   0.078  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.766  -2.024   0.183  1.00  0.00           C  
HETATM   16  N   UNL     1       0.921   0.278  -0.190  1.00  0.00           N  
HETATM   17  C   UNL     1       2.044  -0.659  -0.110  1.00  0.00           C  
HETATM   18  C   UNL     1       3.360   0.110  -0.248  1.00  0.00           C  
HETATM   19  C   UNL     1       4.533  -0.869  -0.165  1.00  0.00           C  
HETATM   20  N   UNL     1       5.797  -0.131  -0.298  1.00  0.00           N  
HETATM   21  C   UNL     1       6.010   0.759   0.853  1.00  0.00           C  
HETATM   22  C   UNL     1       7.304   1.550   0.645  1.00  0.00           C  
HETATM   23  O   UNL     1       8.390   0.638   0.458  1.00  0.00           O  
HETATM   24  C   UNL     1       8.215  -0.244  -0.655  1.00  0.00           C  
HETATM   25  C   UNL     1       6.930  -1.053  -0.461  1.00  0.00           C  
HETATM   26  H   UNL     1      -4.224   3.144  -0.372  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.568   2.860  -0.395  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.367  -2.704   0.353  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.816  -2.243   0.376  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.237   1.630  -0.056  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.015   2.593  -0.250  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.893  -3.088   0.319  1.00  0.00           H  
HETATM   33  H   UNL     1       1.088   1.226  -0.313  1.00  0.00           H  
HETATM   34  H   UNL     1       2.022  -1.171   0.851  1.00  0.00           H  
HETATM   35  H   UNL     1       1.965  -1.390  -0.914  1.00  0.00           H  
HETATM   36  H   UNL     1       3.382   0.623  -1.210  1.00  0.00           H  
HETATM   37  H   UNL     1       3.440   0.841   0.556  1.00  0.00           H  
HETATM   38  H   UNL     1       4.511  -1.382   0.797  1.00  0.00           H  
HETATM   39  H   UNL     1       4.454  -1.601  -0.969  1.00  0.00           H  
HETATM   40  H   UNL     1       5.171   1.449   0.939  1.00  0.00           H  
HETATM   41  H   UNL     1       6.088   0.165   1.763  1.00  0.00           H  
HETATM   42  H   UNL     1       7.206   2.185  -0.235  1.00  0.00           H  
HETATM   43  H   UNL     1       7.497   2.169   1.521  1.00  0.00           H  
HETATM   44  H   UNL     1       8.143   0.339  -1.573  1.00  0.00           H  
HETATM   45  H   UNL     1       9.066  -0.922  -0.719  1.00  0.00           H  
HETATM   46  H   UNL     1       7.023  -1.676   0.429  1.00  0.00           H  
HETATM   47  H   UNL     1       6.763  -1.685  -1.333  1.00  0.00           H  
CONECT    1    2   26   27                                            
CONECT    2    3    1   11   11                                       
CONECT    3   12   12    4    2                                       
CONECT    4   15   15    3    5                                       
CONECT    5    4    6    6   28                                       
CONECT    6    5    5   11    7                                       
CONECT    7    6    8    8   29                                       
CONECT    8    7    7    9                                            
CONECT    9   10   10    8   30                                       
CONECT   10   11    9    9   31                                       
CONECT   11    2    2    6   10                                       
CONECT   12   13    3    3                                            
CONECT   13   16   14   14   12                                       
CONECT   14   13   13   15                                            
CONECT   15   14    4    4   32                                       
CONECT   16   17   13   33                                            
CONECT   17   18   16   34   35                                       
CONECT   18   17   19   36   37                                       
CONECT   19   18   20   38   39                                       
CONECT   20   19   21   25                                            
CONECT   21   22   20   40   41                                       
CONECT   22   21   23   42   43                                       
CONECT   23   22   24                                                 
CONECT   24   23   25   44   45                                       
CONECT   25   20   24   46   47                                       
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
