COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.636  -1.879   1.828  1.00  0.00           C  
HETATM    2  C   UNL     1       5.010  -1.101   0.402  1.00  0.00           C  
HETATM    3  C   UNL     1       5.321  -2.133  -0.499  1.00  0.00           C  
HETATM    4  C   UNL     1       6.335  -3.039  -0.145  1.00  0.00           C  
HETATM    5  N   UNL     1       3.995  -0.384  -0.180  1.00  0.00           N  
HETATM    6  C   UNL     1       3.332   0.795   0.384  1.00  0.00           C  
HETATM    7  C   UNL     1       4.090   2.080  -0.016  1.00  0.00           C  
HETATM    8  C   UNL     1       2.970   3.118  -0.253  1.00  0.00           C  
HETATM    9  C   UNL     1       1.668   2.336   0.031  1.00  0.00           C  
HETATM   10  C   UNL     1       0.565   2.767  -0.938  1.00  0.00           C  
HETATM   11  C   UNL     1       3.717  -0.969  -1.379  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.759   2.456  -1.433  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.963   1.738  -0.983  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.923   1.166  -0.623  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.094   0.467  -0.185  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.764  -0.240   1.080  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.647  -1.398   1.708  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.867  -1.762  -0.433  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.823  -0.851  -0.185  1.00  0.00           C  
HETATM   20  N   UNL     1       6.960  -2.868   1.015  1.00  0.00           N  
HETATM   21  N   UNL     1       5.686  -1.013   1.543  1.00  0.00           N  
HETATM   22  N   UNL     1       6.686  -4.076  -0.992  1.00  0.00           N  
HETATM   23  N   UNL     1       4.496  -1.995  -1.564  1.00  0.00           N  
HETATM   24  N   UNL     1      -5.669   0.587   1.056  1.00  0.00           N  
HETATM   25  N   UNL     1      -7.689  -0.539   1.986  1.00  0.00           N  
HETATM   26  N   UNL     1      -8.743  -2.000   0.536  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.784  -0.381  -0.910  1.00  0.00           N  
HETATM   28  N   UNL     1      -7.975  -2.398  -1.658  1.00  0.00           N  
HETATM   29  O   UNL     1       4.949   2.505   1.044  1.00  0.00           O  
HETATM   30  O   UNL     1       3.103   4.215   0.653  1.00  0.00           O  
HETATM   31  O   UNL     1       2.014   0.951  -0.186  1.00  0.00           O  
HETATM   32  O   UNL     1      -0.659   2.120  -0.586  1.00  0.00           O  
HETATM   33  H   UNL     1       7.167  -1.779   2.763  1.00  0.00           H  
HETATM   34  H   UNL     1       3.269   0.711   1.469  1.00  0.00           H  
HETATM   35  H   UNL     1       4.661   1.919  -0.930  1.00  0.00           H  
HETATM   36  H   UNL     1       2.988   3.471  -1.284  1.00  0.00           H  
HETATM   37  H   UNL     1       1.348   2.492   1.061  1.00  0.00           H  
HETATM   38  H   UNL     1       0.434   3.848  -0.882  1.00  0.00           H  
HETATM   39  H   UNL     1       0.845   2.487  -1.954  1.00  0.00           H  
HETATM   40  H   UNL     1       2.961  -0.632  -2.073  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.528   2.170  -2.459  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.939   3.530  -1.387  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.383  -1.619   2.467  1.00  0.00           H  
HETATM   44  H   UNL     1       6.229  -4.184  -1.841  1.00  0.00           H  
HETATM   45  H   UNL     1       7.387  -4.695  -0.736  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.358   1.152   1.781  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.697  -3.026  -1.816  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.329  -2.215  -2.358  1.00  0.00           H  
HETATM   49  H   UNL     1       5.404   3.340   0.871  1.00  0.00           H  
HETATM   50  H   UNL     1       3.931   4.704   0.559  1.00  0.00           H  
CONECT    1   20   20   21   33                                       
CONECT    2    3    5   21   21                                       
CONECT    3   23    4    4    2                                       
CONECT    4   22    3    3   20                                       
CONECT    5   11    2    6                                            
CONECT    6    7    5   31   34                                       
CONECT    7   29    8    6   35                                       
CONECT    8    7   30    9   36                                       
CONECT    9    8   31   10   37                                       
CONECT   10    9   32   38   39                                       
CONECT   11   23   23    5   40                                       
CONECT   12   32   13   41   42                                       
CONECT   13   12   14   14   14                                       
CONECT   14   15   13   13   13                                       
CONECT   15   27   27   14   24                                       
CONECT   16   19   19   24   25                                       
CONECT   17   26   25   25   43                                       
CONECT   18   28   26   26   19                                       
CONECT   19   18   27   16   16                                       
CONECT   20    4    1    1                                            
CONECT   21    2    2    1                                            
CONECT   22    4   44   45                                            
CONECT   23   11   11    3                                            
CONECT   24   15   16   46                                            
CONECT   25   17   17   16                                            
CONECT   26   18   18   17                                            
CONECT   27   19   15   15                                            
CONECT   28   18   47   48                                            
CONECT   29    7   49                                                 
CONECT   30    8   50                                                 
CONECT   31    6    9                                                 
CONECT   32   10   12                                                 
CONECT   33    1                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   17                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   28                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
CONECT   50   30                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
