COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.389  -2.289  -1.579  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.057  -2.263  -1.221  1.00  0.00           C  
HETATM    3  C   UNL     1       0.577  -1.041  -0.992  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.142   0.148  -1.127  1.00  0.00           C  
HETATM    5  C   UNL     1       2.004  -1.006  -0.607  1.00  0.00           C  
HETATM    6  C   UNL     1       3.922   0.206   0.086  1.00  0.00           C  
HETATM    7  C   UNL     1       4.219   2.458  -0.942  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.858  -0.093  -0.059  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.684   1.307  -0.115  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.405  -1.217  -0.876  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.902  -2.330  -0.311  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.619  -0.644   0.982  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.003   1.474   1.828  1.00  0.00           C  
HETATM   14  C   UNL     1       4.427  -0.862   0.811  1.00  0.00           C  
HETATM   15  C   UNL     1       5.733  -0.828   1.274  1.00  0.00           C  
HETATM   16  C   UNL     1       6.541   0.276   1.015  1.00  0.00           C  
HETATM   17  C   UNL     1       6.057   1.335   0.303  1.00  0.00           C  
HETATM   18  C   UNL     1       4.742   1.318  -0.173  1.00  0.00           C  
HETATM   19  C   UNL     1       7.580  -1.774   2.432  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.548  -1.142  -2.113  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.095  -1.107  -1.716  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.474   0.108  -1.485  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.268   2.063   0.842  1.00  0.00           N  
HETATM   24  N   UNL     1      -6.162   0.172   1.898  1.00  0.00           N  
HETATM   25  N   UNL     1      -5.634  -1.996   0.800  1.00  0.00           N  
HETATM   26  N   UNL     1      -6.584   2.266   2.786  1.00  0.00           N  
HETATM   27  N   UNL     1       2.613   0.176  -0.387  1.00  0.00           N  
HETATM   28  O   UNL     1      -4.024   1.821  -1.002  1.00  0.00           O  
HETATM   29  O   UNL     1       2.627  -2.043  -0.490  1.00  0.00           O  
HETATM   30  O   UNL     1       5.036   3.478  -1.275  1.00  0.00           O  
HETATM   31  O   UNL     1       3.051   2.481  -1.276  1.00  0.00           O  
HETATM   32  O   UNL     1       6.226  -1.874   1.984  1.00  0.00           O  
HETATM   33  H   UNL     1      -1.881  -3.234  -1.756  1.00  0.00           H  
HETATM   34  H   UNL     1       0.493  -3.186  -1.118  1.00  0.00           H  
HETATM   35  H   UNL     1       0.342   1.097  -0.946  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.749  -3.335  -0.677  1.00  0.00           H  
HETATM   37  H   UNL     1       3.803  -1.720   1.015  1.00  0.00           H  
HETATM   38  H   UNL     1       7.558   0.294   1.380  1.00  0.00           H  
HETATM   39  H   UNL     1       6.690   2.187   0.106  1.00  0.00           H  
HETATM   40  H   UNL     1       8.240  -1.667   1.571  1.00  0.00           H  
HETATM   41  H   UNL     1       7.685  -0.905   3.080  1.00  0.00           H  
HETATM   42  H   UNL     1       7.847  -2.675   2.985  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.733  -2.017  -2.737  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.795  -0.239  -2.672  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.031   1.027  -1.590  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.172   3.028   0.822  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.089  -2.629   1.377  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.469   3.228   2.755  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.110   1.863   3.495  1.00  0.00           H  
HETATM   50  H   UNL     1       2.140   1.005  -0.558  1.00  0.00           H  
HETATM   51  H   UNL     1       4.647   4.205  -1.780  1.00  0.00           H  
CONECT    1   21   21    2   33                                       
CONECT    2    3    3    1   34                                       
CONECT    3    4    5    2    2                                       
CONECT    4   22   22    3   35                                       
CONECT    5   29   29    3   27                                       
CONECT    6   27   18   18   14                                       
CONECT    7   31   31   30   18                                       
CONECT    8   12   12    9   10                                       
CONECT    9   23    8   28   28                                       
CONECT   10   11   11    8   20                                       
CONECT   11   25   10   10   36                                       
CONECT   12   24   25    8    8                                       
CONECT   13   26   24   24   23                                       
CONECT   14    6   15   15   37                                       
CONECT   15   14   14   16   32                                       
CONECT   16   17   17   15   38                                       
CONECT   17   18   16   16   39                                       
CONECT   18    7    6    6   17                                       
CONECT   19   32   40   41   42                                       
CONECT   20   10   21   43   44                                       
CONECT   21   22   20    1    1                                       
CONECT   22    4    4   21   45                                       
CONECT   23   13    9   46                                            
CONECT   24   13   13   12                                            
CONECT   25   12   11   47                                            
CONECT   26   13   48   49                                            
CONECT   27    5    6   50                                            
CONECT   28    9    9                                                 
CONECT   29    5    5                                                 
CONECT   30    7   51                                                 
CONECT   31    7    7                                                 
CONECT   32   15   19                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36   11                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
