COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.414   4.063   0.203  1.00  0.00           O  
HETATM    2  C   UNL     1       3.005  -1.148  -1.111  1.00  0.00           C  
HETATM    3  C   UNL     1       2.532   0.817   0.400  1.00  0.00           C  
HETATM    4  C   UNL     1       0.466   1.811   0.276  1.00  0.00           C  
HETATM    5  C   UNL     1       5.019  -1.688  -0.518  1.00  0.00           C  
HETATM    6  O   UNL     1      -8.035  -0.317  -1.504  1.00  0.00           O  
HETATM    7  C   UNL     1       4.637  -0.581   0.258  1.00  0.00           C  
HETATM    8  O   UNL     1      -8.817  -1.699   0.047  1.00  0.00           O  
HETATM    9  C   UNL     1       6.681  -0.635   1.308  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.363   1.405  -1.328  1.00  0.00           O  
HETATM   11  N   UNL     1       7.086  -1.673   0.600  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.896   1.751  -0.417  1.00  0.00           C  
HETATM   13  N   UNL     1       5.493  -0.092   1.151  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.832   0.835   0.374  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.174   0.776  -0.309  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.254  -0.045   0.261  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.037  -0.772   1.436  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.050  -1.543   1.971  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.283  -1.601   1.352  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.515  -0.880   0.177  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.835  -0.945  -0.483  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.500  -0.096  -0.367  1.00  0.00           C  
HETATM   23  O   UNL     1       1.133   0.533   0.186  1.00  0.00           O  
HETATM   24  C   UNL     1       1.401   2.796  -0.459  1.00  0.00           C  
HETATM   25  C   UNL     1       2.792   2.128  -0.375  1.00  0.00           C  
HETATM   26  O   UNL     1       3.706   2.961   0.340  1.00  0.00           O  
HETATM   27  N   UNL     1       3.361  -0.267  -0.134  1.00  0.00           N  
HETATM   28  N   UNL     1       3.979  -1.981  -1.335  1.00  0.00           N  
HETATM   29  C   UNL     1       6.301  -2.229  -0.317  1.00  0.00           C  
HETATM   30  N   UNL     1       6.733  -3.318  -1.054  1.00  0.00           N  
HETATM   31  H   UNL     1       1.986   4.720  -0.217  1.00  0.00           H  
HETATM   32  H   UNL     1       2.053  -1.156  -1.621  1.00  0.00           H  
HETATM   33  H   UNL     1       2.733   0.959   1.462  1.00  0.00           H  
HETATM   34  H   UNL     1       0.348   2.104   1.319  1.00  0.00           H  
HETATM   35  H   UNL     1      -9.663  -1.709  -0.421  1.00  0.00           H  
HETATM   36  H   UNL     1       7.352  -0.213   2.042  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.324   2.753  -0.465  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.773   1.360  -1.427  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.404  -0.167   0.421  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.955   1.225   1.384  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.076  -0.731   1.926  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.878  -2.102   2.878  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.071  -2.206   1.776  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.675   0.466  -1.273  1.00  0.00           H  
HETATM   45  H   UNL     1       1.093   2.913  -1.498  1.00  0.00           H  
HETATM   46  H   UNL     1       3.172   1.912  -1.374  1.00  0.00           H  
HETATM   47  H   UNL     1       3.905   3.797  -0.102  1.00  0.00           H  
HETATM   48  H   UNL     1       7.619  -3.684  -0.904  1.00  0.00           H  
HETATM   49  H   UNL     1       6.151  -3.715  -1.720  1.00  0.00           H  
CONECT    1   24   31                                                 
CONECT    2   28   28   27   32                                       
CONECT    3   27   25   23   33                                       
CONECT    4   24   23   12   34                                       
CONECT    5   29   28    7    7                                       
CONECT    6   21   21                                                 
CONECT    7    5    5   13   27                                       
CONECT    8   21   35                                                 
CONECT    9   11   13   13   36                                       
CONECT   10   15   15                                                 
CONECT   11   29   29    9                                            
CONECT   12    4   14   37   38                                       
CONECT   13    9    9    7                                            
CONECT   14   12   15   39   40                                       
CONECT   15   14   10   10   16                                       
CONECT   16   15   17   17   22                                       
CONECT   17   16   16   18   41                                       
CONECT   18   17   19   19   42                                       
CONECT   19   18   18   20   43                                       
CONECT   20   22   22   19   21                                       
CONECT   21   20    6    6    8                                       
CONECT   22   16   20   20   44                                       
CONECT   23    3    4                                                 
CONECT   24   25    1    4   45                                       
CONECT   25   26    3   24   46                                       
CONECT   26   25   47                                                 
CONECT   27    7    2    3                                            
CONECT   28    5    2    2                                            
CONECT   29   30   11   11    5                                       
CONECT   30   29   48   49                                            
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   30                                                      
CONECT   49   30                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
