COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1     -12.450 -43.391 -19.432  1.00  0.00           O  
HETATM    2  O   UNL     1     -10.507 -42.461 -20.767  1.00  0.00           O  
HETATM    3  O   UNL     1     -10.554 -44.172 -17.445  1.00  0.00           O1+
HETATM    4  O   UNL     1      -8.741 -41.905 -18.567  1.00  0.00           O1+
HETATM    5  O   UNL     1      -8.774 -46.297 -20.215  1.00  0.00           O  
HETATM    6  O   UNL     1     -11.156 -45.992 -19.141  1.00  0.00           O  
HETATM    7  O   UNL     1     -10.099 -46.820 -16.924  1.00  0.00           O  
HETATM    8  O   UNL     1      -7.807 -45.194 -17.596  1.00  0.00           O1+
HETATM    9  O   UNL     1      -9.160 -44.090 -19.711  1.00  0.00           O  
HETATM   10  O   UNL     1      -7.118 -48.073 -15.742  1.00  0.00           O  
HETATM   11  O   UNL     1      -7.510 -46.968 -14.063  1.00  0.00           O  
HETATM   12  O   UNL     1      -5.848 -45.665 -15.634  1.00  0.00           O  
HETATM   13  O   UNL     1      -8.273 -44.727 -14.792  1.00  0.00           O1+
HETATM   14  O   UNL     1     -11.247 -43.788 -14.449  1.00  0.00           O  
HETATM   15  O   UNL     1      -5.848 -44.674 -12.588  1.00  0.00           O  
HETATM   16  O   UNL     1      -5.256 -42.663 -13.538  1.00  0.00           O  
HETATM   17  O   UNL     1      -7.603 -42.897 -15.261  1.00  0.00           O2+
HETATM   18  O   UNL     1      -7.753 -39.758 -13.395  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.986 -40.429 -14.822  1.00  0.00           O  
HETATM   20  O   UNL     1      -7.076 -42.298 -13.455  1.00  0.00           O  
HETATM   21  O   UNL     1      -8.057 -39.289 -15.782  1.00  0.00           O  
HETATM   22  O   UNL     1     -10.463 -39.039 -16.658  1.00  0.00           O  
HETATM   23  O   UNL     1      -9.171 -39.439 -18.893  1.00  0.00           O  
HETATM   24  O   UNL     1     -10.941 -41.128 -17.918  1.00  0.00           O  
HETATM   25  O   UNL     1      -9.548 -41.515 -15.639  1.00  0.00           O1+
HETATM   26  O   UNL     1      -5.612 -42.456 -17.898  1.00  0.00           O  
HETATM   27 MO   UNL     1     -10.654 -42.926 -19.007  1.00  0.00          Mo  
HETATM   28 MO   UNL     1      -9.458 -45.728 -18.603  1.00  0.00          Mo  
HETATM   29 MO   UNL     1      -7.729 -46.385 -15.754  1.00  0.00          Mo  
HETATM   30 MO   UNL     1      -9.853 -43.602 -15.572  1.00  0.00          Mo  
HETATM   31 MO   UNL     1      -6.273 -43.990 -14.199  1.00  0.00          Mo  
HETATM   32 MO   UNL     1      -7.717 -40.920 -14.774  1.00  0.00          Mo  
HETATM   33 MO   UNL     1      -9.230 -40.197 -17.261  1.00  0.00          Mo  
HETATM   34 MO   UNL     1      -7.256 -43.089 -17.450  1.00  0.00          Mo  
HETATM   35  H   UNL     1     -12.887 -43.714 -18.653  1.00  0.00           H  
HETATM   36  H   UNL     1      -9.628 -42.143 -20.939  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.356 -47.142 -20.101  1.00  0.00           H  
HETATM   38  H   UNL     1     -11.183 -46.705 -19.768  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.802 -47.719 -16.998  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.162 -48.420 -14.859  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.761 -47.882 -14.008  1.00  0.00           H  
HETATM   42  H   UNL     1     -10.982 -43.539 -13.571  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.001 -44.021 -11.916  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.775 -42.130 -12.947  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.820 -38.871 -13.729  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.912 -39.507 -14.607  1.00  0.00           H  
HETATM   47  H   UNL     1     -10.064 -38.449 -16.029  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.358 -38.511 -18.818  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.945 -42.947 -17.432  1.00  0.00           H  
CONECT    1   27   35                                                 
CONECT    2   27   36                                                 
CONECT    3   27   28   30                                            
CONECT    4   27   33   34                                            
CONECT    5   28   37                                                 
CONECT    6   28   38                                                 
CONECT    7   28   39                                                 
CONECT    8   28   29   34                                            
CONECT    9   27   28                                                 
CONECT   10   29   40                                                 
CONECT   11   29   41                                                 
CONECT   12   29   31                                                 
CONECT   13   29   30   31                                            
CONECT   14   30   42                                                 
CONECT   15   31   43                                                 
CONECT   16   31   44                                                 
CONECT   17   30   31   32   34                                       
CONECT   18   32   45                                                 
CONECT   19   32   46                                                 
CONECT   20   31   32                                                 
CONECT   21   32   33                                                 
CONECT   22   33   47                                                 
CONECT   23   33   48                                                 
CONECT   24   27   33                                                 
CONECT   25   30   32   33                                            
CONECT   26   34   49                                                 
CONECT   27    1    2    3    4                                       
CONECT   27    9   24                                                 
CONECT   28    3    5    6    7                                       
CONECT   28    8    9                                                 
CONECT   29    8   10   11   12                                       
CONECT   29   13                                                      
CONECT   30    3   13   14   17                                       
CONECT   30   25                                                      
CONECT   31   12   13   15   16                                       
CONECT   31   17   20                                                 
CONECT   32   17   18   19   20                                       
CONECT   32   21   25                                                 
CONECT   33    4   21   22   23                                       
CONECT   33   24   25                                                 
CONECT   34    4    8   17   26                                       
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
