COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.646   0.031   1.834  1.00  0.00           O  
HETATM    2  O   UNL     1       3.075  -2.692   2.015  1.00  0.00           O  
HETATM    3  O   UNL     1       0.099   1.027  -2.161  1.00  0.00           O1+
HETATM    4  O   UNL     1       2.621  -0.044  -3.024  1.00  0.00           O  
HETATM    5  O   UNL     1      -4.334  -1.808  -0.697  1.00  0.00           O  
HETATM    6  O   UNL     1      -3.242   0.839   0.003  1.00  0.00           O1+
HETATM    7  O   UNL     1      -4.013  -1.308   1.920  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.442   0.969   0.347  1.00  0.00           O1+
HETATM    9  O   UNL     1      -3.534   1.404   2.753  1.00  0.00           O  
HETATM   10  O   UNL     1       1.198   3.723  -1.953  1.00  0.00           O  
HETATM   11  O   UNL     1      -1.338   2.895  -0.989  1.00  0.00           O  
HETATM   12  O   UNL     1       0.322  -2.325   2.444  1.00  0.00           O  
HETATM   13  O   UNL     1      -0.784   1.946   2.970  1.00  0.00           O  
HETATM   14  O   UNL     1      -1.512  -0.486   1.757  1.00  0.00           O  
HETATM   15  O   UNL     1       0.960  -3.384  -0.027  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.912  -1.025  -1.446  1.00  0.00           O1+
HETATM   17  O   UNL     1       2.315   1.431  -0.787  1.00  0.00           O1+
HETATM   18  O   UNL     1       4.346  -0.517   2.003  1.00  0.00           O  
HETATM   19  O   UNL     1      -2.243   3.358   1.022  1.00  0.00           O  
HETATM   20  O   UNL     1       4.915   0.799  -0.320  1.00  0.00           O  
HETATM   21  O   UNL     1       0.914   3.465   0.908  1.00  0.00           O  
HETATM   22  O   UNL     1      -2.760   1.286  -2.871  1.00  0.00           O  
HETATM   23  O   UNL     1       2.890  -1.191  -0.413  1.00  0.00           O1+
HETATM   24  O   UNL     1       0.231  -0.707   0.101  1.00  0.00           O1+
HETATM   25  O   UNL     1      -1.848  -2.833   0.533  1.00  0.00           O  
HETATM   26  O   UNL     1       0.729  -1.860  -2.362  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.186  -3.797  -1.951  1.00  0.00           O  
HETATM   28  O   UNL     1       3.483   2.174   1.691  1.00  0.00           O  
HETATM   29 MO   UNL     1       1.614  -1.801   1.006  1.00  0.00          Mo  
HETATM   30 MO   UNL     1      -0.500  -2.279  -0.844  1.00  0.00          Mo  
HETATM   31 MO   UNL     1       3.208   0.470   0.682  1.00  0.00          Mo  
HETATM   32 MO   UNL     1       1.442  -0.256  -1.415  1.00  0.00          Mo  
HETATM   33 MO   UNL     1      -2.792  -1.080   0.353  1.00  0.00          Mo  
HETATM   34 MO   UNL     1       0.565   2.318  -0.675  1.00  0.00          Mo  
HETATM   35 MO   UNL     1      -1.673   0.929  -1.240  1.00  0.00          Mo  
HETATM   36 MO   UNL     1      -2.003   1.435   1.467  1.00  0.00          Mo  
HETATM   37  H   UNL     1       2.855  -3.582   2.323  1.00  0.00           H  
HETATM   38  H   UNL     1       3.557   0.068  -2.813  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.811  -2.522  -0.252  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.592  -1.711   2.692  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.328   0.987   3.601  1.00  0.00           H  
HETATM   42  H   UNL     1       0.879   4.612  -1.749  1.00  0.00           H  
HETATM   43  H   UNL     1       0.516  -3.179   2.855  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.020   2.779   3.402  1.00  0.00           H  
HETATM   45  H   UNL     1       4.989  -1.116   1.598  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.162   3.614   0.867  1.00  0.00           H  
HETATM   47  H   UNL     1       5.645   1.104   0.236  1.00  0.00           H  
HETATM   48  H   UNL     1       1.825   3.782   0.970  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.524   0.702  -2.970  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.493  -4.303  -2.397  1.00  0.00           H  
HETATM   51  H   UNL     1       3.425   2.075   2.652  1.00  0.00           H  
CONECT    1   29   31                                                 
CONECT    2   29   37                                                 
CONECT    3   32   34   35                                            
CONECT    4   32   38                                                 
CONECT    5   33   39                                                 
CONECT    6   33   35   36                                            
CONECT    7   33   40                                                 
CONECT    8   34   35   36                                            
CONECT    9   36   41                                                 
CONECT   10   34   42                                                 
CONECT   11   34   35                                                 
CONECT   12   29   43                                                 
CONECT   13   36   44                                                 
CONECT   14   33   36                                                 
CONECT   15   29   30                                                 
CONECT   16   30   33   35                                            
CONECT   17   31   32   34                                            
CONECT   18   31   45                                                 
CONECT   19   36   46                                                 
CONECT   20   31   47                                                 
CONECT   21   34   48                                                 
CONECT   22   35   49                                                 
CONECT   23   29   31   32                                            
CONECT   24   29   30   32                                            
CONECT   25   30   33                                                 
CONECT   26   30   32                                                 
CONECT   27   30   50                                                 
CONECT   28   31   51                                                 
CONECT   29    1    2   12   15                                       
CONECT   29   23   24                                                 
CONECT   30   15   16   24   25                                       
CONECT   30   26   27                                                 
CONECT   31    1   17   18   20                                       
CONECT   31   23   28                                                 
CONECT   32    3    4   17   23                                       
CONECT   32   24   26                                                 
CONECT   33    5    6    7   14                                       
CONECT   33   16   25                                                 
CONECT   34    3    8   10   11                                       
CONECT   34   17   21                                                 
CONECT   35    3    6    8   11                                       
CONECT   35   16   22                                                 
CONECT   36    6    8    9   13                                       
CONECT   36   14   19                                                 
CONECT   37    2                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
