COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.405  -0.232   0.835  1.00  0.00           C  
HETATM    2  C   UNL     1       6.961   1.862   1.603  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.552   2.968   0.908  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.276  -1.480   0.541  1.00  0.00           C  
HETATM    5  C   UNL     1       7.576   2.498   0.342  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.390  -2.628   1.083  1.00  0.00           C  
HETATM    7  C   UNL     1       6.959   1.695  -0.828  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.764   1.773   0.098  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.971  -2.029   1.111  1.00  0.00           C  
HETATM   10  C   UNL     1       5.693   1.087  -0.173  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.713   2.626  -1.017  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.034  -2.869   0.242  1.00  0.00           C  
HETATM   13  C   UNL     1       5.263  -0.184  -0.909  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.653   3.667  -1.100  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.126   1.167  -1.247  1.00  0.00           C  
HETATM   16  N   UNL     1      -7.543   3.795  -0.121  1.00  0.00           N  
HETATM   17  N   UNL     1      -6.692   1.979   1.027  1.00  0.00           N  
HETATM   18  N   UNL     1      -6.652   4.539  -2.174  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.691   2.201  -1.798  1.00  0.00           N  
HETATM   20  N   UNL     1      -4.751   0.863  -0.075  1.00  0.00           N  
HETATM   21  O   UNL     1       0.268  -3.052  -1.865  1.00  0.00           O  
HETATM   22  O   UNL     1       3.057  -1.862  -2.353  1.00  0.00           O  
HETATM   23  O   UNL     1       0.795  -4.524   0.116  1.00  0.00           O  
HETATM   24  O   UNL     1      -6.516  -1.415   1.250  1.00  0.00           O  
HETATM   25  O   UNL     1       7.212   3.877   0.249  1.00  0.00           O  
HETATM   26  O   UNL     1       4.200  -3.271  -0.598  1.00  0.00           O  
HETATM   27  O   UNL     1       1.870  -2.139  -0.142  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.803  -3.000   2.399  1.00  0.00           O  
HETATM   29  O   UNL     1       6.609   2.559  -1.911  1.00  0.00           O  
HETATM   30  O   UNL     1      -3.060  -0.694   0.586  1.00  0.00           O  
HETATM   31  O   UNL     1       6.124   0.776   1.169  1.00  0.00           O  
HETATM   32  O   UNL     1      -0.698  -2.375   0.366  1.00  0.00           O  
HETATM   33  O   UNL     1       4.031  -0.658  -0.360  1.00  0.00           O  
HETATM   34  P   UNL     1       0.552  -3.023  -0.413  1.00  0.00           P  
HETATM   35  P   UNL     1       3.284  -1.980  -0.895  1.00  0.00           P  
HETATM   36  S   UNL     1       5.964   3.091   2.491  1.00  0.00           S  
HETATM   37  H   UNL     1      -4.521   0.081   1.872  1.00  0.00           H  
HETATM   38  H   UNL     1       7.751   1.484   2.252  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.291   3.111   1.683  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.447  -1.592  -0.529  1.00  0.00           H  
HETATM   41  H   UNL     1       8.661   2.389   0.350  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.428  -3.488   0.413  1.00  0.00           H  
HETATM   43  H   UNL     1       7.639   0.911  -1.163  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.601  -2.002   2.136  1.00  0.00           H  
HETATM   45  H   UNL     1       4.881   1.814  -0.159  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.069  -3.908   0.568  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.349  -2.804  -0.800  1.00  0.00           H  
HETATM   48  H   UNL     1       5.127   0.038  -1.967  1.00  0.00           H  
HETATM   49  H   UNL     1       6.031  -0.948  -0.793  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.284   0.628  -1.658  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.997   4.435  -2.882  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.306   5.254  -2.220  1.00  0.00           H  
HETATM   53  H   UNL     1       0.987  -4.582   1.062  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.095  -2.174   1.099  1.00  0.00           H  
HETATM   55  H   UNL     1       7.523   4.417   0.989  1.00  0.00           H  
HETATM   56  H   UNL     1       4.390  -3.411   0.340  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.710  -3.330   2.449  1.00  0.00           H  
HETATM   58  H   UNL     1       7.359   3.032  -2.296  1.00  0.00           H  
HETATM   59  H   UNL     1       5.502   2.399   3.548  1.00  0.00           H  
CONECT    1    4   20   30   37                                       
CONECT    2    5   31   36   38                                       
CONECT    3   16   16   17   39                                       
CONECT    4    1    6   24   40                                       
CONECT    5    2    7   25   41                                       
CONECT    6    4    9   28   42                                       
CONECT    7    5   10   29   43                                       
CONECT    8   11   17   17   20                                       
CONECT    9    6   12   30   44                                       
CONECT   10    7   13   31   45                                       
CONECT   11    8   14   14   19                                       
CONECT   12    9   32   46   47                                       
CONECT   13   10   33   48   49                                       
CONECT   14   11   11   16   18                                       
CONECT   15   19   19   20   50                                       
CONECT   16    3    3   14                                            
CONECT   17    3    8    8                                            
CONECT   18   14   51   52                                            
CONECT   19   11   15   15                                            
CONECT   20    1    8   15                                            
CONECT   21   34   34                                                 
CONECT   22   35   35                                                 
CONECT   23   34   53                                                 
CONECT   24    4   54                                                 
CONECT   25    5   55                                                 
CONECT   26   35   56                                                 
CONECT   27   34   35                                                 
CONECT   28    6   57                                                 
CONECT   29    7   58                                                 
CONECT   30    1    9                                                 
CONECT   31    2   10                                                 
CONECT   32   12   34                                                 
CONECT   33   13   35                                                 
CONECT   34   21   21   23   27                                       
CONECT   34   32                                                      
CONECT   35   22   22   26   27                                       
CONECT   35   33                                                      
CONECT   36    2   59                                                 
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   15                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   36                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
