COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.786  -1.095  -0.093  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.904  -0.968   0.706  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.804  -0.369   1.949  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.029  -0.234   2.817  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.585   0.106   2.400  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.460  -0.014   1.610  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.554  -0.618   0.355  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.352  -0.751  -0.496  1.00  0.00           C  
HETATM    9  S   UNL     1      -3.342  -1.488  -2.087  1.00  0.00           S  
HETATM   10  C   UNL     1      -2.137  -0.321  -0.155  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.112  -0.560  -1.149  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.619  -1.202  -2.284  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.788  -1.491  -3.293  1.00  0.00           N  
HETATM   14  C   UNL     1       0.487  -1.181  -3.232  1.00  0.00           C  
HETATM   15  N   UNL     1       1.014  -0.575  -2.183  1.00  0.00           N  
HETATM   16  C   UNL     1       0.273  -0.246  -1.136  1.00  0.00           C  
HETATM   17  N   UNL     1       0.839   0.389  -0.046  1.00  0.00           N  
HETATM   18  C   UNL     1       2.270   0.702  -0.043  1.00  0.00           C  
HETATM   19  C   UNL     1       3.046  -0.498   0.436  1.00  0.00           C  
HETATM   20  O   UNL     1       2.461  -1.515   0.743  1.00  0.00           O  
HETATM   21  N   UNL     1       4.390  -0.441   0.521  1.00  0.00           N  
HETATM   22  P   UNL     1       5.234  -1.747   1.042  1.00  0.00           P  
HETATM   23  O   UNL     1       6.680  -1.431   1.046  1.00  0.00           O  
HETATM   24  O   UNL     1       4.764  -2.130   2.534  1.00  0.00           O  
HETATM   25  O   UNL     1       4.959  -2.991   0.057  1.00  0.00           O  
HETATM   26  C   UNL     1       2.531   1.884   0.893  1.00  0.00           C  
HETATM   27  C   UNL     1       1.855   3.115   0.348  1.00  0.00           C  
HETATM   28  C   UNL     1       0.555   3.410   0.715  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.065   4.540   0.215  1.00  0.00           C  
HETATM   30  C   UNL     1       0.614   5.374  -0.653  1.00  0.00           C  
HETATM   31  C   UNL     1       1.914   5.080  -1.020  1.00  0.00           C  
HETATM   32  C   UNL     1       2.536   3.953  -0.515  1.00  0.00           C  
HETATM   33  H   UNL     1      -5.864  -1.567  -1.061  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.858  -1.337   0.360  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.125  -1.115   3.451  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.935   0.655   3.442  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.913  -0.142   2.186  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.514   0.572   3.371  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.510   0.358   1.962  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.933   0.166   0.787  1.00  0.00           H  
HETATM   41  H   UNL     1       1.125  -1.431  -4.066  1.00  0.00           H  
HETATM   42  H   UNL     1       0.288   0.627   0.716  1.00  0.00           H  
HETATM   43  H   UNL     1       2.588   0.961  -1.053  1.00  0.00           H  
HETATM   44  H   UNL     1       4.857   0.372   0.275  1.00  0.00           H  
HETATM   45  H   UNL     1       5.223  -2.896   2.906  1.00  0.00           H  
HETATM   46  H   UNL     1       4.030  -3.254   0.006  1.00  0.00           H  
HETATM   47  H   UNL     1       2.133   1.659   1.883  1.00  0.00           H  
HETATM   48  H   UNL     1       3.604   2.061   0.965  1.00  0.00           H  
HETATM   49  H   UNL     1       0.024   2.758   1.392  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.081   4.770   0.501  1.00  0.00           H  
HETATM   51  H   UNL     1       0.129   6.257  -1.044  1.00  0.00           H  
HETATM   52  H   UNL     1       2.444   5.732  -1.698  1.00  0.00           H  
HETATM   53  H   UNL     1       3.551   3.723  -0.802  1.00  0.00           H  
CONECT    1    2    2    7   33                                       
CONECT    2    1    1    3   34                                       
CONECT    3    2    4    5    5                                       
CONECT    4    3   35   36   37                                       
CONECT    5    3    3    6   38                                       
CONECT    6    7    7    5   39                                       
CONECT    7    1    8    6    6                                       
CONECT    8   10   10    7    9                                       
CONECT    9   12    8                                                 
CONECT   10   11    8    8   40                                       
CONECT   11   16   10   12   12                                       
CONECT   12   11   11   13    9                                       
CONECT   13   14   14   12                                            
CONECT   14   15   13   13   41                                       
CONECT   15   16   16   14                                            
CONECT   16   17   15   15   11                                       
CONECT   17   18   16   42                                            
CONECT   18   26   19   17   43                                       
CONECT   19   21   20   20   18                                       
CONECT   20   19   19                                                 
CONECT   21   22   19   44                                            
CONECT   22   23   23   25   21                                       
CONECT   22   24                                                      
CONECT   23   22   22                                                 
CONECT   24   22   45                                                 
CONECT   25   22   46                                                 
CONECT   26   27   18   47   48                                       
CONECT   27   32   26   28   28                                       
CONECT   28   27   27   29   49                                       
CONECT   29   30   30   28   50                                       
CONECT   30   31   29   29   51                                       
CONECT   31   32   32   30   52                                       
CONECT   32   31   31   27   53                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40   10                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
