COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.214  -2.077  -0.084  1.00  0.00           N  
HETATM    2  N   UNL     1      -2.249  -2.843  -0.121  1.00  0.00           N  
HETATM    3  N   UNL     1       0.596   0.277   0.041  1.00  0.00           N  
HETATM    4  N   UNL     1       8.163   1.109   0.026  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.344  -2.143  -0.068  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.983  -0.791   0.007  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.611  -0.768  -0.003  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.777  -2.616  -0.076  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.663  -1.468   0.423  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.341  -0.188  -0.351  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.967   0.344   0.078  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.410   0.867  -0.057  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.744   0.419   0.061  1.00  0.00           C  
HETATM   14  C   UNL     1       1.459   1.459   0.105  1.00  0.00           C  
HETATM   15  C   UNL     1       2.903   1.029   0.067  1.00  0.00           C  
HETATM   16  C   UNL     1       3.555   0.903  -1.145  1.00  0.00           C  
HETATM   17  C   UNL     1       4.879   0.509  -1.181  1.00  0.00           C  
HETATM   18  C   UNL     1       5.552   0.241  -0.003  1.00  0.00           C  
HETATM   19  C   UNL     1       4.900   0.367   1.209  1.00  0.00           C  
HETATM   20  C   UNL     1       3.577   0.765   1.245  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.430   1.169   1.443  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.089   2.148  -0.830  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.779   0.340  -0.489  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.848   1.395  -0.195  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.237   1.529   0.132  1.00  0.00           O  
HETATM   26  O   UNL     1       7.457  -0.825  -1.335  1.00  0.00           O  
HETATM   27  O   UNL     1       7.479  -0.973   1.160  1.00  0.00           O  
HETATM   28  S   UNL     1       7.240  -0.263  -0.047  1.00  0.00           S  
HETATM   29  H   UNL     1      -0.293  -2.381  -0.107  1.00  0.00           H  
HETATM   30  H   UNL     1       0.989  -0.608  -0.015  1.00  0.00           H  
HETATM   31  H   UNL     1       7.736   1.979   0.081  1.00  0.00           H  
HETATM   32  H   UNL     1       9.131   1.044   0.014  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.067  -2.891  -1.090  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.884  -3.477   0.583  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.711  -1.728   0.273  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.480  -1.305   1.485  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.330  -0.403  -1.419  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.021   0.721   1.099  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.655   1.143  -0.594  1.00  0.00           H  
HETATM   40  H   UNL     1       1.251   2.107  -0.746  1.00  0.00           H  
HETATM   41  H   UNL     1       1.266   2.000   1.031  1.00  0.00           H  
HETATM   42  H   UNL     1       3.030   1.113  -2.066  1.00  0.00           H  
HETATM   43  H   UNL     1       5.389   0.410  -2.128  1.00  0.00           H  
HETATM   44  H   UNL     1       5.425   0.157   2.129  1.00  0.00           H  
HETATM   45  H   UNL     1       3.069   0.868   2.192  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.454   1.544   1.751  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.191   1.920   1.653  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.658   0.256   1.994  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.075   1.933  -1.898  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.850   2.899  -0.620  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.113   2.523  -0.522  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.765   0.126  -1.558  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.008  -0.572   0.062  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.862   1.610   0.874  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.619   2.307  -0.746  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.824   1.020  -0.503  1.00  0.00           H  
CONECT    1    2    7   29                                            
CONECT    2    1    5    5                                            
CONECT    3   13   14   30                                            
CONECT    4   28   31   32                                            
CONECT    5    2    2    6    8                                       
CONECT    6    5    7    7   11                                       
CONECT    7    1    6    6   13                                       
CONECT    8    5    9   33   34                                       
CONECT    9    8   10   35   36                                       
CONECT   10    9   11   12   37                                       
CONECT   11    6   10   38   39                                       
CONECT   12   10   21   22   23                                       
CONECT   13    3    7   25   25                                       
CONECT   14    3   15   40   41                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   42                                       
CONECT   17   16   18   18   43                                       
CONECT   18   17   17   19   28                                       
CONECT   19   18   20   20   44                                       
CONECT   20   15   19   19   45                                       
CONECT   21   12   46   47   48                                       
CONECT   22   12   49   50   51                                       
CONECT   23   12   24   52   53                                       
CONECT   24   23   54   55   56                                       
CONECT   25   13   13                                                 
CONECT   26   28   28                                                 
CONECT   27   28   28                                                 
CONECT   28    4   18   26   26                                       
CONECT   28   27   27                                                 
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
