COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.482  -0.813  -1.493  1.00  0.00           C  
HETATM    2  C   UNL     1       2.874  -1.851  -0.415  1.00  0.00           C  
HETATM    3  C   UNL     1       7.288   0.365  -0.888  1.00  0.00           C  
HETATM    4  C   UNL     1       5.762   0.250  -0.858  1.00  0.00           C  
HETATM    5  C   UNL     1       3.508  -0.917   0.385  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.739  -0.993   0.177  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.492  -0.084   0.918  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.685   0.870   1.645  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.870  -0.111   0.844  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.843   2.966  -0.911  1.00  0.00           N  
HETATM   11  C   UNL     1      -6.891  -1.456  -1.509  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.503  -1.038   0.036  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.761  -1.942  -0.702  1.00  0.00           C  
HETATM   14  C   UNL     1       0.743  -0.969   0.252  1.00  0.00           C  
HETATM   15  O   UNL     1       5.658  -2.214   0.159  1.00  0.00           O  
HETATM   16  S   UNL     1       5.267  -0.884   0.469  1.00  0.00           S  
HETATM   17  O   UNL     1       5.547  -0.315   1.741  1.00  0.00           O  
HETATM   18  O   UNL     1       7.677   1.259  -1.933  1.00  0.00           O  
HETATM   19  C   UNL     1       2.766  -0.009   1.118  1.00  0.00           C  
HETATM   20  C   UNL     1       1.387  -0.031   1.056  1.00  0.00           C  
HETATM   21  C   UNL     1       1.495  -1.877  -0.489  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.383  -1.928  -0.632  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.008  -1.063  -0.040  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.543  -2.470   0.296  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.740  -2.721  -0.638  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.464   2.360   1.374  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.945   1.733   2.670  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.448   2.733   0.325  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.113   2.826   0.670  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.186   3.169  -0.302  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.639   3.407  -1.591  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.990   3.295  -1.861  1.00  0.00           C  
HETATM   33  H   UNL     1      -4.823  -1.311  -2.205  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.539   0.255  -1.703  1.00  0.00           H  
HETATM   35  H   UNL     1       3.458  -2.557  -0.986  1.00  0.00           H  
HETATM   36  H   UNL     1       7.642   0.748   0.069  1.00  0.00           H  
HETATM   37  H   UNL     1       7.722  -0.618  -1.069  1.00  0.00           H  
HETATM   38  H   UNL     1       5.327   1.234  -0.677  1.00  0.00           H  
HETATM   39  H   UNL     1       5.408  -0.133  -1.815  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.998   0.639   1.549  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.696   0.549   1.895  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.624  -0.778  -1.072  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.177  -1.723  -2.526  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.261  -2.666  -1.328  1.00  0.00           H  
HETATM   45  H   UNL     1       8.634   1.380  -2.011  1.00  0.00           H  
HETATM   46  H   UNL     1       3.266   0.718   1.741  1.00  0.00           H  
HETATM   47  H   UNL     1       0.808   0.679   1.629  1.00  0.00           H  
HETATM   48  H   UNL     1       1.001  -2.607  -1.114  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.804  -2.634  -1.208  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.436  -0.320   0.633  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.768  -3.216   0.118  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.865  -2.509   1.336  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.644  -2.880  -0.051  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.546  -3.588  -1.269  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.330   3.018   1.445  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.470   1.979   3.593  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.869   1.591   2.764  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.796   2.634   1.685  1.00  0.00           H  
HETATM   59  H   UNL     1       0.863   3.250  -0.062  1.00  0.00           H  
HETATM   60  H   UNL     1       0.055   3.677  -2.373  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.351   3.478  -2.863  1.00  0.00           H  
CONECT    1   11   23   33   34                                       
CONECT    2    5    5   21   35                                       
CONECT    3   18    4   36   37                                       
CONECT    4    3   16   38   39                                       
CONECT    5   19   16    2    2                                       
CONECT    6   22   14    7    7                                       
CONECT    7    6    6    9   40                                       
CONECT    8    9   27   26   41                                       
CONECT    9   12   12    7    8                                       
CONECT   10   32   32   28                                            
CONECT   11   25    1   42   43                                       
CONECT   12   13   23    9    9                                       
CONECT   13   22   22   12   44                                       
CONECT   14   20    6   21   21                                       
CONECT   15   16   16                                                 
CONECT   16    4   17   17    5                                       
CONECT   16   15   15                                                 
CONECT   17   16   16                                                 
CONECT   18    3   45                                                 
CONECT   19   20   20    5   46                                       
CONECT   20   19   19   14   47                                       
CONECT   21   14   14    2   48                                       
CONECT   22   13   13    6   49                                       
CONECT   23   24    1   12   50                                       
CONECT   24   25   23   51   52                                       
CONECT   25   11   24   53   54                                       
CONECT   26    8   27   28   55                                       
CONECT   27    8   26   56   57                                       
CONECT   28   10   26   29   29                                       
CONECT   29   28   28   30   58                                       
CONECT   30   31   31   29   59                                       
CONECT   31   32   30   30   60                                       
CONECT   32   10   10   31   61                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
