COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -8.217   1.526  -0.049  1.00  0.00           N  
HETATM    2  N   UNL     1       6.641   1.969  -0.642  1.00  0.00           N  
HETATM    3  C   UNL     1      -5.696  -0.770   0.430  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.226  -0.938   0.145  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.304  -0.111   0.760  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.956  -0.264   0.500  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.527  -1.248  -0.379  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.800  -1.924  -0.727  1.00  0.00           C  
HETATM    9  C   UNL     1       2.574  -4.229  -0.135  1.00  0.00           C  
HETATM   10  C   UNL     1       2.025  -1.763   1.698  1.00  0.00           C  
HETATM   11  C   UNL     1       4.002   0.127   1.123  1.00  0.00           C  
HETATM   12  C   UNL     1       5.653   1.028  -0.367  1.00  0.00           C  
HETATM   13  C   UNL     1       5.340   0.054  -1.316  1.00  0.00           C  
HETATM   14  C   UNL     1       4.374  -0.874  -1.059  1.00  0.00           C  
HETATM   15  C   UNL     1       8.083   2.474   1.268  1.00  0.00           C  
HETATM   16  C   UNL     1       6.600   2.800  -2.942  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.360   2.536   0.110  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.798   0.317  -0.386  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.299   0.219  -0.569  1.00  0.00           C  
HETATM   20  S   UNL     1      -5.731   1.917  -0.215  1.00  0.00           S  
HETATM   21  O   UNL     1      -7.645   3.677   0.421  1.00  0.00           O  
HETATM   22  O   UNL     1      -8.546  -0.625  -0.534  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.454  -2.076  -0.995  1.00  0.00           C  
HETATM   24  O   UNL     1      -0.201  -1.400  -0.637  1.00  0.00           O  
HETATM   25  C   UNL     1       0.168  -2.433  -1.552  1.00  0.00           C  
HETATM   26  C   UNL     1       1.689  -2.451  -1.715  1.00  0.00           C  
HETATM   27  N   UNL     1       2.312  -2.820  -0.442  1.00  0.00           N  
HETATM   28  C   UNL     1       2.652  -1.843   0.468  1.00  0.00           C  
HETATM   29  C   UNL     1       2.390  -0.754   2.595  1.00  0.00           C  
HETATM   30  O   UNL     1       3.343   0.145   2.302  1.00  0.00           O  
HETATM   31  C   UNL     1       3.694  -0.850   0.162  1.00  0.00           C  
HETATM   32  O   UNL     1       1.827  -0.690   3.675  1.00  0.00           O  
HETATM   33  C   UNL     1       4.986   1.064   0.849  1.00  0.00           C  
HETATM   34  C   UNL     1       6.973   2.994   0.351  1.00  0.00           C  
HETATM   35  C   UNL     1       7.348   1.936  -1.924  1.00  0.00           C  
HETATM   36  H   UNL     1      -9.164   1.679   0.089  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.197  -1.733   0.336  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.828  -0.390   1.443  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.638   0.655   1.444  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.236   0.383   0.980  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.522  -2.571  -1.203  1.00  0.00           H  
HETATM   42  H   UNL     1       3.499  -4.311   0.436  1.00  0.00           H  
HETATM   43  H   UNL     1       1.748  -4.633   0.450  1.00  0.00           H  
HETATM   44  H   UNL     1       2.670  -4.791  -1.064  1.00  0.00           H  
HETATM   45  H   UNL     1       1.255  -2.473   1.962  1.00  0.00           H  
HETATM   46  H   UNL     1       5.865   0.036  -2.259  1.00  0.00           H  
HETATM   47  H   UNL     1       4.135  -1.626  -1.797  1.00  0.00           H  
HETATM   48  H   UNL     1       7.741   1.572   1.776  1.00  0.00           H  
HETATM   49  H   UNL     1       8.967   2.244   0.674  1.00  0.00           H  
HETATM   50  H   UNL     1       8.330   3.237   2.007  1.00  0.00           H  
HETATM   51  H   UNL     1       5.590   2.413  -3.074  1.00  0.00           H  
HETATM   52  H   UNL     1       6.552   3.827  -2.580  1.00  0.00           H  
HETATM   53  H   UNL     1       7.126   2.775  -3.896  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.053  -0.069  -1.591  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.122  -2.843  -1.679  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.168  -3.396  -1.167  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.299  -2.246  -2.519  1.00  0.00           H  
HETATM   58  H   UNL     1       1.964  -3.179  -2.479  1.00  0.00           H  
HETATM   59  H   UNL     1       2.034  -1.462  -2.015  1.00  0.00           H  
HETATM   60  H   UNL     1       5.233   1.820   1.580  1.00  0.00           H  
HETATM   61  H   UNL     1       7.314   3.895  -0.157  1.00  0.00           H  
HETATM   62  H   UNL     1       6.089   3.224   0.946  1.00  0.00           H  
HETATM   63  H   UNL     1       8.358   2.322  -1.792  1.00  0.00           H  
HETATM   64  H   UNL     1       7.396   0.908  -2.286  1.00  0.00           H  
CONECT    1   17   18   36                                            
CONECT    2   34   12   35                                            
CONECT    3    4   19   37   38                                       
CONECT    4    5    5    8    3                                       
CONECT    5    6    4    4   39                                       
CONECT    6    7    7    5   40                                       
CONECT    7   24    6    6   23                                       
CONECT    8   23   23    4   41                                       
CONECT    9   27   42   43   44                                       
CONECT   10   28   28   29   45                                       
CONECT   11   33   31   31   30                                       
CONECT   12    2   13   33   33                                       
CONECT   13   12   14   14   46                                       
CONECT   14   13   13   31   47                                       
CONECT   15   34   48   49   50                                       
CONECT   16   35   51   52   53                                       
CONECT   17   20   21   21    1                                       
CONECT   18   19    1   22   22                                       
CONECT   19   20    3   18   54                                       
CONECT   20   19   17                                                 
CONECT   21   17   17                                                 
CONECT   22   18   18                                                 
CONECT   23    7    8    8   55                                       
CONECT   24   25    7                                                 
CONECT   25   26   24   56   57                                       
CONECT   26   27   25   58   59                                       
CONECT   27    9   28   26                                            
CONECT   28   31   27   10   10                                       
CONECT   29   30   10   32   32                                       
CONECT   30   11   29                                                 
CONECT   31   14   11   11   28                                       
CONECT   32   29   29                                                 
CONECT   33   12   12   11   60                                       
CONECT   34   15    2   61   62                                       
CONECT   35    2   16   63   64                                       
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   19                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
CONECT   62   34                                                      
CONECT   63   35                                                      
CONECT   64   35                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
