COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.019  -0.229  -1.580  1.00  0.00           C  
HETATM    2  C   UNL     1       5.522   0.901  -2.193  1.00  0.00           C  
HETATM    3  C   UNL     1       5.894   1.995  -1.432  1.00  0.00           C  
HETATM    4  C   UNL     1       5.272  -2.476   0.855  1.00  0.00           C  
HETATM    5  C   UNL     1       3.003  -1.526   0.636  1.00  0.00           C  
HETATM    6  C   UNL     1       2.489  -2.611   1.349  1.00  0.00           C  
HETATM    7  C   UNL     1       1.122  -2.689   1.536  1.00  0.00           C  
HETATM    8  C   UNL     1       0.860  -0.721   0.363  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.372   0.094  -0.044  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.188   1.201   0.132  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.564   1.038   0.221  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.118  -0.233   0.133  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.302  -1.334  -0.042  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.398   2.233  -0.668  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.317   3.429  -0.402  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.536   4.572   0.720  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.599   3.388   0.465  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.975  -3.812   0.288  1.00  0.00           O  
HETATM   19  S   UNL     1      -4.009  -2.944  -0.154  1.00  0.00           S  
HETATM   20  O   UNL     1      -5.233  -2.839   0.560  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.324  -3.178  -1.925  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.390   2.150   0.398  1.00  0.00           N  
HETATM   23  O   UNL     1      -5.528   4.618  -0.309  1.00  0.00           O  
HETATM   24  C   UNL     1      -1.933  -1.175  -0.131  1.00  0.00           C  
HETATM   25  N   UNL     1       0.014   0.254  -0.139  1.00  0.00           N  
HETATM   26  N   UNL     1       0.345  -1.740   1.036  1.00  0.00           N  
HETATM   27  N   UNL     1       2.165  -0.607   0.167  1.00  0.00           N  
HETATM   28  N   UNL     1       4.368  -1.406   0.425  1.00  0.00           N  
HETATM   29  C   UNL     1       4.882  -0.266  -0.198  1.00  0.00           C  
HETATM   30  C   UNL     1       4.614  -1.420  -2.410  1.00  0.00           C  
HETATM   31  C   UNL     1       5.256   0.834   0.563  1.00  0.00           C  
HETATM   32  C   UNL     1       5.764   1.960  -0.056  1.00  0.00           C  
HETATM   33  C   UNL     1       6.171   3.153   0.769  1.00  0.00           C  
HETATM   34  O   UNL     1       7.546   3.029   1.140  1.00  0.00           O  
HETATM   35  H   UNL     1       5.624   0.932  -3.268  1.00  0.00           H  
HETATM   36  H   UNL     1       6.287   2.878  -1.914  1.00  0.00           H  
HETATM   37  H   UNL     1       5.395  -3.196   0.046  1.00  0.00           H  
HETATM   38  H   UNL     1       6.242  -2.050   1.113  1.00  0.00           H  
HETATM   39  H   UNL     1       4.853  -2.977   1.727  1.00  0.00           H  
HETATM   40  H   UNL     1       3.145  -3.372   1.746  1.00  0.00           H  
HETATM   41  H   UNL     1       0.692  -3.515   2.082  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.755   2.188   0.201  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.189  -0.361   0.202  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.989   1.317  -0.683  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.902   2.362  -1.630  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.030   3.529  -1.220  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.854   3.274   0.533  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.021   4.451   1.688  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.962   5.499   0.714  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.074   3.536  -0.478  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.876   3.315   1.278  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.767  -4.161  -2.088  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.009  -2.408  -2.278  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.384  -3.108  -2.473  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.297  -2.038  -0.268  1.00  0.00           H  
HETATM   56  H   UNL     1       0.383   1.048  -0.557  1.00  0.00           H  
HETATM   57  H   UNL     1       5.468  -2.087  -2.530  1.00  0.00           H  
HETATM   58  H   UNL     1       3.804  -1.953  -1.910  1.00  0.00           H  
HETATM   59  H   UNL     1       4.276  -1.082  -3.390  1.00  0.00           H  
HETATM   60  H   UNL     1       5.151   0.809   1.637  1.00  0.00           H  
HETATM   61  H   UNL     1       6.034   4.063   0.184  1.00  0.00           H  
HETATM   62  H   UNL     1       5.555   3.202   1.667  1.00  0.00           H  
HETATM   63  H   UNL     1       7.877   3.764   1.674  1.00  0.00           H  
CONECT    1   29   30    2    2                                       
CONECT    2    1    1    3   35                                       
CONECT    3   32   32    2   36                                       
CONECT    4   28   37   38   39                                       
CONECT    5    6    6   27   28                                       
CONECT    6    7    5    5   40                                       
CONECT    7   26   26    6   41                                       
CONECT    8   26   25   27   27                                       
CONECT    9   24   25   10   10                                       
CONECT   10    9    9   11   42                                       
CONECT   11   12   12   10   22                                       
CONECT   12   13   11   11   43                                       
CONECT   13   19   24   24   12                                       
CONECT   14   22   15   44   45                                       
CONECT   15   14   23   46   47                                       
CONECT   16   17   23   48   49                                       
CONECT   17   22   16   50   51                                       
CONECT   18   19   19                                                 
CONECT   19   20   20   21   18                                       
CONECT   19   18   13                                                 
CONECT   20   19   19                                                 
CONECT   21   19   52   53   54                                       
CONECT   22   11   17   14                                            
CONECT   23   16   15                                                 
CONECT   24   13   13    9   55                                       
CONECT   25    9    8   56                                            
CONECT   26    7    7    8                                            
CONECT   27    8    8    5                                            
CONECT   28    5    4   29                                            
CONECT   29   28   31   31    1                                       
CONECT   30    1   57   58   59                                       
CONECT   31   29   29   32   60                                       
CONECT   32   31   33    3    3                                       
CONECT   33   32   34   61   62                                       
CONECT   34   33   63                                                 
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   34                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
