COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -4.476  -0.819   1.149  1.00  0.00           N  
HETATM    2  C   UNL     1       1.251   2.123   0.570  1.00  0.00           C  
HETATM    3  C   UNL     1       0.042   1.385   0.540  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.778   2.697  -0.166  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.998   3.845  -0.812  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.677   4.607  -1.951  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.902   1.670   2.005  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.459  -1.326   0.399  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.969  -3.862  -1.854  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.054  -0.798   0.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.346  -0.490   0.618  1.00  0.00           C  
HETATM   12  C   UNL     1       2.464   1.530   0.331  1.00  0.00           C  
HETATM   13  C   UNL     1       1.375  -0.555  -0.018  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.016   0.268   1.839  1.00  0.00           C  
HETATM   15  C   UNL     1       0.134   0.062   0.199  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.719   0.500   1.507  1.00  0.00           C  
HETATM   17  C   UNL     1       2.540   0.177   0.049  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.010  -1.913  -0.779  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.330  -2.440  -0.456  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.521   3.652  -2.252  1.00  0.00           C  
HETATM   21  C   UNL     1       5.983  -1.840   1.327  1.00  0.00           C  
HETATM   22  C   UNL     1       4.624  -1.145   1.428  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.015   2.167   0.972  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.112  -2.687  -0.991  1.00  0.00           N  
HETATM   25  O   UNL     1      -4.286  -3.157  -0.704  1.00  0.00           O  
HETATM   26  O   UNL     1       3.801  -1.713  -1.046  1.00  0.00           O  
HETATM   27  O   UNL     1       4.937   0.455  -0.683  1.00  0.00           O  
HETATM   28  S   UNL     1       4.101  -0.596  -0.220  1.00  0.00           S  
HETATM   29  H   UNL     1      -5.380  -1.169   1.184  1.00  0.00           H  
HETATM   30  H   UNL     1       1.217   3.180   0.787  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.743   3.064   0.182  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.933   1.906  -0.900  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.355   4.413  -0.139  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.680   4.291  -2.241  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.481   5.677  -2.029  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.575   2.470   2.313  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.309   1.352   2.862  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.690  -4.725  -1.249  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.916  -4.062  -2.356  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.196  -3.674  -2.598  1.00  0.00           H  
HETATM   41  H   UNL     1       3.366   2.122   0.363  1.00  0.00           H  
HETATM   42  H   UNL     1       1.418  -1.611  -0.239  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.594   0.853   2.539  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.075  -2.191  -1.244  1.00  0.00           H  
HETATM   45  H   UNL     1       0.437   4.094  -2.528  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.762   2.708  -2.740  1.00  0.00           H  
HETATM   47  H   UNL     1       5.901  -2.703   0.665  1.00  0.00           H  
HETATM   48  H   UNL     1       6.719  -1.143   0.925  1.00  0.00           H  
HETATM   49  H   UNL     1       6.297  -2.171   2.317  1.00  0.00           H  
HETATM   50  H   UNL     1       3.888  -1.842   1.829  1.00  0.00           H  
HETATM   51  H   UNL     1       4.706  -0.283   2.090  1.00  0.00           H  
CONECT    1    8   14   29                                            
CONECT    2    3    3   12   30                                       
CONECT    3    2    2   15   23                                       
CONECT    4    5   23   31   32                                       
CONECT    5    4    6   20   33                                       
CONECT    6    5   20   34   35                                       
CONECT    7   16   23   36   37                                       
CONECT    8    1   11   11   19                                       
CONECT    9   24   38   39   40                                       
CONECT   10   11   15   18   18                                       
CONECT   11    8    8   10   16                                       
CONECT   12    2   17   17   41                                       
CONECT   13   15   15   17   42                                       
CONECT   14    1   16   16   43                                       
CONECT   15    3   10   13   13                                       
CONECT   16    7   11   14   14                                       
CONECT   17   12   12   13   28                                       
CONECT   18   10   10   24   44                                       
CONECT   19    8   24   25   25                                       
CONECT   20    5    6   45   46                                       
CONECT   21   22   47   48   49                                       
CONECT   22   21   28   50   51                                       
CONECT   23    3    4    7                                            
CONECT   24    9   18   19                                            
CONECT   25   19   19                                                 
CONECT   26   28   28                                                 
CONECT   27   28   28                                                 
CONECT   28   17   22   26   26                                       
CONECT   28   27   27                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
