COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.324  -1.275   0.280  1.00  0.00           C  
HETATM    2  N   UNL     1       0.918   2.151   0.466  1.00  0.00           N  
HETATM    3  O   UNL     1      -4.886  -0.766  -0.648  1.00  0.00           O  
HETATM    4  C   UNL     1       2.249   0.104   0.416  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.600   0.043  -0.442  1.00  0.00           N  
HETATM    6  O   UNL     1      -3.869  -0.424   1.581  1.00  0.00           O  
HETATM    7  C   UNL     1       3.377   0.874   0.224  1.00  0.00           C  
HETATM    8  O   UNL     1       5.840  -1.700  -0.544  1.00  0.00           O  
HETATM    9  C   UNL     1       4.581   0.268  -0.096  1.00  0.00           C  
HETATM   10  C   UNL     1       4.657  -1.109  -0.229  1.00  0.00           C  
HETATM   11  C   UNL     1       3.522  -1.882  -0.036  1.00  0.00           C  
HETATM   12  C   UNL     1       0.922   0.718   0.773  1.00  0.00           C  
HETATM   13  C   UNL     1       2.075   2.812   1.084  1.00  0.00           C  
HETATM   14  C   UNL     1       3.339   2.376   0.343  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.197   0.024  -0.006  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.543   0.641   0.387  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.507   2.149   0.121  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.342   2.779   0.884  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.583   0.291  -1.890  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.531   1.803  -2.132  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.339   2.397  -1.378  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.116  -2.576   0.196  1.00  0.00           C  
HETATM   23  C   UNL     1       5.841  -3.124  -0.665  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.131  -3.544   0.807  1.00  0.00           C  
HETATM   25  S   UNL     1      -3.785  -0.890   0.242  1.00  0.00           S  
HETATM   26  H   UNL     1       1.439  -1.877   0.427  1.00  0.00           H  
HETATM   27  H   UNL     1       5.465   0.871  -0.242  1.00  0.00           H  
HETATM   28  H   UNL     1       3.574  -2.956  -0.136  1.00  0.00           H  
HETATM   29  H   UNL     1       0.737   0.579   1.838  1.00  0.00           H  
HETATM   30  H   UNL     1       1.962   3.894   1.010  1.00  0.00           H  
HETATM   31  H   UNL     1       2.145   2.523   2.133  1.00  0.00           H  
HETATM   32  H   UNL     1       4.217   2.717   0.893  1.00  0.00           H  
HETATM   33  H   UNL     1       3.345   2.819  -0.653  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.034   0.159  -1.075  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.201  -1.039   0.232  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.745   0.443   1.440  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.441   2.598   0.460  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.484   2.629   1.954  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.303   3.847   0.669  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.704  -0.180  -2.331  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.485  -0.123  -2.342  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.420   1.996  -3.199  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.454   2.260  -1.774  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.289   3.469  -1.566  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.419   1.925  -1.724  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.188  -2.614   0.766  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.920  -2.861  -0.838  1.00  0.00           H  
HETATM   48  H   UNL     1       6.845  -3.466  -0.918  1.00  0.00           H  
HETATM   49  H   UNL     1       5.534  -3.570   0.281  1.00  0.00           H  
HETATM   50  H   UNL     1       5.147  -3.423  -1.450  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.327  -3.259   1.841  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.059  -3.505   0.237  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.729  -4.557   0.780  1.00  0.00           H  
CONECT    1    4    4   11   26                                       
CONECT    2   13   18   12                                            
CONECT    3   25   25                                                 
CONECT    4    7   12    1    1                                       
CONECT    5   16   19   25                                            
CONECT    6   25   25                                                 
CONECT    7   14    9    9    4                                       
CONECT    8   23   10                                                 
CONECT    9    7    7   10   27                                       
CONECT   10    9    8   11   11                                       
CONECT   11   10   10    1   28                                       
CONECT   12    2    4   15   29                                       
CONECT   13   14    2   30   31                                       
CONECT   14   13    7   32   33                                       
CONECT   15   12   16   34   35                                       
CONECT   16   17   15    5   36                                       
CONECT   17   18   21   16   37                                       
CONECT   18    2   17   38   39                                       
CONECT   19   20    5   40   41                                       
CONECT   20   21   19   42   43                                       
CONECT   21   17   20   44   45                                       
CONECT   22   25   24   46   47                                       
CONECT   23    8   48   49   50                                       
CONECT   24   22   51   52   53                                       
CONECT   25    5    3    3    6                                       
CONECT   25    6   22                                                 
CONECT   26    1                                                      
CONECT   27    9                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
