COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -1.069  -0.616   4.021  1.00  0.00           S  
HETATM    2  O   UNL     1      -2.612  -0.429   6.243  1.00  0.00           O  
HETATM    3  O   UNL     1       1.772   0.669   6.138  1.00  0.00           O  
HETATM    4  O   UNL     1       0.394  -0.497  -2.144  1.00  0.00           O  
HETATM    5  N   UNL     1      -0.383   0.153   6.278  1.00  0.00           N  
HETATM    6  N   UNL     1       1.174  -0.291  -4.871  1.00  0.00           N  
HETATM    7  N   UNL     1      -1.094  -0.813  -4.574  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.525  -0.287   5.717  1.00  0.00           C  
HETATM    9  C   UNL     1       0.755   0.270   5.614  1.00  0.00           C  
HETATM   10  C   UNL     1       0.697  -0.129   4.147  1.00  0.00           C  
HETATM   11  C   UNL     1       1.013   1.056   3.233  1.00  0.00           C  
HETATM   12  C   UNL     1       0.847   0.640   1.794  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.378   0.784   1.171  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.532   0.403  -0.147  1.00  0.00           C  
HETATM   15  C   UNL     1       0.544  -0.122  -0.846  1.00  0.00           C  
HETATM   16  C   UNL     1       1.771  -0.270  -0.217  1.00  0.00           C  
HETATM   17  C   UNL     1       1.922   0.116   1.100  1.00  0.00           C  
HETATM   18  C   UNL     1       1.662  -0.992  -2.579  1.00  0.00           C  
HETATM   19  C   UNL     1       1.563  -1.434  -4.041  1.00  0.00           C  
HETATM   20  C   UNL     1       2.203   0.571  -5.457  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.170  -0.026  -5.102  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.381  -0.593  -4.764  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.812   0.467  -5.536  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.874   1.313  -6.113  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.532   1.060  -5.891  1.00  0.00           C  
HETATM   26  H   UNL     1      -0.396   0.397   7.217  1.00  0.00           H  
HETATM   27  H   UNL     1       1.356  -0.972   3.939  1.00  0.00           H  
HETATM   28  H   UNL     1       2.040   1.381   3.402  1.00  0.00           H  
HETATM   29  H   UNL     1       0.331   1.877   3.455  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.215   1.194   1.716  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.489   0.516  -0.634  1.00  0.00           H  
HETATM   32  H   UNL     1       2.610  -0.680  -0.759  1.00  0.00           H  
HETATM   33  H   UNL     1       2.878   0.004   1.589  1.00  0.00           H  
HETATM   34  H   UNL     1       1.952  -1.843  -1.962  1.00  0.00           H  
HETATM   35  H   UNL     1       2.411  -0.205  -2.487  1.00  0.00           H  
HETATM   36  H   UNL     1       0.814  -2.221  -4.132  1.00  0.00           H  
HETATM   37  H   UNL     1       2.530  -1.812  -4.373  1.00  0.00           H  
HETATM   38  H   UNL     1       3.189   0.209  -5.168  1.00  0.00           H  
HETATM   39  H   UNL     1       2.114   0.555  -6.543  1.00  0.00           H  
HETATM   40  H   UNL     1       2.070   1.591  -5.096  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.107  -1.253  -4.314  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.867   0.636  -5.690  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.185   2.149  -6.721  1.00  0.00           H  
HETATM   44  H   UNL     1       0.223   1.699  -6.325  1.00  0.00           H  
CONECT    1    8   10                                                 
CONECT    2    8    8                                                 
CONECT    3    9    9                                                 
CONECT    4   15   18                                                 
CONECT    5    8    9   26                                            
CONECT    6   19   20   21                                            
CONECT    7   21   21   22                                            
CONECT    8    1    2    2    5                                       
CONECT    9    3    3    5   10                                       
CONECT   10    1    9   11   27                                       
CONECT   11   10   12   28   29                                       
CONECT   12   11   13   13   17                                       
CONECT   13   12   12   14   30                                       
CONECT   14   13   15   15   31                                       
CONECT   15    4   14   14   16                                       
CONECT   16   15   17   17   32                                       
CONECT   17   12   16   16   33                                       
CONECT   18    4   19   34   35                                       
CONECT   19    6   18   36   37                                       
CONECT   20    6   38   39   40                                       
CONECT   21    6    7    7   25                                       
CONECT   22    7   23   23   41                                       
CONECT   23   22   22   24   42                                       
CONECT   24   23   25   25   43                                       
CONECT   25   21   24   24   44                                       
CONECT   26    5                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   11                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
