 RMCXAS: eXafs And Scattering 08/21/24mw mac                                     
 PID   2774
  
 initialize rmc
 open log book
 input parameters
 input / generate coordinates of phase:   1
 generate coordinates   768
 input data set no.   1  from mzro2.S_of_q.dat               
 calculate maximum chisq   4.125612E+06  1
 INAFF
 input spectrum no.   1  from mw_0037to39.mcm                
 calculate maximum chisq   2201.30  1
 phase number   1
 number of partial pair distribution functions (pPDFs):   2
 # of pPDFs to compute (diffraction):   3
 output initial pdf
 scattering background
 calculate initial chisq   165072.
  
 INPUT THEORETICAL DATA (FEFF): 
 exafs kernels
 calculate initial spectrum
 calculate initial chisq   368481.
 output initial spectra
  
 START RMC CYCLES
  
 STOP AFTER   768  RMC CYCLES
