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33 bytes added ,  16:02, 4 December 2007
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  INCLUDE_RESOLUTION_RANGE=50 1  ! optional  
 
  INCLUDE_RESOLUTION_RANGE=50 1  ! optional  
 
  OUTPUT_FILE=temp.hkl  CCP4    FRIEDEL'S_LAW=FALSE
 
  OUTPUT_FILE=temp.hkl  CCP4    FRIEDEL'S_LAW=FALSE
After running XDSCONV one would then run
+
This produces the file temp.hkl which is then converted to a MTZ file XDS_ASCII.mtz with
 
  f2mtz HKLOUT temp.mtz<F2MTZ.INP
 
  f2mtz HKLOUT temp.mtz<F2MTZ.INP
  cad HKLIN1 temp.mtz HKLOUT junk_truncated.mtz<<EOF
+
  cad HKLIN1 temp.mtz HKLOUT XDS_ASCII.mtz<<EOF
 
  LABIN FILE 1 E1=FP E2=SIGFP E3=DANO E4=SIGDANO
 
  LABIN FILE 1 E1=FP E2=SIGFP E3=DANO E4=SIGDANO
  LABOUT FILE 1 E1=FP E2=SIGFP E3=DANO_sulf E4=SIGDANO_sulf
+
  LABOUT FILE 1 E1=FP E2=SIGFP E3=DANO E4=SIGDANO
 
  END
 
  END
 
  EOF
 
  EOF
    
''More to come''
 
''More to come''
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