#!/bin/sh 

set -e

#   Remember the order of reflections will be funny.
#
# Use cad or sortmtz to fix it.

reindex     \
HKLIN  $CEXAM/toxd/toxd_old \
HKLOUT $CCP4_SCR/toxd_reind1  \
<< END-mtz 
reindex HKL h/2 -l/2, k, h/2 +l/2 
end
END-mtz

echo H K L | sortmtz HKLIN $CCP4_SCR/toxd_reind1 HKLOUT $CCP4_SCR/toxd_reind2
#