#!/usr/bin/perl -w use strict; my $line; printf("CrystFEL reflection list version 2.0\n"); printf("Symmetry: 1\n"); printf(" h k l I phase sigma(I) nmeas\n"); while ( $line = ) { if ( $line =~ /([\d\-]+)\s+([\d\-]+)\s+([\d\-]+)\s+([\d\.\-]+)\s+([\d\.\-]+)\s+([\d\.\-]+)/ ) { my $h = $1; my $k = $2; my $l = $3; my $intensity = $4; my $phase = $5; my $sigi = $6; printf("%4i %4i %4i %10.2f %s %10.2f %7i\n", $h, $k, $l, $intensity, " -", $sigi, 1, 0.0, 0.0); } } printf("End of reflections\n");