From ee31a8c99cec9923376dc2919c4730654434fb02 Mon Sep 17 00:00:00 2001 From: Thomas White Date: Sat, 4 Sep 2010 14:15:33 +0200 Subject: Add P 21 21 21 --- src/cell.c | 1 + 1 file changed, 1 insertion(+) (limited to 'src') diff --git a/src/cell.c b/src/cell.c index 9ae51f0a..a13ad577 100644 --- a/src/cell.c +++ b/src/cell.c @@ -762,6 +762,7 @@ static void cell_set_pointgroup_from_pdb(UnitCell *cell, const char *sym) char *new = NULL; if ( strcmp(sym, "P 63") == 0 ) new = "6"; + if ( strcmp(sym, "P 21 21 21") == 0 ) new = "222"; if ( new != NULL ) { free(cell->pointgroup); -- cgit v1.2.3