From acp37@rs1.rrz.Uni-Koeln.DE Wed Sep 20 11:03:04 1995 Received: from rs1.rrz.Uni-Koeln.DE for acp37@rs1.rrz.Uni-Koeln.DE by www.ccl.net (8.6.10/950822.1) id KAA00452; Wed, 20 Sep 1995 10:50:17 -0400 Received: by rs1.rrz.Uni-Koeln.DE id AA127543 (5.67b/IDA-1.5 for CCL ); Wed, 20 Sep 1995 16:49:49 +0200 Date: Wed, 20 Sep 1995 16:49:49 +0200 (MST) From: "T. Koch" To: CCL Subject: Exact symmetries needed Message-Id: Mime-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII Dear netters, I am looking for a cute little program which would be so kind and generate exact symmetric coordinates from my approximate ones. I already tried newzmat from the Gaussian package, but it seems to be too far from the desired symmetry for it. Any help would be great. Thorsten Koch /-----------------------------------------------------------------\ | Thorsten Koch | | Institut fuer Physikalische Chemie II der Universitaet zu Koeln | | Luxemburger Str. 116, 50939 Koeln, Germany | | acp37@rrz.uni-koeln.de | | Tel. +49 [0]221 470 4816 | \-----------------------------------------------------------------/