From chemistry-request /at\ccl.net Tue Sep 7 14:29:35 2004 Received: from smtp1.nodak.edu (smtp1.NoDak.edu [134.129.111.50]) by server.ccl.net (8.12.8/8.12.8) with ESMTP id i87JTYPS015562 for ; Tue, 7 Sep 2004 14:29:35 -0500 Received: from ndsu.nodak.edu (dyn216.cie-122.ndsu.NoDak.edu [134.129.122.216]) (authenticated) by smtp1.nodak.edu (8.11.6/8.11.6) with ESMTP id i87Jd5G24074 for ; Tue, 7 Sep 2004 14:39:10 -0500 Message-ID: <413E0EBE.2050207~at~ndsu.nodak.edu> Date: Tue, 07 Sep 2004 14:40:46 -0500 From: Pijush Ghosh User-Agent: Mozilla/5.0 (Windows; U; Windows NT 5.1; en-US; rv:1.0.2) Gecko/20030208 Netscape/7.02 X-Accept-Language: en-us, en MIME-Version: 1.0 To: CHEMISTRY~at~ccl.net Subject: CCL: Unit cell coordinates for Aragonite. Content-Type: text/plain; charset=us-ascii; format=flowed Content-Transfer-Encoding: 7bit X-Spam-Status: No, hits=0.0 required=7.5 tests=none autolearn=no version=2.61 X-Spam-Checker-Version: SpamAssassin 2.61 (1.212.2.1-2003-12-09-exp) on servernd.ccl.net CCL-friends, I have all the information for the unit cell of Aragonite ( space group, cell dimension, general position etc), but finding some problem to build a model of the same in Cerius2 or in Sybyl6.91. Could anyone help me with the coordinates of unit cell of aragonite. If anyone has tool which is efficient in building unit cell atomic model, please let me know, I can pass on the details needed for building. Thank you. Pijush Ghosh PhD Student Dept. of Civil Engineering. North Dakota State University Fargo. ND-58105. Phone: 701-231-6491(Lab) 701-231-4096(Res)