From ep7 # - at - # dent.okayama-u.ac.jp Tue Jun 16 23:10:18 1998 Received: from deews1.dent.okayama-u.ac.jp (deews1.dent.okayama-u.ac.jp [150.46.202.36]) by www.ccl.net (8.8.3/8.8.6/OSC/CCL 1.0) with ESMTP id XAA24739 Tue, 16 Jun 1998 23:09:44 -0400 (EDT) From: ep7 -A_T- dent.okayama-u.ac.jp Received: from [150.46.140.80] (yobou2.dent.okayama-u.ac.jp [150.46.140.80]) by deews1.dent.okayama-u.ac.jp (8.8.8/3.6W) with SMTP id MAA28445 for ; Wed, 17 Jun 1998 12:11:08 +0900 (JST) Message-Id: <199806170311.MAA28445;at;deews1.dent.okayama-u.ac.jp> Date: Wed, 17 Jun 1998 12:27:10 +0900 To: CHEMISTRY#* at *#www.ccl.net Subject: XYZ to Zmat MIME-Version: 1.0 Content-Type: text/plain; charset=iso-2022-jp X-Mailer: Eudora-J(1.3.8.5-J13) Thank you for everybody. Other persons are the same opinion. Date: Thu, 11 Jun 1998 08:10:00 -0400 From: Ned Martin Subject: XYZ to Zmat To: ep7 -8 at 8- dent.okayama-u.ac.jp X-Mailer: Microsoft Outlook Express 4.71.1712.3 Content-type: text/plain; charset="iso-8859-1" Content-transfer-encoding: 7bit X-MSMail-Priority: Normal X-MimeOLE: Produced By Microsoft MimeOLE V4.71.1712.3 X-Priority: 3 X-UIDL: 9e0af511eaaab70825230d1f053cf471 Masao, Use the newzmat utility: newzmat -ixyz -ozmat filename.xyz filename.com Then enter the charge and multiplicity (default 0, 1) when prompted. The filenames may have any extensions; I used .xyz and .com as examples. Good luck. Ned ************************************************************************ Ned H. Martin, W.S. DeLoach Professor Tel: (910) 962-3453 Department of Chemistry Fax: (910) 962-3013 University of North Carolina at Wilmington Wilmington, NC 28403-3297 email: martinn ^%at%^ uncwil.edu ************************************************************************