From owner-chemistry@ccl.net Mon Feb  8 06:17:01 2016
From: "Josh BERRYMAN Josh.Berryman%%uni.lu" <owner-chemistry-$-server.ccl.net>
To: CCL
Subject: CCL:G: Cartesian to z-matrix
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X-Original-From: Josh BERRYMAN <Josh.Berryman^^uni.lu>
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Date: Mon, 8 Feb 2016 11:14:34 +0000
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Sent to CCL by: Josh BERRYMAN [Josh.Berryman()uni.lu]

Oganov's lab offer something:

http://han.ess.sunysb.edu/zmatrix/

no personal experience of this, but am eager to hear other people's suggestions for converting e.g. an AMBER top + crd file pair to z-matrix format.

Josh


________________________________________
> From: owner-chemistry+josh.berryman==uni.lu[a]ccl.net [owner-chemistry+josh.berryman==uni.lu[a]ccl.net] on behalf of K Kumar Kd2f^^mtmail.mtsu.edu [owner-chemistry[a]ccl.net]
Sent: Saturday, February 06, 2016 07:14 AM
To: Josh BERRYMAN
Subject: CCL:G: Cartesian to z-matrix

Sent to CCL by: "K  Kumar" [Kd2f|mtmail.mtsu.edu]
Dear ccl users,

Could anyone suggest a software to convert from cartesian to z-matrix. Please recommend other
than "newzmat" command in gaussian and "openbabel" software. I tried them but having trouble
with them.http://www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp://www.ccl.net/chemistry/sub_unsub.shtmlhttp://www.ccl.net/spammers.txt