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To: gamess-users@glue.umd.edu
From: Fred Salsbury <sals@midway.uchicago.edu>
Date: Wed, 28 Aug 96 18:38:02 CDT
Delivery-date: Wed, 28 Aug 1996 19:55:50 -0400
Reply-to: gamess-users@glue.umd.edu
Sender: owner-gamess-users@glueserv1.umd.edu


Hello,

I have a simple question. I'm trying to do a calculation on a diatomic and I
want the origin to be on one of the atoms. If I'm doing a homonuclear
diatomic and I enter symmetry group DNH 4 then the origin defaults to the
middle, but I want to use the density as an input to something else where I
need the origin on one of the atoms. How can I get GAMESS to do this?

thanks

fred Salsbury
sals@dirac.cchem.berkeley.edu
sals@midway.uchicago.edu

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