From owner-chemistry.,at,.ccl.net Tue May  2 19:07:01 2006
From: "Xiaobo Zheng xiaoboccl:+:gmail.com" <owner-chemistry(0)server.ccl.net>
To: CCL
Subject: CCL:G: Cartesian Coordinate Transformation
Message-Id: <-31667-060502145741-19614-oxzWI6VJQ25Cnz1W013ekw(0)server.ccl.net>
X-Original-From: "Xiaobo  Zheng" <xiaoboccl-x-gmail.com>
Date: Tue, 2 May 2006 14:57:39 -0400


Sent to CCL by: "Xiaobo  Zheng" [xiaoboccl#%#gmail.com]
Dear CCLer,

I am using Gaussian to optimized geometries with constraints and my input format is in cartesian coordinate.  But after optimization, somtimes, Gaussian output does not contain my original cartesian coordinate information.  Instead, it reports "standard orientation", which is a transformation of my original coordinate.  I am just wondering if there is an easy way or tools to transform Gaussian "starndard orientation" back to my cartesian coordinate.

Thanks for your input.

Xiaobo Zheng