Subject: CCL: Re:Cannot optimize phenylferrocene

From: Joao Otavio M A Lins <[email-masked]>
Date: Tue, 12 May 1998 17:02:04 GMT

Dear Yubo,

	In my opinion, if you wish to optimize all geometric 
parameters it is better to use cartesian coordinates rather than
Z-matrix. The z-matrix must be misdefined.

							-Joao