From fdeprof.,at,.is1.vub.ac.be Thu Dec 8 04:00:37 1994 Received: from rc1 for fdeprof -8 at 8- is1.vub.ac.be by www.ccl.net (8.6.9/930601.1506) id CAA05927; Thu, 8 Dec 1994 02:50:45 -0500 Received: from vnet3.vub.ac.be by rc1 (8.6.8.1/3.3.1 (Antoon Pardon)) id IAA02089; Thu, 8 Dec 1994 08:52:06 +0100 Received: from [134.184.22.207] (sterfpmc207) by vnet3.vub.ac.be (4.1/VUB.920213) id AA22162; Thu, 8 Dec 94 08:52:03 +0100 Date: Thu, 8 Dec 94 08:52:03 +0100 Message-Id: <9412080752.AA22162 -8 at 8- vnet3.vub.ac.be> X-Sender: fdeprof /at\is1.vub.ac.be (Unverified) Mime-Version: 1.0 Content-Type: text/plain; charset="us-ascii" To: chemistry: at :ccl.net From: fdeprof # - at - # is1.vub.ac.be Subject: Z matrix to cartesian coord. Hi All, I have a problem which is rather urgent. I have internal coordinates for a number of highly symmetric molecules (symmetry Ih). I would like to have the cartesian coordinates of these Z-matrices to a rather big accuracy (10-15 digits after the komma), to exchange with other people whose programs only read cartesian coordinates. Is there a possibility to obtain these cartesian coordinates to this larger accuracy with the Gaussian 92 program, in stead of the standard six digits after the komma the program yields ? Please mail all the answers to me as soon as possible, I will summarize for the net. Thanks, Frank De Proft