From jkl@ccl.net  Sun Oct 25 17:04:56 1992
From: jkl@ccl.net (Jan Labanowski)
Date: Sun, 25 Oct 1992 22:04:56 -0500
To: chemistry@ccl.net
Subject: fract2xyz - fractional to cartesian coordinates program


Dear CCLers,
Thanks to Rene Kanters we have a nice addition to our archives:
fract2xyz.c which converts the fractional coordinates (which crystallographers
like) to Xmol XYZ format which is essentially the cartesian coordinates.
All instructions on how to compile and use the program are given as
a comment on the top of the program. Program is short and elegant.
Enjoy...

How to get it:
Via e-mail:
Send a message:
   send fract2xyz.c from chemistry
to OSCPOST@ccl.net or OSCPOST@OHSTPY.BITNET and wait (at least 2 hrs)
for a message with the program.

Via ftp:
ftp www.ccl.net    (or ftp 128.146.36.48)
Login: anonymous
Password: Your_e_mail_address
ftp> cd pub/chemistry
ftp> ascii
ftp> get fract2xyz.c
ftp> quit        or bye if you want to be polite to August Kekule {:-)}

Send comments to Rene Kanters (KANTERS@urvax.urich.edu)

Thanks again Rene,

Jan Labanowski
Ohio Supercomputer Center
jkl@ccl.net