SKLOUT: Output Atom Site Data for Schakal

Contact Author: Syd Hall, Crystallography Centre,

University of Western Australia, Nedlands 6009, Australia.

SKLOUT produces a file containing atomic coordinate data suitable for input to the molecular graphics program Schakal (Keller).

Application

The coordinates of atom sites on the archive files are output to the line file skl. There are two mode options. Entering mole will cause a connected set of atom sites for a single molecule to output (this is the default). Entering cell will cause all atom sites belonging to connected molecules in a single cell to be output to adm.The program Schakal may be obtained from Egbert Keller, Universitat Freiburg, Kristallographie Institut, Hebelstr. 25, D-7800 Freiburg, Germany email: egbert.freiburg@ruf.uni-freiburg.dbp.de.

File Assignments

Reads data from the input archive bdf.

Writes data to the line file skl