Crystal Structure Data

Spacegroup Symbol:	I 4/m m m
Origin Offset:	(none)
Lattice Type:	I

Unit Cell Parameters
a [A]	b [A]	c [A]	alpha [deg]	beta [deg]	gamma [deg]
3.8550	3.8550	29.3180	90.000	90.000	90.000

Fractional Coordinates of Atoms in the Asymmetric Unit
Site Label	Element	x	y	z
Ba	Ba	0.0000	0.0000	0.1218
Ca	Ca	0.0000	0.0000	0.0000
Cu	Cu	0.5000	0.5000	0.0540
O1	O	0.0000	0.5000	0.0531
O2	O	0.5000	0.5000	0.1461
O3	O	0.6040	0.5000	0.2815
Tl	Tl	0.5000	0.5000	0.2136

This page created by CrystalMaker
CrystalMaker Software Ltd., Begbroke Science Park, Building 5, Yarnton, OX5 1PF, UK
E-mail: info@crystalmaker.cm
Web site: http://www.crystalmaker.com