Ziesite
	Yashima M, Suzuki R O
	Physical Review B79 (2009) 125201-6
	Electronic structure and magnetic properties of monoclinic beta-Cu2V2O7:
	A GGA+U study
	Note: theoretical study, in a triclinic setting
	_database_code_amcsd 0018361
	7.8468 5.6213 10.18 103.61 109.71 45.74 P1
	atom x y z
	Cu1 .7582 .8522 .9841
	Cu2 .3897 .8522 .5159
	Cu3 .6103 .1478 .4841
	Cu4 .2419 .1478 .0159
	V1 .5566 .4431 .2134
	V2 .0003 .4431 .2866
	V3 .4434 .5569 .7866
	V4 .9997 .5569 .7134
	O1 .8650 .2700 .2500
	O2 .1350 .7301 .7500
	O3 .3673 .8110 .1354
	O4 .8218 .8110 .3646
	O5 .6327 .1890 .8646
	O6 .1782 .1890 .6354
	O7 .5339 .1805 .1021
	O8 .2856 .1805 .3979
	O9 .4661 .8195 .8979
	O10 .7144 .8195 .6021
	O11 .4853 .5046 .3723
	O12 .0101 .5046 .1277
	O13 .5147 .4954 .6277
	O14 .9899 .4954 .8723
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