Vaterite
	Demichelis R, Raiteri P, Gale J D, Dovesi R
	CrystEngComm 14 (2012) 44-47
	A new structural model for disorder in vaterite from first-principles calculations
	Locality: theoretical
	_database_code_amcsd 0019870
	7.1239 7.1239 25.3203 90 90 120 P3_221
	atom x y z
	Ca1 .98731 .00884 .25020
	Ca2 .66938 .29692 .25375
	Ca3 .30357 .63281 .24648
	C1 .03394 .36633 .16169
	C2 .94957 .62773 .66089
	C3 0 .30149 5/6
	C4 0 .69852 1/3
	O5 0 .11971 5/6
	O6 0 .87944 1/3
	O7 .98084 .37860 .78859
	O8 .99342 .60886 .28838
	O9 .92793 .26758 .12000
	O10 .99651 .67669 .61111
	O11 .21701 .54412 .15803
	O12 .77434 .44983 .67169
	O13 .96475 .29501 .20912
	O14 .07260 .75107 .69768
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