Bassanite
	Abriel W, Nesper R
	Zeitschrift fur Kristallographie 205 (1993) 99-113
	Bestimmung der Kristallstruktur von CaSO4(H2O)0.5 mit
	Rontgenbeugungsmethoden und mit Potentialprofil-Rechnungen
	Locality: synthetic
	_database_code_amcsd 0019828
	6.937 6.937 6.345 90 90 120 P3_121
	atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Ca .5447 0 5/6 .0331 .0162 .0120 -.0004 -.0002 .0081
	S .5504 0 1/3 .0144 .0114 .0120 .0030 .0015 .0057
	O1 .5969 .8550 .4653 .0224 .0256 .0376 .0215 .0042 .0152
	O2 .3647 .8722 .1889 .0269 .0152 .0158 -.0027 -.0025 -.0012
	Wat .9015 0 5/6 .5 .0264 .0376 .179 -.027 -.0134 .0188
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