Weddellite
	Izatulina A, Gurzhiy V, Frank-Kamenetskaya O
	American Mineralogist 99 (2014) 2-7
	Weddellite from renal stones: Structure refinement and dependence of
	crystal chemical features on H2O content.
	Note: Sample 1
	Locality: oxalic renal stones of St. Petersburg citizens aged 24-65 years
	_database_code_amcsd 0020071
	12.3363 12.3363 7.3448 90 90 90 I4/m
	atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Ca1 .69940 .19936 .5 .01288 .0144 .0131 .0111 -.0014 .000 .000
	C1 .74239 -.05333 .3945 .0157 .0210 .0141 .0121 .0008 .0020 .0003
	O1 .74513 -.14369 .3173 .0192 .0308 .0144 .0124 .0034 -.0017 -.0025
	O2 .73769 .03708 .3201 .0352 .0762 .0146 .0147 .0042 .0073 .0022
	OW1 .6449 .3854 .5 .0326 .0472 .0214 .0292 .0004 .000 .000
	OW2 .5186 .1175 .5 .0366 .0306 .0452 .0339 -.0139 .000 .000
	Wat3 .5 .5 .14 .09 .09
	Wat31 .5 .5 .219 .18 .08
	H1 .668 .424 .403 .106
	H2 .5 .113 .396 .24
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