Rhodocrosite
	Merlini M, Hanfland M, Gemmi M
	American Mineralogist 100 (2015) 2625-2629
	The MnCO3-II high-pressure polymorph of rhodocrosite
	Note: Sample run2-p3
	Note: P = 1.62 GPa
	Locality: Sardegna, Italy
	_database_code_amcsd 0020360
	4.7714 4.7714 15.578 90 90 120 R-3c
	atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Mn1 0 0 0 .96 .0114 .0093 .0093 .0155 .0046 0 0
	Ca1 0 0 0 .04 .0114 .0093 .0093 .0155 .0046 0 0
	C1 0 0 .25 .0085
	O1 .2681 0 .25 .0116 .0081 .013 .015 .0066 .0006 .0012
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