Rhodocrosite
	Merlini M, Hanfland M, Gemmi M
	American Mineralogist 100 (2015) 2625-2629
	The MnCO3-II high-pressure polymorph of rhodocrosite
	Note: Sample run1-p8
	Note: P = 36.20 GPa
	Locality: Sardegna, Italy
	_database_code_amcsd 0020349
	4.6100 4.6100 13.582 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 .0198 .0186 .0186 .0222 .0093 0 0
	Ca1 0 0 0 .04 .0198 .0186 .0186 .0222 .0093 0 0
	C1 0 0 .25 .017
	O .2715 0 .25 .029 .019 .027 .044 .013 -.0027 -.005
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