Rhodocrosite
	Merlini M, Hanfland M, Gemmi M
	American Mineralogist 100 (2015) 2625-2629
	The MnCO3-II high-pressure polymorph of rhodocrosite
	Note: Sample run1-p13
	Note: P = 41.55 GPa
	Locality: Sardegna, Italy
	_database_code_amcsd 0020355
	2.940 4.856 5.584 101.99 95.58 89.65 P-1
	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 .195 .306 .7257 .96 .037 .046 .040 .020 .025 -.001 -.004
	Ca1 .195 .306 .7257 .04 .037 .046 .040 .020 .025 -.001 -.004
	C1 .635 .846 .735 .022
	O1 .70 .048 .846 .030
	O2 .729 .617 .863 .006
	O3 -.337 .242 .431 .018
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