data_global _chemical_name_mineral 'Metakirchheimerite' loop_ _publ_author_name 'Locock A J' 'Burns P C' 'Flynn M' _journal_name_full 'The Canadian Mineralogist' _journal_volume 42 _journal_year 2004 _journal_page_first 1699 _journal_page_last 1718 _publ_section_title ; Divalent transition metals and magnesium in structures that contain the autunite-type sheet Sample: CoUAs8 ; _database_code_amcsd 0005993 _chemical_formula_sum 'Co U2 As2 O20 H16' _cell_length_a 7.1955 _cell_length_b 9.7715 _cell_length_c 13.2319 _cell_angle_alpha 75.525 _cell_angle_beta 84.052 _cell_angle_gamma 81.661 _cell_volume 889.083 _exptl_crystal_density_diffrn 3.814 _symmetry_space_group_name_H-M 'P -1' loop_ _space_group_symop_operation_xyz 'x,y,z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Co 0.32780 0.36160 0.26160 0.01900 U1 0.23510 0.69330 0.40060 0.01100 U2 0.22660 0.20220 -0.09120 0.01200 As1 0.25220 0.87150 0.11990 0.01200 As2 0.24570 0.37860 -0.37230 0.01200 O1 0.26150 0.04600 0.06660 0.02000 O2 0.19540 0.83640 0.46250 0.02000 O3 0.18580 0.34200 -0.02510 0.02100 O4 0.08870 0.81110 0.06620 0.02000 O5 0.46000 0.77450 0.10120 0.02300 O6 0.45380 0.27960 -0.38580 0.02100 O7 0.08110 0.31610 -0.42410 0.02000 O8 0.26160 0.54950 -0.43610 0.02000 O9 0.19530 0.85560 0.24800 0.02100 O10 0.27410 0.54610 0.33780 0.02300 O11 0.26790 0.06320 -0.15850 0.02600 O12 0.18600 0.37280 -0.24510 0.02000 Wat1 0.41130 0.18130 0.19840 0.03000 Wat2 0.56480 0.28900 0.34080 0.03400 Wat3 0.17770 0.23760 0.38300 0.03700 Wat4 0.08920 0.42970 0.18240 0.04000 Wat5 0.48050 0.47780 0.14020 0.04200 Wat6 0.96420 0.09820 0.29500 0.03700 Wat7 0.77740 0.27780 0.11890 0.05000 Wat8 0.36090 0.00560 0.59070 0.05800