data_global _chemical_name_mineral 'Stewartite' loop_ _publ_author_name 'Moore P B' 'Araki T' _journal_name_full 'American Mineralogist' _journal_volume 59 _journal_year 1974 _journal_page_first 1272 _journal_page_last 1276 _publ_section_title ; Stewartite, MnFe2(OH)2(H2O)6[PO4]2.2H2O: Its atomic arrangement ; _database_code_amcsd 0000432 _chemical_formula_sum 'Mn Fe2 P2 O18 H18' _cell_length_a 10.398 _cell_length_b 10.672 _cell_length_c 7.223 _cell_angle_alpha 90.10 _cell_angle_beta 109.10 _cell_angle_gamma 71.83 _cell_volume 715.122 _exptl_crystal_density_diffrn 2.483 _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 Mn 0.27273 0.48931 0.64620 0.01545 Fe1 0.00000 0.00000 0.00000 0.00925 Fe2 0.50000 0.00000 0.00000 0.00988 Fe3 0.24996 0.99745 0.50902 0.00785 P1 0.90510 0.18642 0.33970 0.00760 P2 0.45901 0.17736 0.59600 0.00760 O1 0.05880 0.12580 0.48880 0.01165 O2 0.88700 0.12100 0.14450 0.01216 O3 0.86980 0.33560 0.29410 0.01330 O4 0.80020 0.16170 0.43360 0.01153 O5 0.31180 0.15790 0.49470 0.01013 O6 0.43720 0.32600 0.60720 0.01444 O7 0.55450 0.12650 0.46950 0.01039 O8 0.53660 0.10080 0.80420 0.01317 O-H1 0.17980 0.99100 0.21560 0.01279 O-H2 0.31790 0.00060 0.80400 0.01254 Wat1 0.01760 0.16060 0.85870 0.01786 Wat2 0.38930 0.17500 0.08940 0.02102 Wat3 0.14270 0.36410 0.65920 0.02685 Wat4 0.15160 0.54280 0.32820 0.02292 Wat5 0.41150 0.60990 0.63460 0.02026 Wat6 0.37320 0.44080 0.96680 0.02812 Wat7 0.09690 0.32580 0.15340 0.02647 Wat8 0.29540 0.65540 0.15270 0.02495