# generated using pymatgen data_Sr8Nd2Fe5(MoO6)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.66071900 _cell_length_b 5.69713200 _cell_length_c 40.35394163 _cell_angle_alpha 82.02419611 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr8Nd2Fe5(MoO6)5 _chemical_formula_sum 'Sr16 Nd4 Fe10 Mo10 O60' _cell_volume 1288.82025229 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Sr Sr0 1 0.48241400 0.76033300 0.74895500 1.0 Sr Sr1 1 0.48751900 0.56125900 0.95099700 1.0 Sr Sr2 1 0.48464200 0.35183900 0.14929600 1.0 Sr Sr3 1 0.49250500 0.95251700 0.54887800 1.0 Sr Sr4 1 0.00749500 0.95251700 0.04887800 1.0 Sr Sr5 1 0.01758600 0.76033300 0.24895500 1.0 Sr Sr6 1 0.01248100 0.56125900 0.45099700 1.0 Sr Sr7 1 0.01535800 0.35183900 0.64929600 1.0 Sr Sr8 1 0.99250500 0.04748300 0.95112200 1.0 Sr Sr9 1 0.98241400 0.23966700 0.75104500 1.0 Sr Sr10 1 0.98464200 0.64816100 0.35070400 1.0 Sr Sr11 1 0.98751900 0.43874100 0.54900300 1.0 Sr Sr12 1 0.51535800 0.64816100 0.85070400 1.0 Sr Sr13 1 0.50749500 0.04748300 0.45112200 1.0 Sr Sr14 1 0.51758600 0.23966700 0.25104500 1.0 Sr Sr15 1 0.51248100 0.43874100 0.04900300 1.0 Nd Nd16 1 0.47900400 0.16057200 0.35136300 1.0 Nd Nd17 1 0.02099600 0.16057200 0.85136300 1.0 Nd Nd18 1 0.97900400 0.83942800 0.14863700 1.0 Nd Nd19 1 0.52099600 0.83942800 0.64863700 1.0 Fe Fe20 1 0.50065700 0.39525700 0.59963400 1.0 Fe Fe21 1 0.99996600 0.79944700 0.70008900 1.0 Fe Fe22 1 0.00065700 0.60474300 0.90036600 1.0 Fe Fe23 1 0.00003400 0.20055300 0.29991100 1.0 Fe Fe24 1 0.99934300 0.39525700 0.09963400 1.0 Fe Fe25 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe26 1 0.49996600 0.20055300 0.79991100 1.0 Fe Fe27 1 0.49934300 0.60474300 0.40036600 1.0 Fe Fe28 1 0.50003400 0.79944700 0.20008900 1.0 Fe Fe29 1 0.50000000 0.00000000 0.00000000 1.0 Mo Mo30 1 0.49843000 0.29953100 0.69955500 1.0 Mo Mo31 1 0.50199100 0.10180500 0.89997300 1.0 Mo Mo32 1 0.49800900 0.89819500 0.10002700 1.0 Mo Mo33 1 0.50157000 0.70046900 0.30044500 1.0 Mo Mo34 1 0.50000000 0.50000000 0.50000000 1.0 Mo Mo35 1 0.99843000 0.70046900 0.80044500 1.0 Mo Mo36 1 0.00000000 0.50000000 0.00000000 1.0 Mo Mo37 1 0.00157000 0.29953100 0.19955500 1.0 Mo Mo38 1 0.00199100 0.89819500 0.60002700 1.0 Mo Mo39 1 0.99800900 0.10180500 0.39997300 1.0 O O40 1 0.50556900 0.31847400 0.74990700 1.0 O O41 1 0.50197600 0.12410800 0.94628000 1.0 O O42 1 0.51068800 0.90932800 0.14872600 1.0 O O43 1 0.50708600 0.74171700 0.34995200 1.0 O O44 1 0.50654400 0.50987100 0.55070600 1.0 O O45 1 0.23437500 0.86405400 0.90546700 1.0 O O46 1 0.24717900 0.45289000 0.30954300 1.0 O O47 1 0.22715600 0.65874600 0.10936000 1.0 O O48 1 0.23255000 0.06924600 0.70631500 1.0 O O49 1 0.25029000 0.26863100 0.50599600 1.0 O O50 1 0.23507300 0.97824200 0.79418300 1.0 O O51 1 0.24616500 0.36833900 0.39037000 1.0 O O52 1 0.23905200 0.76802100 0.99387300 1.0 O O53 1 0.22800300 0.59365500 0.19013700 1.0 O O54 1 0.23647300 0.16630500 0.59369400 1.0 O O55 1 0.27199700 0.59365500 0.69013700 1.0 O O56 1 0.25383500 0.36833900 0.89037000 1.0 O O57 1 0.26352700 0.16630500 0.09369400 1.0 O O58 1 0.26492700 0.97824200 0.29418300 1.0 O O59 1 0.26094800 0.76802100 0.49387300 1.0 O O60 1 0.24971000 0.26863100 0.00599600 1.0 O O61 1 0.25282100 0.45289000 0.80954300 1.0 O O62 1 0.26562500 0.86405400 0.40546700 1.0 O O63 1 0.26745000 0.06924600 0.20631500 1.0 O O64 1 0.27284400 0.65874600 0.60936000 1.0 O O65 1 0.98931200 0.90932800 0.64872600 1.0 O O66 1 0.99443100 0.31847400 0.24990700 1.0 O O67 1 0.99291400 0.74171700 0.84995200 1.0 O O68 1 0.99345600 0.50987100 0.05070600 1.0 O O69 1 0.99802400 0.12410800 0.44628000 1.0 O O70 1 0.00708600 0.25828300 0.15004800 1.0 O O71 1 0.00654400 0.49012900 0.94929400 1.0 O O72 1 0.01068800 0.09067200 0.35127400 1.0 O O73 1 0.00197600 0.87589200 0.55372000 1.0 O O74 1 0.00556900 0.68152600 0.75009300 1.0 O O75 1 0.73255000 0.93075400 0.79368500 1.0 O O76 1 0.72715600 0.34125400 0.39064000 1.0 O O77 1 0.74717900 0.54711000 0.19045700 1.0 O O78 1 0.75029000 0.73136900 0.99400400 1.0 O O79 1 0.73437500 0.13594600 0.59453300 1.0 O O80 1 0.73647300 0.83369500 0.90630600 1.0 O O81 1 0.72800300 0.40634500 0.30986300 1.0 O O82 1 0.74616500 0.63166100 0.10963000 1.0 O O83 1 0.73507300 0.02175800 0.70581700 1.0 O O84 1 0.73905200 0.23197900 0.50612700 1.0 O O85 1 0.77199700 0.40634500 0.80986300 1.0 O O86 1 0.76352700 0.83369500 0.40630600 1.0 O O87 1 0.76492700 0.02175800 0.20581700 1.0 O O88 1 0.76094800 0.23197900 0.00612700 1.0 O O89 1 0.75383500 0.63166100 0.60963000 1.0 O O90 1 0.77284400 0.34125400 0.89064000 1.0 O O91 1 0.75282100 0.54711000 0.69045700 1.0 O O92 1 0.76745000 0.93075400 0.29368500 1.0 O O93 1 0.76562500 0.13594600 0.09453300 1.0 O O94 1 0.74971000 0.73136900 0.49400400 1.0 O O95 1 0.49802400 0.87589200 0.05372000 1.0 O O96 1 0.48931200 0.09067200 0.85127400 1.0 O O97 1 0.49345600 0.49012900 0.44929400 1.0 O O98 1 0.49443100 0.68152600 0.25009300 1.0 O O99 1 0.49291400 0.25828300 0.65004800 1.0