# generated using pymatgen data_Ca3As2(W5O4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.27546952 _cell_length_b 10.96277720 _cell_length_c 14.08566225 _cell_angle_alpha 111.35863332 _cell_angle_beta 96.71634679 _cell_angle_gamma 98.40207088 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3As2(W5O4)2 _chemical_formula_sum 'Ca6 As4 W20 O16' _cell_volume 877.44268485 _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 Ca Ca0 1 0.45555100 0.54373800 0.32987800 1.0 Ca Ca1 1 0.54444900 0.45626200 0.67012200 1.0 Ca Ca2 1 0.22938300 0.85534500 0.33148600 1.0 Ca Ca3 1 0.77061700 0.14465500 0.66851400 1.0 Ca Ca4 1 0.80655300 0.04354800 0.31270000 1.0 Ca Ca5 1 0.19344700 0.95645200 0.68730000 1.0 As As6 1 0.72090600 0.13773500 0.13641700 1.0 As As7 1 0.27909400 0.86226500 0.86358300 1.0 As As8 1 0.26240800 0.13931700 0.54058000 1.0 As As9 1 0.73759200 0.86068300 0.45942000 1.0 W W10 1 0.26196500 0.59242400 0.54926000 1.0 W W11 1 0.73803500 0.40757600 0.45074000 1.0 W W12 1 0.06297900 0.68176200 0.02981500 1.0 W W13 1 0.93702100 0.31823800 0.97018500 1.0 W W14 1 0.98057000 0.58007400 0.37926200 1.0 W W15 1 0.01943000 0.41992600 0.62073800 1.0 W W16 1 0.26639100 0.52584500 0.11079500 1.0 W W17 1 0.73360900 0.47415500 0.88920500 1.0 W W18 1 0.09699900 0.08168000 0.92695600 1.0 W W19 1 0.90300100 0.91832000 0.07304400 1.0 W W20 1 0.39804800 0.91467200 0.06367200 1.0 W W21 1 0.60195200 0.08532800 0.93632800 1.0 W W22 1 0.56249200 0.66876900 0.03424200 1.0 W W23 1 0.43750800 0.33123100 0.96575800 1.0 W W24 1 0.39200400 0.25266700 0.12734300 1.0 W W25 1 0.60799600 0.74733300 0.87265700 1.0 W W26 1 0.78592800 0.51959500 0.12911900 1.0 W W27 1 0.21407200 0.48040500 0.87088100 1.0 W W28 1 0.20386700 0.33823800 0.40645600 1.0 W W29 1 0.79613300 0.66176200 0.59354400 1.0 O O30 1 0.10671000 0.57459100 0.24185100 1.0 O O31 1 0.89329000 0.42540900 0.75814900 1.0 O O32 1 0.08489300 0.21861300 0.61870800 1.0 O O33 1 0.91510700 0.78138700 0.38129200 1.0 O O34 1 0.72916600 0.01470600 0.45682900 1.0 O O35 1 0.27083400 0.98529400 0.54317100 1.0 O O36 1 0.51976600 0.23256400 0.60171900 1.0 O O37 1 0.48023400 0.76743600 0.39828100 1.0 O O38 1 0.19919900 0.11163100 0.40875400 1.0 O O39 1 0.80080100 0.88836900 0.59124600 1.0 O O40 1 0.86024800 0.25540000 0.36575300 1.0 O O41 1 0.13975200 0.74460000 0.63424700 1.0 O O42 1 0.31284700 0.32023500 0.26610500 1.0 O O43 1 0.68715300 0.67976500 0.73389500 1.0 O O44 1 0.18304100 0.05769900 0.07933000 1.0 O O45 1 0.81695900 0.94230100 0.92067000 1.0