# generated using pymatgen data_Fe2(AsO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.69721240 _cell_length_b 12.32730100 _cell_length_c 8.99918200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.72719070 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe2(AsO4)3 _chemical_formula_sum 'Fe8 As12 O48' _cell_volume 964.75298777 _cell_formula_units_Z 4 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 Fe Fe0 1 0.25008700 0.88490300 0.02498400 1.0 Fe Fe1 1 0.24991300 0.61509700 0.52498400 1.0 Fe Fe2 1 0.25391300 0.38290000 0.97159200 1.0 Fe Fe3 1 0.24608700 0.11710000 0.47159200 1.0 Fe Fe4 1 0.75391300 0.88290000 0.52840800 1.0 Fe Fe5 1 0.74608700 0.61710000 0.02840800 1.0 Fe Fe6 1 0.75008700 0.38490300 0.47501600 1.0 Fe Fe7 1 0.74991300 0.11509700 0.97501600 1.0 As As8 1 0.03696400 0.49126100 0.25060300 1.0 As As9 1 0.11163600 0.84813600 0.37842100 1.0 As As10 1 0.11331200 0.13985100 0.11253800 1.0 As As11 1 0.38836400 0.65186400 0.87842100 1.0 As As12 1 0.38668800 0.36014900 0.61253800 1.0 As As13 1 0.46303600 0.00873900 0.75060300 1.0 As As14 1 0.53696400 0.99126100 0.24939700 1.0 As As15 1 0.61331200 0.63985100 0.38746200 1.0 As As16 1 0.61163600 0.34813600 0.12157900 1.0 As As17 1 0.88668800 0.86014900 0.88746200 1.0 As As18 1 0.88836400 0.15186400 0.62157900 1.0 As As19 1 0.96303600 0.50873900 0.74939700 1.0 O O20 1 0.05983300 0.43937600 0.88489300 1.0 O O21 1 0.07308700 0.90678100 0.88410600 1.0 O O22 1 0.07270600 0.61171600 0.67168600 1.0 O O23 1 0.07192800 0.18963200 0.57415100 1.0 O O24 1 0.09685300 0.59456900 0.36579200 1.0 O O25 1 0.11571100 0.83772000 0.18724900 1.0 O O26 1 0.13814700 0.98237800 0.42290600 1.0 O O27 1 0.12701000 0.24743400 0.99204600 1.0 O O28 1 0.16732400 0.18623900 0.28526700 1.0 O O29 1 0.19429400 0.42990400 0.17552800 1.0 O O30 1 0.24248800 0.77283200 0.47478800 1.0 O O31 1 0.25751200 0.72716800 0.97478800 1.0 O O32 1 0.24484400 0.04424800 0.05666900 1.0 O O33 1 0.25515600 0.45575200 0.55666900 1.0 O O34 1 0.30570600 0.07009600 0.67552800 1.0 O O35 1 0.33267600 0.31376100 0.78526700 1.0 O O36 1 0.36185300 0.51762200 0.92290600 1.0 O O37 1 0.37299000 0.25256600 0.49204600 1.0 O O38 1 0.38428900 0.66228000 0.68724900 1.0 O O39 1 0.40314700 0.90543100 0.86579200 1.0 O O40 1 0.42729400 0.88828400 0.17168600 1.0 O O41 1 0.42691300 0.59321900 0.38410600 1.0 O O42 1 0.42807200 0.31036800 0.07415100 1.0 O O43 1 0.44016700 0.06062400 0.38489300 1.0 O O44 1 0.55983300 0.93937600 0.61510700 1.0 O O45 1 0.57192800 0.68963200 0.92584900 1.0 O O46 1 0.57308700 0.40678100 0.61589400 1.0 O O47 1 0.57270600 0.11171600 0.82831400 1.0 O O48 1 0.59685300 0.09456900 0.13420800 1.0 O O49 1 0.61571100 0.33772000 0.31275100 1.0 O O50 1 0.62701000 0.74743400 0.50795400 1.0 O O51 1 0.63814700 0.48237800 0.07709400 1.0 O O52 1 0.66732400 0.68623900 0.21473300 1.0 O O53 1 0.69429400 0.92990400 0.32447200 1.0 O O54 1 0.74484400 0.54424800 0.44333100 1.0 O O55 1 0.75515600 0.95575200 0.94333100 1.0 O O56 1 0.74248800 0.27283200 0.02521200 1.0 O O57 1 0.75751200 0.22716800 0.52521200 1.0 O O58 1 0.80570600 0.57009600 0.82447200 1.0 O O59 1 0.83267600 0.81376100 0.71473300 1.0 O O60 1 0.87299000 0.75256600 0.00795400 1.0 O O61 1 0.86185300 0.01762200 0.57709400 1.0 O O62 1 0.88428900 0.16228000 0.81275100 1.0 O O63 1 0.90314700 0.40543100 0.63420800 1.0 O O64 1 0.92807200 0.81036800 0.42584900 1.0 O O65 1 0.92729400 0.38828400 0.32831400 1.0 O O66 1 0.92691300 0.09321900 0.11589400 1.0 O O67 1 0.94016700 0.56062400 0.11510700 1.0