# generated using pymatgen data_Bi(PO3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.02289400 _cell_length_b 7.59266500 _cell_length_c 16.71643795 _cell_angle_alpha 68.38615049 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Bi(PO3)4 _chemical_formula_sum 'Bi4 P16 O48' _cell_volume 1064.68421409 _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 Bi Bi0 1 0.15862400 0.68894100 0.85457400 1.0 Bi Bi1 1 0.34137600 0.68894100 0.35457400 1.0 Bi Bi2 1 0.84137600 0.31105900 0.14542600 1.0 Bi Bi3 1 0.65862400 0.31105900 0.64542600 1.0 P P4 1 0.05415100 0.65880700 0.21831700 1.0 P P5 1 0.73884200 0.63556400 0.42538900 1.0 P P6 1 0.23884200 0.36443600 0.07461100 1.0 P P7 1 0.76795800 0.23315100 0.94140500 1.0 P P8 1 0.97561500 0.89912000 0.31466200 1.0 P P9 1 0.44584900 0.65880700 0.71831700 1.0 P P10 1 0.94584900 0.34119300 0.78168300 1.0 P P11 1 0.23204200 0.76684900 0.05859500 1.0 P P12 1 0.26115800 0.36443600 0.57461100 1.0 P P13 1 0.02438500 0.10088000 0.68533800 1.0 P P14 1 0.76115800 0.63556400 0.92538900 1.0 P P15 1 0.47561500 0.10088000 0.18533800 1.0 P P16 1 0.55415100 0.34119300 0.28168300 1.0 P P17 1 0.52438500 0.89912000 0.81466200 1.0 P P18 1 0.26795800 0.76684900 0.55859500 1.0 P P19 1 0.73204200 0.23315100 0.44140500 1.0 O O20 1 0.11118000 0.26400100 0.13013600 1.0 O O21 1 0.04543000 0.18751500 0.76057100 1.0 O O22 1 0.95699500 0.53444900 0.19053000 1.0 O O23 1 0.85607500 0.20158200 0.86513800 1.0 O O24 1 0.04300500 0.46555100 0.80947000 1.0 O O25 1 0.72502400 0.57755700 0.52130900 1.0 O O26 1 0.39053300 0.24843000 0.10313500 1.0 O O27 1 0.33867300 0.56710400 0.79094600 1.0 O O28 1 0.10541400 0.91467400 0.71661100 1.0 O O29 1 0.64392500 0.20158200 0.36513800 1.0 O O30 1 0.54300500 0.53444900 0.69053000 1.0 O O31 1 0.27497600 0.42244300 0.47869100 1.0 O O32 1 0.14392500 0.79841800 0.13486200 1.0 O O33 1 0.45699500 0.46555100 0.30947000 1.0 O O34 1 0.45457000 0.18751500 0.26057100 1.0 O O35 1 0.38882000 0.26400100 0.63013600 1.0 O O36 1 0.10946700 0.24843000 0.60313500 1.0 O O37 1 0.61118000 0.73599900 0.36986400 1.0 O O38 1 0.60541400 0.08532600 0.78338900 1.0 O O39 1 0.36467700 0.89597200 0.83975600 1.0 O O40 1 0.63635600 0.10051400 0.96341800 1.0 O O41 1 0.35607500 0.79841800 0.63486200 1.0 O O42 1 0.95457000 0.81248500 0.23942900 1.0 O O43 1 0.86515300 0.19455300 0.01974300 1.0 O O44 1 0.63532300 0.10402800 0.16024400 1.0 O O45 1 0.77497600 0.57755700 0.02130900 1.0 O O46 1 0.36364400 0.89948600 0.03658200 1.0 O O47 1 0.28324600 0.54940700 0.09845000 1.0 O O48 1 0.54543000 0.81248500 0.73942900 1.0 O O49 1 0.60946700 0.75157000 0.89686500 1.0 O O50 1 0.71675400 0.45059300 0.90155000 1.0 O O51 1 0.89458600 0.08532600 0.28338900 1.0 O O52 1 0.39458600 0.91467400 0.21661100 1.0 O O53 1 0.13635600 0.89948600 0.53658200 1.0 O O54 1 0.83867300 0.43289600 0.70905400 1.0 O O55 1 0.21675400 0.54940700 0.59845000 1.0 O O56 1 0.78324600 0.45059300 0.40155000 1.0 O O57 1 0.86364400 0.10051400 0.46341800 1.0 O O58 1 0.88882000 0.73599900 0.86986400 1.0 O O59 1 0.13484700 0.80544700 0.98025700 1.0 O O60 1 0.63484700 0.19455300 0.51974300 1.0 O O61 1 0.22502400 0.42244300 0.97869100 1.0 O O62 1 0.16132700 0.56710400 0.29094600 1.0 O O63 1 0.13532300 0.89597200 0.33975600 1.0 O O64 1 0.89053300 0.75157000 0.39686500 1.0 O O65 1 0.36515300 0.80544700 0.48025700 1.0 O O66 1 0.86467700 0.10402800 0.66024400 1.0 O O67 1 0.66132700 0.43289600 0.20905400 1.0