# generated using pymatgen data_Cu10Bi25O48 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.51255100 _cell_length_b 8.51255100 _cell_length_c 18.13487300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu10Bi25O48 _chemical_formula_sum 'Cu10 Bi25 O48' _cell_volume 1314.11681444 _cell_formula_units_Z 1 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 Cu Cu0 1 0.00000000 0.00000000 0.17426800 1.0 Cu Cu1 1 0.00000000 0.00000000 0.52494700 1.0 Cu Cu2 1 0.00000000 0.00000000 0.69210400 1.0 Cu Cu3 1 0.00000000 0.00000000 0.86115300 1.0 Cu Cu4 1 0.50000000 0.50000000 0.14118800 1.0 Cu Cu5 1 0.50000000 0.50000000 0.30799100 1.0 Cu Cu6 1 0.50000000 0.50000000 0.47684200 1.0 Cu Cu7 1 0.50000000 0.50000000 0.64102400 1.0 Cu Cu8 1 0.50000000 0.50000000 0.80506100 1.0 Cu Cu9 1 0.50000000 0.50000000 0.97110300 1.0 Bi Bi10 1 0.83466200 0.31715200 0.07842100 1.0 Bi Bi11 1 0.81904500 0.65745200 0.24410800 1.0 Bi Bi12 1 0.82513000 0.33045000 0.41946000 1.0 Bi Bi13 1 0.82749600 0.32991400 0.75208700 1.0 Bi Bi14 1 0.82860300 0.67154300 0.58561100 1.0 Bi Bi15 1 0.83343800 0.66768100 0.91912500 1.0 Bi Bi16 1 0.00000000 0.00000000 0.32240500 1.0 Bi Bi17 1 0.16533800 0.68284800 0.07842100 1.0 Bi Bi18 1 0.18095500 0.34254800 0.24410800 1.0 Bi Bi19 1 0.17139700 0.32845700 0.58561100 1.0 Bi Bi20 1 0.17487000 0.66955000 0.41946000 1.0 Bi Bi21 1 0.16656200 0.33231900 0.91912500 1.0 Bi Bi22 1 0.17250400 0.67008600 0.75208700 1.0 Bi Bi23 1 0.34254800 0.81904500 0.24410800 1.0 Bi Bi24 1 0.31715200 0.16533800 0.07842100 1.0 Bi Bi25 1 0.33045000 0.17487000 0.41946000 1.0 Bi Bi26 1 0.33231900 0.83343800 0.91912500 1.0 Bi Bi27 1 0.32845700 0.82860300 0.58561100 1.0 Bi Bi28 1 0.32991400 0.17250400 0.75208700 1.0 Bi Bi29 1 0.65745200 0.18095500 0.24410800 1.0 Bi Bi30 1 0.67154300 0.17139700 0.58561100 1.0 Bi Bi31 1 0.66768100 0.16656200 0.91912500 1.0 Bi Bi32 1 0.68284800 0.83466200 0.07842100 1.0 Bi Bi33 1 0.66955000 0.82513000 0.41946000 1.0 Bi Bi34 1 0.67008600 0.82749600 0.75208700 1.0 O O35 1 0.79614700 0.89467700 0.19207500 1.0 O O36 1 0.76340700 0.10174900 0.03003900 1.0 O O37 1 0.79347900 0.89803000 0.52925200 1.0 O O38 1 0.77890400 0.10344800 0.36764300 1.0 O O39 1 0.79519900 0.10266400 0.69621300 1.0 O O40 1 0.79555300 0.89734700 0.86421900 1.0 O O41 1 0.89825100 0.76340700 0.03003900 1.0 O O42 1 0.89467700 0.20385300 0.19207500 1.0 O O43 1 0.89655200 0.77890400 0.36764300 1.0 O O44 1 0.89733600 0.79519900 0.69621300 1.0 O O45 1 0.89734700 0.20444700 0.86421900 1.0 O O46 1 0.89803000 0.20652100 0.52925200 1.0 O O47 1 0.10532300 0.79614700 0.19207500 1.0 O O48 1 0.10197000 0.79347900 0.52925200 1.0 O O49 1 0.10265300 0.79555300 0.86421900 1.0 O O50 1 0.10174900 0.23659300 0.03003900 1.0 O O51 1 0.10344800 0.22109600 0.36764300 1.0 O O52 1 0.10266400 0.20480100 0.69621300 1.0 O O53 1 0.23659300 0.89825100 0.03003900 1.0 O O54 1 0.20385300 0.10532300 0.19207500 1.0 O O55 1 0.22109600 0.89655200 0.36764300 1.0 O O56 1 0.20652100 0.10197000 0.52925200 1.0 O O57 1 0.20480100 0.89733600 0.69621300 1.0 O O58 1 0.20444700 0.10265300 0.86421900 1.0 O O59 1 0.29883000 0.40119200 0.13834900 1.0 O O60 1 0.29415600 0.40220900 0.47204100 1.0 O O61 1 0.29622500 0.40259800 0.80113200 1.0 O O62 1 0.29340000 0.59813600 0.30119700 1.0 O O63 1 0.29322400 0.59950800 0.63711900 1.0 O O64 1 0.29724700 0.59754700 0.96707100 1.0 O O65 1 0.40186400 0.29340000 0.30119700 1.0 O O66 1 0.40049200 0.29322400 0.63711900 1.0 O O67 1 0.40245300 0.29724700 0.96707100 1.0 O O68 1 0.40119200 0.70117000 0.13834900 1.0 O O69 1 0.40220900 0.70584400 0.47204100 1.0 O O70 1 0.40259800 0.70377500 0.80113200 1.0 O O71 1 0.59880800 0.29883000 0.13834900 1.0 O O72 1 0.59779100 0.29415600 0.47204100 1.0 O O73 1 0.59740200 0.29622500 0.80113200 1.0 O O74 1 0.59813600 0.70660000 0.30119700 1.0 O O75 1 0.59950800 0.70677600 0.63711900 1.0 O O76 1 0.59754700 0.70275300 0.96707100 1.0 O O77 1 0.70660000 0.40186400 0.30119700 1.0 O O78 1 0.70677600 0.40049200 0.63711900 1.0 O O79 1 0.70117000 0.59880800 0.13834900 1.0 O O80 1 0.70584400 0.59779100 0.47204100 1.0 O O81 1 0.70377500 0.59740200 0.80113200 1.0 O O82 1 0.70275300 0.40245300 0.96707100 1.0