# generated using pymatgen data_Na6Bi2As(CO4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.37262574 _cell_length_b 10.37262574 _cell_length_c 10.37262574 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na6Bi2As(CO4)4 _chemical_formula_sum 'Na12 Bi4 As2 C8 O32' _cell_volume 789.13467475 _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 Na Na0 1 0.30074200 0.30074200 0.69925800 1.0 Na Na1 1 0.94925800 0.55074200 0.55074200 1.0 Na Na2 1 0.69925800 0.30074200 0.69925800 1.0 Na Na3 1 0.30074200 0.69925800 0.30074200 1.0 Na Na4 1 0.55074200 0.94925800 0.94925800 1.0 Na Na5 1 0.55074200 0.55074200 0.94925800 1.0 Na Na6 1 0.69925800 0.30074200 0.30074200 1.0 Na Na7 1 0.69925800 0.69925800 0.30074200 1.0 Na Na8 1 0.55074200 0.94925800 0.55074200 1.0 Na Na9 1 0.94925800 0.55074200 0.94925800 1.0 Na Na10 1 0.30074200 0.69925800 0.69925800 1.0 Na Na11 1 0.94925800 0.94925800 0.55074200 1.0 Bi Bi12 1 0.62500000 0.12500000 0.12500000 1.0 Bi Bi13 1 0.12500000 0.12500000 0.12500000 1.0 Bi Bi14 1 0.12500000 0.12500000 0.62500000 1.0 Bi Bi15 1 0.12500000 0.62500000 0.12500000 1.0 As As16 1 0.50000000 0.50000000 0.50000000 1.0 As As17 1 0.75000000 0.75000000 0.75000000 1.0 C C18 1 0.30552600 0.89815800 0.89815800 1.0 C C19 1 0.89815800 0.30552600 0.89815800 1.0 C C20 1 0.89815800 0.89815800 0.89815800 1.0 C C21 1 0.89815800 0.89815800 0.30552600 1.0 C C22 1 0.35184200 0.35184200 0.94447400 1.0 C C23 1 0.35184200 0.35184200 0.35184200 1.0 C C24 1 0.35184200 0.94447400 0.35184200 1.0 C C25 1 0.94447400 0.35184200 0.35184200 1.0 O O26 1 0.22968600 0.48065300 0.34391700 1.0 O O27 1 0.94574400 0.34391700 0.48065300 1.0 O O28 1 0.30425600 0.02031400 0.90608300 1.0 O O29 1 0.02031400 0.30425600 0.76934700 1.0 O O30 1 0.30425600 0.76934700 0.02031400 1.0 O O31 1 0.56794600 0.56794600 0.29616100 1.0 O O32 1 0.90608300 0.02031400 0.76934700 1.0 O O33 1 0.56794600 0.29616100 0.56794600 1.0 O O34 1 0.56794600 0.56794600 0.56794600 1.0 O O35 1 0.90608300 0.30425600 0.02031400 1.0 O O36 1 0.76934700 0.30425600 0.90608300 1.0 O O37 1 0.29616100 0.56794600 0.56794600 1.0 O O38 1 0.02031400 0.90608300 0.30425600 1.0 O O39 1 0.76934700 0.90608300 0.02031400 1.0 O O40 1 0.90608300 0.76934700 0.30425600 1.0 O O41 1 0.48065300 0.22968600 0.94574400 1.0 O O42 1 0.76934700 0.02031400 0.30425600 1.0 O O43 1 0.34391700 0.48065300 0.94574400 1.0 O O44 1 0.48065300 0.34391700 0.22968600 1.0 O O45 1 0.22968600 0.34391700 0.94574400 1.0 O O46 1 0.95383900 0.68205400 0.68205400 1.0 O O47 1 0.48065300 0.94574400 0.34391700 1.0 O O48 1 0.34391700 0.94574400 0.22968600 1.0 O O49 1 0.68205400 0.95383900 0.68205400 1.0 O O50 1 0.68205400 0.68205400 0.68205400 1.0 O O51 1 0.34391700 0.22968600 0.48065300 1.0 O O52 1 0.68205400 0.68205400 0.95383900 1.0 O O53 1 0.94574400 0.48065300 0.22968600 1.0 O O54 1 0.22968600 0.94574400 0.48065300 1.0 O O55 1 0.94574400 0.22968600 0.34391700 1.0 O O56 1 0.30425600 0.90608300 0.76934700 1.0 O O57 1 0.02031400 0.76934700 0.90608300 1.0