# generated using pymatgen data_Zr10HgBi5B2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.65715619 _cell_length_b 8.65470636 _cell_length_c 5.87126369 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99064378 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr10HgBi5B2 _chemical_formula_sum 'Zr10 Hg1 Bi5 B2' _cell_volume 381.00506163 _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 Zr Zr0 1 0.66810629 0.33428884 0.00153965 1.0 Zr Zr1 1 0.33189371 0.66618455 0.00153965 1.0 Zr Zr2 1 0.33189371 0.66618455 0.49846035 1.0 Zr Zr3 1 0.66810629 0.33428884 0.49846035 1.0 Zr Zr4 1 0.77356219 0.77226168 0.75000000 1.0 Zr Zr5 1 0.22643781 0.99869949 0.75000000 1.0 Zr Zr6 1 1.00000000 0.22368782 0.75000000 1.0 Zr Zr7 1 0.22188920 0.22862603 0.25000000 1.0 Zr Zr8 1 0.77811080 0.00673683 0.25000000 1.0 Zr Zr9 1 1.00000000 0.77026080 0.25000000 1.0 Hg Hg10 1 1.00000000 0.39865854 0.25000000 1.0 Bi Bi11 1 0.39797548 0.39851182 0.75000000 1.0 Bi Bi12 1 0.60202452 0.00053534 0.75000000 1.0 Bi Bi13 1 1.00000000 0.59548919 0.75000000 1.0 Bi Bi14 1 0.60208354 0.60409255 0.25000000 1.0 Bi Bi15 1 0.39791646 0.00200901 0.25000000 1.0 B B16 1 0.00000000 0.99974257 0.00065813 1.0 B B17 1 0.00000000 0.99974257 0.49934187 1.0