# generated using pymatgen data_Zr6InSiBi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.72376086 _cell_length_b 7.72376066 _cell_length_c 3.88793338 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000088 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6InSiBi _chemical_formula_sum 'Zr6 In1 Si1 Bi1' _cell_volume 200.86629486 _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 0.38679973 0.38609777 0.50000000 1.0 Zr Zr1 1 0.61390223 0.00070196 0.50000000 1.0 Zr Zr2 1 0.99929804 0.61320027 0.50000000 1.0 Zr Zr3 1 0.76117839 0.75630971 0.00000000 1.0 Zr Zr4 1 0.24369029 0.00486868 0.00000000 1.0 Zr Zr5 1 0.99513132 0.23882161 0.00000000 1.0 In In6 1 0.66666700 0.33333300 0.00000000 1.0 Si Si7 1 0.00000000 0.00000000 0.50000000 1.0 Bi Bi8 1 0.33333300 0.66666700 0.00000000 1.0