# generated using pymatgen data_Zr6InBiAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.71400937 _cell_length_b 7.71400923 _cell_length_c 3.89242700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000061 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6InBiAs _chemical_formula_sum 'Zr6 In1 Bi1 As1' _cell_volume 200.59098986 _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 0.38878731 0.38840532 0.50000000 1.0 Zr Zr1 1 0.61159468 0.00038199 0.50000000 1.0 Zr Zr2 1 0.99961801 0.61121269 0.50000000 1.0 Zr Zr3 1 0.75677389 0.75184524 0.00000000 1.0 Zr Zr4 1 0.24815476 0.00492865 0.00000000 1.0 Zr Zr5 1 0.99507135 0.24322611 0.00000000 1.0 In In6 1 0.66666700 0.33333300 0.00000000 1.0 Bi Bi7 1 0.33333300 0.66666700 0.00000000 1.0 As As8 1 0.00000000 0.00000000 0.50000000 1.0