# generated using pymatgen data_Ba3BiAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.55372712 _cell_length_b 6.55372712 _cell_length_c 6.55372712 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3BiAs _chemical_formula_sum 'Ba3 Bi1 As1' _cell_volume 281.49135632 _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 Ba Ba0 1 -0.00000000 0.50000000 0.50000000 1.0 Ba Ba1 1 0.50000000 0.00000000 0.50000000 1.0 Ba Ba2 1 0.50000000 0.50000000 0.00000000 1.0 Bi Bi3 1 0.50000000 0.50000000 0.50000000 1.0 As As4 1 -0.00000000 0.00000000 0.00000000 1.0