# generated using pymatgen data_Zr4TaTi3As4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64759128 _cell_length_b 6.92399523 _cell_length_c 8.46913513 _cell_angle_alpha 90.00095232 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4TaTi3As4 _chemical_formula_sum 'Zr4 Ta1 Ti3 As4' _cell_volume 213.89566883 _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 0.25000000 0.54376981 0.83193026 1.0 Zr Zr1 1 0.75000000 0.95707889 0.33176866 1.0 Zr Zr2 1 0.25000000 0.04570080 0.66926735 1.0 Zr Zr3 1 0.75000000 0.45880197 0.16617171 1.0 Ta Ta4 1 0.75000000 0.36439031 0.55930579 1.0 Ti Ti5 1 0.25000000 0.13143415 0.05991347 1.0 Ti Ti6 1 0.75000000 0.86635714 0.94061760 1.0 Ti Ti7 1 0.25000000 0.63138836 0.44096229 1.0 As As8 1 0.75000000 0.74455729 0.64007295 1.0 As As9 1 0.25000000 0.75749132 0.13927877 1.0 As As10 1 0.75000000 0.24247447 0.86573726 1.0 As As11 1 0.25000000 0.25655749 0.35497389 1.0