# generated using pymatgen data_ZrTi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.05734567 _cell_length_b 6.05734567 _cell_length_c 4.75397534 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999703 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrTi3 _chemical_formula_sum 'Zr2 Ti6' _cell_volume 151.06097551 _cell_formula_units_Z 2 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 0.33333300 0.66666700 0.75000000 1.0 Zr Zr1 1 0.66666700 0.33333300 0.25000000 1.0 Ti Ti2 1 0.16037327 0.32074554 0.25000000 1.0 Ti Ti3 1 0.67925446 0.83962673 0.25000000 1.0 Ti Ti4 1 0.16037327 0.83962673 0.25000000 1.0 Ti Ti5 1 0.83962673 0.67925446 0.75000000 1.0 Ti Ti6 1 0.32074554 0.16037327 0.75000000 1.0 Ti Ti7 1 0.83962673 0.16037327 0.75000000 1.0