# generated using pymatgen data_Ti3Nb(PRh)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.68092613 _cell_length_b 6.27861280 _cell_length_c 7.18176881 _cell_angle_alpha 90.26591976 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Nb(PRh)4 _chemical_formula_sum 'Ti3 Nb1 P4 Rh4' _cell_volume 165.97686074 _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 Ti Ti0 1 0.25000000 0.02818915 0.82609497 1.0 Ti Ti1 1 0.25000000 0.52775251 0.67427337 1.0 Ti Ti2 1 0.75000000 0.97106346 0.17455961 1.0 Nb Nb3 1 0.75000000 0.47169806 0.32823226 1.0 P P4 1 0.25000000 0.76019646 0.37432059 1.0 P P5 1 0.25000000 0.25324825 0.12310458 1.0 P P6 1 0.75000000 0.24288715 0.62562464 1.0 P P7 1 0.75000000 0.74677589 0.87615976 1.0 Rh Rh8 1 0.25000000 0.14004025 0.43633057 1.0 Rh Rh9 1 0.25000000 0.64901815 0.06000418 1.0 Rh Rh10 1 0.75000000 0.85383989 0.56675751 1.0 Rh Rh11 1 0.75000000 0.35528980 0.93453696 1.0