# generated using pymatgen data_Tm3Hf(NiP)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.82795487 _cell_length_b 3.82795484 _cell_length_c 14.78654987 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000873 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Hf(NiP)4 _chemical_formula_sum 'Tm3 Hf1 Ni4 P4' _cell_volume 187.64243478 _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 Tm Tm0 1 0.00000000 0.00000000 0.49303836 1.0 Tm Tm1 1 0.00000000 0.00000000 0.00696164 1.0 Tm Tm2 1 0.00000000 0.00000000 0.75000000 1.0 Hf Hf3 1 0.00000000 0.00000000 0.25000000 1.0 Ni Ni4 1 0.33333300 0.66666700 0.34636204 1.0 Ni Ni5 1 0.66666700 0.33333300 0.62301621 1.0 Ni Ni6 1 0.66666700 0.33333300 0.87698379 1.0 Ni Ni7 1 0.33333300 0.66666700 0.15363796 1.0 P P8 1 0.33333300 0.66666700 0.88003268 1.0 P P9 1 0.66666700 0.33333300 0.12564030 1.0 P P10 1 0.66666700 0.33333300 0.37435970 1.0 P P11 1 0.33333300 0.66666700 0.61996732 1.0