# generated using pymatgen data_Nb4Tc(NiP)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.14488418 _cell_length_b 7.14488422 _cell_length_c 7.14488422 _cell_angle_alpha 93.56270970 _cell_angle_beta 93.56271286 _cell_angle_gamma 151.13008124 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb4Tc(NiP)4 _chemical_formula_sum 'Nb4 Tc1 Ni4 P4' _cell_volume 170.54618872 _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 Nb Nb0 1 0.80551434 0.12869347 0.93420781 1.0 Nb Nb1 1 0.12869347 0.19448566 0.32317913 1.0 Nb Nb2 1 0.87130653 0.80551434 0.67682087 1.0 Nb Nb3 1 0.19448566 0.87130653 0.06579219 1.0 Tc Tc4 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni5 1 0.91422660 0.39123195 0.30545855 1.0 Ni Ni6 1 0.08577340 0.60876805 0.69454145 1.0 Ni Ni7 1 0.60876805 0.91422660 0.52299365 1.0 Ni Ni8 1 0.39123195 0.08577340 0.47700635 1.0 P P9 1 0.55577115 0.24282848 0.79860064 1.0 P P10 1 0.24282848 0.44422885 0.68705633 1.0 P P11 1 0.75717152 0.55577115 0.31294367 1.0 P P12 1 0.44422885 0.75717152 0.20139936 1.0