# generated using pymatgen data_Pa4TaNb3N8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.29951327 _cell_length_b 5.73704021 _cell_length_c 11.01732005 _cell_angle_alpha 90.02443221 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pa4TaNb3N8 _chemical_formula_sum 'Pa4 Ta1 Nb3 N8' _cell_volume 208.55168334 _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 Pa Pa0 1 0.25000000 0.57409199 0.85391742 1.0 Pa Pa1 1 0.75000000 0.42324844 0.14658720 1.0 Pa Pa2 1 0.75000000 0.92547996 0.35369305 1.0 Pa Pa3 1 0.25000000 0.07549452 0.64702346 1.0 Ta Ta4 1 0.25000000 0.92758116 0.09642572 1.0 Nb Nb5 1 0.75000000 0.07151060 0.90402655 1.0 Nb Nb6 1 0.75000000 0.57228670 0.59541015 1.0 Nb Nb7 1 0.25000000 0.42917572 0.40306733 1.0 N N8 1 0.25000000 0.66489405 0.24199904 1.0 N N9 1 0.75000000 0.33904628 0.75538399 1.0 N N10 1 0.75000000 0.83766623 0.74463787 1.0 N N11 1 0.25000000 0.15973567 0.25357314 1.0 N N12 1 0.25000000 0.77166723 0.50199779 1.0 N N13 1 0.75000000 0.22931614 0.49720146 1.0 N N14 1 0.75000000 0.73113230 0.00577374 1.0 N N15 1 0.25000000 0.26767200 0.99928011 1.0