# generated using pymatgen data_TbPa(WN3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43768146 _cell_length_b 5.64041743 _cell_length_c 7.83873799 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbPa(WN3)2 _chemical_formula_sum 'Tb2 Pa2 W4 N12' _cell_volume 240.42031229 _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 Tb Tb0 1 0.51103649 0.55560556 0.75000000 1.0 Tb Tb1 1 0.98896351 0.05560556 0.75000000 1.0 Pa Pa2 1 0.48946429 0.43302612 0.25000000 1.0 Pa Pa3 1 0.01053571 0.93302612 0.25000000 1.0 W W4 1 0.50494982 0.99962457 0.50678250 1.0 W W5 1 0.99505018 0.49962457 0.99321750 1.0 W W6 1 0.99505018 0.49962457 0.50678250 1.0 W W7 1 0.50494982 0.99962457 0.99321750 1.0 N N8 1 0.69782675 0.29715707 0.54458184 1.0 N N9 1 0.30410853 0.69809854 0.05850312 1.0 N N10 1 0.19589147 0.19809854 0.05850312 1.0 N N11 1 0.41651158 0.98173509 0.75000000 1.0 N N12 1 0.88812593 0.53987387 0.25000000 1.0 N N13 1 0.30410853 0.69809854 0.44149688 1.0 N N14 1 0.80217325 0.79715707 0.95541816 1.0 N N15 1 0.69782675 0.29715707 0.95541816 1.0 N N16 1 0.80217325 0.79715707 0.54458184 1.0 N N17 1 0.08348842 0.48173509 0.75000000 1.0 N N18 1 0.19589147 0.19809854 0.44149688 1.0 N N19 1 0.61187407 0.03987387 0.25000000 1.0