# generated using pymatgen data_Ba6HPb2N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.92901297 _cell_length_b 7.92901293 _cell_length_c 7.92901270 _cell_angle_alpha 59.99999680 _cell_angle_beta 59.99999699 _cell_angle_gamma 59.99999781 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba6HPb2N _chemical_formula_sum 'Ba6 H1 Pb2 N1' _cell_volume 352.48638130 _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 Ba Ba0 1 0.25850626 0.74149374 0.74149374 1.0 Ba Ba1 1 0.25850626 0.74149374 0.25850626 1.0 Ba Ba2 1 0.74149374 0.25850626 0.74149374 1.0 Ba Ba3 1 0.74149374 0.74149374 0.25850626 1.0 Ba Ba4 1 0.25850626 0.25850626 0.74149374 1.0 Ba Ba5 1 0.74149374 0.25850626 0.25850626 1.0 H H6 1 0.00000000 0.00000000 0.00000000 1.0 Pb Pb7 1 0.25000000 0.25000000 0.25000000 1.0 Pb Pb8 1 0.75000000 0.75000000 0.75000000 1.0 N N9 1 0.50000000 0.50000000 0.50000000 1.0