# generated using pymatgen data_RbBa3(BeP)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.14643259 _cell_length_b 8.32151269 _cell_length_c 7.39731693 _cell_angle_alpha 63.58794261 _cell_angle_beta 75.06354463 _cell_angle_gamma 96.79627814 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbBa3(BeP)8 _chemical_formula_sum 'Rb1 Ba3 Be8 P8' _cell_volume 366.62332364 _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 Rb Rb0 1 0.00000000 0.00000000 0.00000000 1.0 Ba Ba1 1 0.99911467 0.48413193 0.75830540 1.0 Ba Ba2 1 0.00000000 0.00000000 0.50000000 1.0 Ba Ba3 1 0.00088533 0.51586807 0.24169460 1.0 Be Be4 1 0.50301181 0.62515718 0.31015010 1.0 Be Be5 1 0.49769295 0.62071688 0.81489165 1.0 Be Be6 1 0.49811803 0.12511284 0.06502830 1.0 Be Be7 1 0.49127951 0.12534179 0.56409556 1.0 Be Be8 1 0.49698819 0.37484282 0.68984990 1.0 Be Be9 1 0.50230705 0.37928312 0.18510835 1.0 Be Be10 1 0.50872049 0.87465821 0.43590444 1.0 Be Be11 1 0.50188197 0.87488716 0.93497170 1.0 P P12 1 0.30938663 0.33191696 0.50366724 1.0 P P13 1 0.30929492 0.32746695 0.01228775 1.0 P P14 1 0.31692977 0.82704038 0.25997299 1.0 P P15 1 0.31222439 0.82533936 0.75525530 1.0 P P16 1 0.69061337 0.66808304 0.49633276 1.0 P P17 1 0.69070508 0.67253305 0.98771225 1.0 P P18 1 0.68777561 0.17466064 0.24474470 1.0 P P19 1 0.68307023 0.17295962 0.74002701 1.0