# generated using pymatgen data_Tb(BeP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.65408238 _cell_length_b 10.39099440 _cell_length_c 11.29905764 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb(BeP)3 _chemical_formula_sum 'Tb4 Be12 P12' _cell_volume 429.02012906 _cell_formula_units_Z 4 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 0.75000000 0.94135406 0.33999372 1.0 Tb Tb1 1 0.25000000 0.44135406 0.16000628 1.0 Tb Tb2 1 0.75000000 0.55864594 0.83999372 1.0 Tb Tb3 1 0.25000000 0.05864594 0.66000628 1.0 Be Be4 1 0.75000000 0.24081045 0.45047677 1.0 Be Be5 1 0.25000000 0.74081045 0.04952323 1.0 Be Be6 1 0.75000000 0.25918955 0.95047677 1.0 Be Be7 1 0.25000000 0.75918955 0.54952323 1.0 Be Be8 1 0.75000000 0.64739895 0.28953373 1.0 Be Be9 1 0.25000000 0.14739895 0.21046627 1.0 Be Be10 1 0.75000000 0.85260105 0.78953373 1.0 Be Be11 1 0.25000000 0.35260105 0.71046627 1.0 Be Be12 1 0.75000000 0.04181026 0.06467535 1.0 Be Be13 1 0.25000000 0.54181026 0.43532465 1.0 Be Be14 1 0.75000000 0.45818974 0.56467535 1.0 Be Be15 1 0.25000000 0.95818974 0.93532465 1.0 P P16 1 0.75000000 0.44225807 0.37007589 1.0 P P17 1 0.25000000 0.94225807 0.12992411 1.0 P P18 1 0.75000000 0.05774193 0.87007589 1.0 P P19 1 0.25000000 0.55774193 0.62992411 1.0 P P20 1 0.75000000 0.23298691 0.14176908 1.0 P P21 1 0.25000000 0.73298691 0.35823092 1.0 P P22 1 0.75000000 0.26701309 0.64176908 1.0 P P23 1 0.25000000 0.76701309 0.85823092 1.0 P P24 1 0.75000000 0.63567742 0.09510957 1.0 P P25 1 0.25000000 0.13567742 0.40489043 1.0 P P26 1 0.75000000 0.86432258 0.59510957 1.0 P P27 1 0.25000000 0.36432258 0.90489043 1.0