# generated using pymatgen data_YbBeB2O5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.63128259 _cell_length_b 5.16351830 _cell_length_c 16.83325721 _cell_angle_alpha 80.29709523 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbBeB2O5 _chemical_formula_sum 'Yb4 Be4 B8 O20' _cell_volume 311.11177466 _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 Yb Yb0 1 0.84345949 0.72945658 0.57127327 1.0 Yb Yb1 1 0.15654051 0.27054342 0.42872673 1.0 Yb Yb2 1 0.34345949 0.27054342 0.92872673 1.0 Yb Yb3 1 0.65654051 0.72945658 0.07127327 1.0 Be Be4 1 0.71155705 0.60404888 0.79055042 1.0 Be Be5 1 0.21155705 0.39595112 0.70944958 1.0 Be Be6 1 0.78844295 0.60404888 0.29055042 1.0 Be Be7 1 0.28844295 0.39595112 0.20944958 1.0 B B8 1 0.69441644 0.09631033 0.78919364 1.0 B B9 1 0.99804788 0.79344408 0.90675969 1.0 B B10 1 0.19441644 0.90368967 0.71080636 1.0 B B11 1 0.30558356 0.90368967 0.21080636 1.0 B B12 1 0.00195212 0.20655592 0.09324031 1.0 B B13 1 0.49804788 0.20655592 0.59324031 1.0 B B14 1 0.50195212 0.79344408 0.40675969 1.0 B B15 1 0.80558356 0.09631033 0.28919364 1.0 O O16 1 0.36656694 0.95865868 0.63026377 1.0 O O17 1 0.38770824 0.42799088 0.62123073 1.0 O O18 1 0.96124806 0.12993747 0.72146298 1.0 O O19 1 0.71962489 0.21179963 0.52846860 1.0 O O20 1 0.13343306 0.95865868 0.13026377 1.0 O O21 1 0.28037511 0.78820037 0.47153140 1.0 O O22 1 0.99001306 0.66096737 0.71420147 1.0 O O23 1 0.78037511 0.21179963 0.02846860 1.0 O O24 1 0.46124806 0.87006253 0.77853702 1.0 O O25 1 0.00998694 0.33903263 0.28579853 1.0 O O26 1 0.11229176 0.42799088 0.12123073 1.0 O O27 1 0.61229176 0.57200912 0.37876927 1.0 O O28 1 0.21962489 0.78820037 0.97153140 1.0 O O29 1 0.03875194 0.87006253 0.27853702 1.0 O O30 1 0.86656694 0.04134132 0.86973623 1.0 O O31 1 0.50998694 0.66096737 0.21420147 1.0 O O32 1 0.63343306 0.04134132 0.36973623 1.0 O O33 1 0.53875194 0.12993747 0.22146298 1.0 O O34 1 0.49001306 0.33903263 0.78579853 1.0 O O35 1 0.88770824 0.57200912 0.87876927 1.0