# generated using pymatgen data_Sm2Co5B2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.09497947 _cell_length_b 5.09497947 _cell_length_c 19.93241000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.98791650 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2Co5B2 _chemical_formula_sum 'Sm8 Co20 B8' _cell_volume 448.15493979 _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 Sm Sm0 1 0.66671700 0.33328300 0.52188000 1.0 Sm Sm1 1 0.33328300 0.66671700 0.47812000 1.0 Sm Sm2 1 0.33328300 0.66671700 0.02188000 1.0 Sm Sm3 1 0.66671700 0.33328300 0.97812000 1.0 Sm Sm4 1 0.66669000 0.33331000 0.67473600 1.0 Sm Sm5 1 0.33331000 0.66669000 0.32526400 1.0 Sm Sm6 1 0.33331000 0.66669000 0.17473600 1.0 Sm Sm7 1 0.66669000 0.33331000 0.82526400 1.0 Co Co8 1 0.00000000 0.00000000 0.50000000 1.0 Co Co9 1 0.00000000 0.00000000 0.00000000 1.0 Co Co10 1 0.16743800 0.33483900 0.75000000 1.0 Co Co11 1 0.16744700 0.83255300 0.75000000 1.0 Co Co12 1 0.66516100 0.83256200 0.75000000 1.0 Co Co13 1 0.83256200 0.66516100 0.25000000 1.0 Co Co14 1 0.83255300 0.16744700 0.25000000 1.0 Co Co15 1 0.33483900 0.16743800 0.25000000 1.0 Co Co16 1 0.16151700 0.32278800 0.60712600 1.0 Co Co17 1 0.16151500 0.83848500 0.60708100 1.0 Co Co18 1 0.67721200 0.83848400 0.60712600 1.0 Co Co19 1 0.83848400 0.67721200 0.39287400 1.0 Co Co20 1 0.83848500 0.16151500 0.39291900 1.0 Co Co21 1 0.32278800 0.16151700 0.39287400 1.0 Co Co22 1 0.83848400 0.67721200 0.10712600 1.0 Co Co23 1 0.83848500 0.16151500 0.10708100 1.0 Co Co24 1 0.32278800 0.16151700 0.10712600 1.0 Co Co25 1 0.16151700 0.32278800 0.89287400 1.0 Co Co26 1 0.16151500 0.83848500 0.89291900 1.0 Co Co27 1 0.67721200 0.83848400 0.89287400 1.0 B B28 1 0.00012500 0.99987500 0.67776900 1.0 B B29 1 0.99987500 0.00012500 0.32223100 1.0 B B30 1 0.99987500 0.00012500 0.17776900 1.0 B B31 1 0.00012500 0.99987500 0.82223100 1.0 B B32 1 0.66668100 0.33331900 0.32530100 1.0 B B33 1 0.33331900 0.66668100 0.67469900 1.0 B B34 1 0.33331900 0.66668100 0.82530100 1.0 B B35 1 0.66668100 0.33331900 0.17469900 1.0