# generated using pymatgen data_SmCo2(B2Ru)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.21561685 _cell_length_b 7.21561685 _cell_length_c 3.88728192 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmCo2(B2Ru)2 _chemical_formula_sum 'Sm2 Co4 B8 Ru4' _cell_volume 202.39182536 _cell_formula_units_Z 2 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 0.00000000 0.00000000 0.91354515 1.0 Sm Sm1 1 0.50000000 0.50000000 0.41354515 1.0 Co Co2 1 0.11650521 0.37831919 0.62226807 1.0 Co Co3 1 0.88349479 0.62168081 0.62226807 1.0 Co Co4 1 0.12168081 0.61650521 0.12226807 1.0 Co Co5 1 0.87831919 0.38349479 0.12226807 1.0 B B6 1 0.81999742 0.65769697 0.11905416 1.0 B B7 1 0.18000258 0.34230303 0.11905416 1.0 B B8 1 0.84230303 0.31999742 0.61905416 1.0 B B9 1 0.15769697 0.68000258 0.61905416 1.0 B B10 1 0.72921369 0.82677014 0.40317847 1.0 B B11 1 0.27078631 0.17322986 0.40317847 1.0 B B12 1 0.67322986 0.22921369 0.90317847 1.0 B B13 1 0.32677014 0.77078631 0.90317847 1.0 Ru Ru14 1 0.38990190 0.15894054 0.89872723 1.0 Ru Ru15 1 0.61009810 0.84105946 0.89872723 1.0 Ru Ru16 1 0.34105946 0.88990190 0.39872723 1.0 Ru Ru17 1 0.65894054 0.11009810 0.39872723 1.0