# generated using pymatgen data_SmBeCo12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.81040261 _cell_length_b 7.81038210 _cell_length_c 7.81040683 _cell_angle_alpha 60.00010360 _cell_angle_beta 59.99957346 _cell_angle_gamma 60.00008602 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmBeCo12 _chemical_formula_sum 'Sm2 Be2 Co24' _cell_volume 336.90199494 _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 0.25000000 0.25001160 0.25000000 1.0 Sm Sm1 1 0.75000000 0.74998840 0.75000000 1.0 Be Be2 1 0.00000000 0.00000000 0.00000000 1.0 Be Be3 1 0.50000000 0.50000000 0.50000000 1.0 Co Co4 1 0.29407531 0.05999338 0.94000726 1.0 Co Co5 1 0.70592469 0.94000662 0.05999274 1.0 Co Co6 1 0.05999297 0.29407450 0.70592548 1.0 Co Co7 1 0.94000703 0.70592550 0.29407452 1.0 Co Co8 1 0.94000258 0.29407097 0.05999631 1.0 Co Co9 1 0.20593035 0.44000202 0.79407083 1.0 Co Co10 1 0.05999742 0.70592903 0.94000369 1.0 Co Co11 1 0.79406965 0.55999798 0.20592917 1.0 Co Co12 1 0.70593035 0.05999680 0.29407083 1.0 Co Co13 1 0.44000258 0.20593014 0.55999631 1.0 Co Co14 1 0.29406965 0.94000320 0.70592917 1.0 Co Co15 1 0.55999742 0.79406986 0.44000369 1.0 Co Co16 1 0.05999735 0.94000201 0.29407456 1.0 Co Co17 1 0.55999735 0.20592608 0.79407456 1.0 Co Co18 1 0.94000265 0.05999799 0.70592544 1.0 Co Co19 1 0.44000265 0.79407392 0.20592544 1.0 Co Co20 1 0.70592507 0.29407606 0.94000307 1.0 Co Co21 1 0.20592507 0.55999580 0.44000307 1.0 Co Co22 1 0.29407493 0.70592394 0.05999693 1.0 Co Co23 1 0.79407493 0.44000420 0.55999693 1.0 Co Co24 1 0.79407531 0.20592405 0.44000726 1.0 Co Co25 1 0.20592469 0.79407595 0.55999274 1.0 Co Co26 1 0.55999297 0.44000705 0.20592548 1.0 Co Co27 1 0.44000703 0.55999295 0.79407452 1.0