# generated using pymatgen data_SmCoSb3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.18340600 _cell_length_b 12.10737800 _cell_length_c 12.59718800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmCoSb3 _chemical_formula_sum 'Sm8 Co8 Sb24' _cell_volume 943.08638558 _cell_formula_units_Z 8 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 0.72241400 0.25000000 0.69645600 1.0 Sm Sm1 1 0.75000000 0.00000000 0.29995800 1.0 Sm Sm2 1 0.22241400 0.25000000 0.30354400 1.0 Sm Sm3 1 0.25000000 0.00000000 0.70004200 1.0 Sm Sm4 1 0.75000000 0.50000000 0.29995800 1.0 Sm Sm5 1 0.25000000 0.50000000 0.70004200 1.0 Sm Sm6 1 0.77758600 0.75000000 0.69645600 1.0 Sm Sm7 1 0.27758600 0.75000000 0.30354400 1.0 Co Co8 1 0.53746000 0.63604200 0.89997200 1.0 Co Co9 1 0.53746000 0.86395800 0.89997200 1.0 Co Co10 1 0.96254000 0.13604200 0.89997200 1.0 Co Co11 1 0.03746000 0.86395800 0.10002800 1.0 Co Co12 1 0.46254000 0.13604200 0.10002800 1.0 Co Co13 1 0.96254000 0.36395800 0.89997200 1.0 Co Co14 1 0.46254000 0.36395800 0.10002800 1.0 Co Co15 1 0.03746000 0.63604200 0.10002800 1.0 Sb Sb16 1 0.25000000 0.00000000 0.22282200 1.0 Sb Sb17 1 0.25000000 0.50000000 0.22282200 1.0 Sb Sb18 1 0.48626500 0.12430900 0.49716500 1.0 Sb Sb19 1 0.73261800 0.25000000 0.21734700 1.0 Sb Sb20 1 0.38518600 0.75000000 0.05578000 1.0 Sb Sb21 1 0.51373500 0.62430900 0.50283500 1.0 Sb Sb22 1 0.88518600 0.75000000 0.94422000 1.0 Sb Sb23 1 0.11481400 0.25000000 0.05578000 1.0 Sb Sb24 1 0.61481400 0.25000000 0.94422000 1.0 Sb Sb25 1 0.25000000 0.50000000 0.97218000 1.0 Sb Sb26 1 0.75000000 0.50000000 0.02782000 1.0 Sb Sb27 1 0.01373500 0.87569100 0.49716500 1.0 Sb Sb28 1 0.98626500 0.37569100 0.50283500 1.0 Sb Sb29 1 0.76738200 0.75000000 0.21734700 1.0 Sb Sb30 1 0.25000000 0.00000000 0.97218000 1.0 Sb Sb31 1 0.51373500 0.87569100 0.50283500 1.0 Sb Sb32 1 0.75000000 0.00000000 0.02782000 1.0 Sb Sb33 1 0.23261800 0.25000000 0.78265300 1.0 Sb Sb34 1 0.48626500 0.37569100 0.49716500 1.0 Sb Sb35 1 0.75000000 0.00000000 0.77717800 1.0 Sb Sb36 1 0.26738200 0.75000000 0.78265300 1.0 Sb Sb37 1 0.01373500 0.62430900 0.49716500 1.0 Sb Sb38 1 0.98626500 0.12430900 0.50283500 1.0 Sb Sb39 1 0.75000000 0.50000000 0.77717800 1.0