# generated using pymatgen data_Sc6FeSb2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.66090377 _cell_length_b 7.66084432 _cell_length_c 3.94913743 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00058794 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc6FeSb2 _chemical_formula_sum 'Sc6 Fe1 Sb2' _cell_volume 200.71829084 _cell_formula_units_Z 1 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 Sc Sc0 1 0.60863215 -0.00000117 0.50000000 1.0 Sc Sc1 1 0.39134232 0.39134427 0.50000000 1.0 Sc Sc2 1 0.99999719 0.60864173 0.50000000 1.0 Sc Sc3 1 0.23580560 -0.00000131 0.00000000 1.0 Sc Sc4 1 0.76419454 0.76419199 0.00000000 1.0 Sc Sc5 1 0.00000077 0.23580982 0.00000000 1.0 Fe Fe6 1 0.00001575 0.00000949 0.50000000 1.0 Sb Sb7 1 0.33333848 0.66667847 0.00000000 1.0 Sb Sb8 1 0.66667321 0.33332771 0.00000000 1.0