# generated using pymatgen data_SrMg6Fe _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73540454 _cell_length_b 6.73540454 _cell_length_c 5.12729500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 123.56363777 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrMg6Fe _chemical_formula_sum 'Sr1 Mg6 Fe1' _cell_volume 193.82179421 _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 Sr Sr0 1 0.32420700 0.67579300 0.50000000 1.0 Mg Mg1 1 0.31640400 0.17077600 0.50000000 1.0 Mg Mg2 1 0.82922400 0.68359600 0.50000000 1.0 Mg Mg3 1 0.14862900 0.31297700 0.00000000 1.0 Mg Mg4 1 0.68702300 0.85137100 0.00000000 1.0 Mg Mg5 1 0.67957900 0.32042100 0.00000000 1.0 Mg Mg6 1 0.15145800 0.84854200 0.00000000 1.0 Fe Fe7 1 0.86348000 0.13652000 0.50000000 1.0