# generated using pymatgen data_Sr3Er _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.10078200 _cell_length_b 8.10078200 _cell_length_c 6.57119200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999998 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr3Er _chemical_formula_sum 'Sr6 Er2' _cell_volume 373.44674497 _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 Sr Sr0 1 0.17173100 0.34346200 0.25000000 1.0 Sr Sr1 1 0.65653800 0.82826900 0.25000000 1.0 Sr Sr2 1 0.17173100 0.82826900 0.25000000 1.0 Sr Sr3 1 0.82826900 0.65653800 0.75000000 1.0 Sr Sr4 1 0.34346200 0.17173100 0.75000000 1.0 Sr Sr5 1 0.82826900 0.17173100 0.75000000 1.0 Er Er6 1 0.33333300 0.66666700 0.75000000 1.0 Er Er7 1 0.66666700 0.33333300 0.25000000 1.0