# generated using pymatgen data_GdS2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.52312904 _cell_length_b 5.52312904 _cell_length_c 5.52312904 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural GdS2 _chemical_formula_sum 'Gd2 S4' _cell_volume 119.13533024 _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 Gd Gd0 1 0.25000000 0.25000000 0.25000000 1.0 Gd Gd1 1 0.00000000 0.00000000 0.00000000 1.0 S S2 1 0.62500000 0.62500000 0.12500000 1.0 S S3 1 0.62500000 0.12500000 0.62500000 1.0 S S4 1 0.12500000 0.62500000 0.62500000 1.0 S S5 1 0.62500000 0.62500000 0.62500000 1.0