# generated using pymatgen data_KYbEr2CuSe5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.07480820 _cell_length_b 7.27812492 _cell_length_c 17.72672566 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 73.74364464 _symmetry_Int_Tables_number 1 _chemical_formula_structural KYbEr2CuSe5 _chemical_formula_sum 'K2 Yb2 Er4 Cu2 Se10' _cell_volume 504.70190375 _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 K K0 1 0.52120695 0.95758810 0.25000000 1.0 K K1 1 0.47879405 0.04241190 0.75000000 1.0 Yb Yb2 1 0.00000000 0.00000000 0.00000000 1.0 Yb Yb3 1 0.00000000 0.00000000 0.50000000 1.0 Er Er4 1 0.27058079 0.45883743 0.10325811 1.0 Er Er5 1 0.27058079 0.45883743 0.39674189 1.0 Er Er6 1 0.72942021 0.54116257 0.60325811 1.0 Er Er7 1 0.72942021 0.54116257 0.89674289 1.0 Cu Cu8 1 0.79566811 0.40866578 0.25000000 1.0 Cu Cu9 1 0.20433289 0.59133322 0.75000000 1.0 Se Se10 1 0.64106201 0.71787899 0.04747597 1.0 Se Se11 1 0.89882661 0.20234779 0.13903551 1.0 Se Se12 1 0.19780240 0.60439521 0.25000000 1.0 Se Se13 1 0.89882661 0.20234779 0.36096449 1.0 Se Se14 1 0.64106201 0.71787899 0.45252503 1.0 Se Se15 1 0.35893899 0.28212101 0.54747497 1.0 Se Se16 1 0.10117339 0.79765221 0.63903551 1.0 Se Se17 1 0.80219860 0.39560479 0.75000000 1.0 Se Se18 1 0.10117339 0.79765221 0.86096449 1.0 Se Se19 1 0.35893899 0.28212101 0.95252503 1.0