# generated using pymatgen data_ErZn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.28645160 _cell_length_b 6.59723735 _cell_length_c 9.93013864 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErZn3 _chemical_formula_sum 'Er4 Zn12' _cell_volume 280.81179481 _cell_formula_units_Z 4 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 Er Er0 1 0.75000000 0.22030596 0.83758302 1.0 Er Er1 1 0.75000000 0.72030496 0.66241798 1.0 Er Er2 1 0.25000000 0.77969404 0.16241598 1.0 Er Er3 1 0.25000000 0.27969504 0.33758202 1.0 Zn Zn4 1 0.75000000 0.96312279 0.39690770 1.0 Zn Zn5 1 0.75000000 0.46312279 0.10309130 1.0 Zn Zn6 1 0.25000000 0.03687621 0.60309330 1.0 Zn Zn7 1 0.25000000 0.53687621 0.89690770 1.0 Zn Zn8 1 0.75000000 0.58145386 0.35277029 1.0 Zn Zn9 1 0.75000000 0.08145386 0.14722871 1.0 Zn Zn10 1 0.25000000 0.41854714 0.64723071 1.0 Zn Zn11 1 0.25000000 0.91854614 0.85277029 1.0 Zn Zn12 1 0.75000000 0.28114958 0.54371643 1.0 Zn Zn13 1 0.75000000 0.78114858 0.95628457 1.0 Zn Zn14 1 0.25000000 0.71885042 0.45628457 1.0 Zn Zn15 1 0.25000000 0.21885142 0.04371443 1.0