# generated using pymatgen data_ErTaP3Rh4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.90355565 _cell_length_b 10.97110969 _cell_length_c 12.41649576 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErTaP3Rh4 _chemical_formula_sum 'Er4 Ta4 P12 Rh16' _cell_volume 531.75303384 _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 0.25000000 0.58241943 0.70446861 1.0 Er Er1 1 0.25000000 0.91758057 0.20446861 1.0 Er Er2 1 0.75000000 0.41758057 0.29553139 1.0 Er Er3 1 0.75000000 0.08241943 0.79553139 1.0 Ta Ta4 1 0.25000000 0.71002363 0.98900838 1.0 Ta Ta5 1 0.25000000 0.78997637 0.48900838 1.0 Ta Ta6 1 0.75000000 0.28997637 0.01099162 1.0 Ta Ta7 1 0.75000000 0.21002363 0.51099162 1.0 P P8 1 0.25000000 0.41819379 0.11786946 1.0 P P9 1 0.25000000 0.08180621 0.61786946 1.0 P P10 1 0.75000000 0.58180621 0.88213054 1.0 P P11 1 0.75000000 0.91819379 0.38213054 1.0 P P12 1 0.25000000 0.26057661 0.87047155 1.0 P P13 1 0.25000000 0.23942339 0.37047155 1.0 P P14 1 0.75000000 0.73942339 0.12952845 1.0 P P15 1 0.75000000 0.76057661 0.62952845 1.0 P P16 1 0.25000000 0.59416603 0.39173401 1.0 P P17 1 0.25000000 0.90583397 0.89173401 1.0 P P18 1 0.75000000 0.40583397 0.60826599 1.0 P P19 1 0.75000000 0.09416603 0.10826599 1.0 Rh Rh20 1 0.25000000 0.40751541 0.48917450 1.0 Rh Rh21 1 0.25000000 0.09248459 0.98917450 1.0 Rh Rh22 1 0.75000000 0.59248459 0.51082550 1.0 Rh Rh23 1 0.75000000 0.90751541 0.01082550 1.0 Rh Rh24 1 0.25000000 0.22977507 0.18352403 1.0 Rh Rh25 1 0.25000000 0.27022493 0.68352403 1.0 Rh Rh26 1 0.75000000 0.77022493 0.81647597 1.0 Rh Rh27 1 0.75000000 0.72977507 0.31647597 1.0 Rh Rh28 1 0.25000000 0.89758005 0.70598605 1.0 Rh Rh29 1 0.25000000 0.60241995 0.20598605 1.0 Rh Rh30 1 0.75000000 0.10241995 0.29401395 1.0 Rh Rh31 1 0.75000000 0.39758005 0.79401395 1.0 Rh Rh32 1 0.25000000 0.46165897 0.93416303 1.0 Rh Rh33 1 0.25000000 0.03834103 0.43416303 1.0 Rh Rh34 1 0.75000000 0.53834103 0.06583697 1.0 Rh Rh35 1 0.75000000 0.96165897 0.56583697 1.0