# generated using pymatgen data_PrZr8(In2Ru)7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.67273670 _cell_length_b 9.67273688 _cell_length_c 9.67273677 _cell_angle_alpha 60.00000037 _cell_angle_beta 59.99999977 _cell_angle_gamma 59.99999851 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrZr8(In2Ru)7 _chemical_formula_sum 'Pr1 Zr8 In14 Ru7' _cell_volume 639.93093841 _cell_formula_units_Z 1 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 Pr Pr0 1 0.50000000 0.50000000 0.50000000 1.0 Zr Zr1 1 0.12042537 0.63872690 0.12042537 1.0 Zr Zr2 1 0.36127310 0.87957463 0.87957463 1.0 Zr Zr3 1 0.87957463 0.87957463 0.87957463 1.0 Zr Zr4 1 0.63872690 0.12042537 0.12042537 1.0 Zr Zr5 1 0.87957463 0.87957463 0.36127310 1.0 Zr Zr6 1 0.12042537 0.12042537 0.12042537 1.0 Zr Zr7 1 0.87957463 0.36127310 0.87957463 1.0 Zr Zr8 1 0.12042537 0.12042537 0.63872690 1.0 In In9 1 0.50000000 0.84682777 0.15317223 1.0 In In10 1 0.50000000 0.84682777 0.50000000 1.0 In In11 1 0.50000000 0.15317223 0.50000000 1.0 In In12 1 0.50000000 0.50000000 0.84682777 1.0 In In13 1 0.15317223 0.50000000 0.50000000 1.0 In In14 1 0.84682777 0.15317223 0.50000000 1.0 In In15 1 0.15317223 0.84682777 0.50000000 1.0 In In16 1 0.50000000 0.15317223 0.84682777 1.0 In In17 1 0.15317223 0.50000000 0.84682777 1.0 In In18 1 0.50000000 0.50000000 0.15317223 1.0 In In19 1 0.84682777 0.50000000 0.50000000 1.0 In In20 1 0.84682777 0.50000000 0.15317223 1.0 In In21 1 0.25000000 0.25000000 0.25000000 1.0 In In22 1 0.75000000 0.75000000 0.75000000 1.0 Ru Ru23 1 0.77687256 0.77687256 0.22312744 1.0 Ru Ru24 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru25 1 0.22312744 0.77687256 0.22312744 1.0 Ru Ru26 1 0.22312744 0.77687256 0.77687256 1.0 Ru Ru27 1 0.22312744 0.22312744 0.77687256 1.0 Ru Ru28 1 0.77687256 0.22312744 0.77687256 1.0 Ru Ru29 1 0.77687256 0.22312744 0.22312744 1.0