# generated using pymatgen data_LiY9In3Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.57971157 _cell_length_b 9.57971233 _cell_length_c 9.66166809 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000081 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiY9In3Ru _chemical_formula_sum 'Li2 Y18 In6 Ru2' _cell_volume 767.86989962 _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 Li Li0 1 0.00000000 0.00000000 0.50000000 1.0 Li Li1 1 0.00000000 0.00000000 0.00000000 1.0 Y Y2 1 0.20744941 0.79255059 0.43804629 1.0 Y Y3 1 0.20744941 0.41490083 0.43804629 1.0 Y Y4 1 0.58509917 0.79255059 0.43804629 1.0 Y Y5 1 0.79255059 0.20744941 0.56195371 1.0 Y Y6 1 0.79255059 0.58509917 0.56195371 1.0 Y Y7 1 0.41490083 0.20744941 0.56195371 1.0 Y Y8 1 0.79255059 0.20744941 0.93804629 1.0 Y Y9 1 0.79255059 0.58509917 0.93804629 1.0 Y Y10 1 0.41490083 0.20744941 0.93804629 1.0 Y Y11 1 0.20744941 0.79255059 0.06195371 1.0 Y Y12 1 0.20744941 0.41490083 0.06195371 1.0 Y Y13 1 0.58509917 0.79255059 0.06195371 1.0 Y Y14 1 0.54040460 0.45959540 0.25000000 1.0 Y Y15 1 0.54040460 0.08081021 0.25000000 1.0 Y Y16 1 0.91918979 0.45959540 0.25000000 1.0 Y Y17 1 0.45959540 0.54040460 0.75000000 1.0 Y Y18 1 0.45959540 0.91918979 0.75000000 1.0 Y Y19 1 0.08081021 0.54040460 0.75000000 1.0 In In20 1 0.89117220 0.10882780 0.25000000 1.0 In In21 1 0.89117220 0.78234441 0.25000000 1.0 In In22 1 0.21765559 0.10882780 0.25000000 1.0 In In23 1 0.10882780 0.89117220 0.75000000 1.0 In In24 1 0.10882780 0.21765559 0.75000000 1.0 In In25 1 0.78234441 0.89117220 0.75000000 1.0 Ru Ru26 1 0.33333300 0.66666700 0.25000000 1.0 Ru Ru27 1 0.66666700 0.33333300 0.75000000 1.0