# generated using pymatgen data_LiTm9Cd3Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.27491283 _cell_length_b 9.27418938 _cell_length_c 9.53657758 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00140795 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiTm9Cd3Ru _chemical_formula_sum 'Li2 Tm18 Cd6 Ru2' _cell_volume 710.39977130 _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 Tm Tm2 1 0.20799639 0.79202609 0.44079307 1.0 Tm Tm3 1 0.20799395 0.41598261 0.44078678 1.0 Tm Tm4 1 0.58403578 0.79202718 0.44079544 1.0 Tm Tm5 1 0.79200361 0.20797391 0.55920693 1.0 Tm Tm6 1 0.79200605 0.58401739 0.55921322 1.0 Tm Tm7 1 0.41596422 0.20797282 0.55920456 1.0 Tm Tm8 1 0.79200361 0.20797391 0.94079307 1.0 Tm Tm9 1 0.79200605 0.58401739 0.94078678 1.0 Tm Tm10 1 0.41596422 0.20797282 0.94079544 1.0 Tm Tm11 1 0.20799639 0.79202609 0.05920693 1.0 Tm Tm12 1 0.20799395 0.41598261 0.05921322 1.0 Tm Tm13 1 0.58403578 0.79202718 0.05920456 1.0 Tm Tm14 1 0.54178403 0.45822094 0.25000000 1.0 Tm Tm15 1 0.54177928 0.08355805 0.25000000 1.0 Tm Tm16 1 0.91643458 0.45821790 0.25000000 1.0 Tm Tm17 1 0.45821597 0.54177906 0.75000000 1.0 Tm Tm18 1 0.45822072 0.91644195 0.75000000 1.0 Tm Tm19 1 0.08356542 0.54178210 0.75000000 1.0 Cd Cd20 1 0.89217691 0.10779938 0.25000000 1.0 Cd Cd21 1 0.89219623 0.78440427 0.25000000 1.0 Cd Cd22 1 0.21562863 0.10781000 0.25000000 1.0 Cd Cd23 1 0.10782309 0.89220062 0.75000000 1.0 Cd Cd24 1 0.10780377 0.21559573 0.75000000 1.0 Cd Cd25 1 0.78437137 0.89219000 0.75000000 1.0 Ru Ru26 1 0.33334157 0.66668153 0.25000000 1.0 Ru Ru27 1 0.66665843 0.33331847 0.75000000 1.0