# generated using pymatgen data_HfGe2Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.07864300 _cell_length_b 9.30961300 _cell_length_c 10.48103000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfGe2Ru _chemical_formula_sum 'Hf12 Ge24 Ru12' _cell_volume 788.26820341 _cell_formula_units_Z 12 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 Hf Hf0 1 0.24123100 0.82671300 0.45178000 1.0 Hf Hf1 1 0.24123100 0.17328700 0.54822000 1.0 Hf Hf2 1 0.75876900 0.32671300 0.04822000 1.0 Hf Hf3 1 0.75876900 0.67328700 0.95178000 1.0 Hf Hf4 1 0.75876900 0.17328700 0.54822000 1.0 Hf Hf5 1 0.75876900 0.82671300 0.45178000 1.0 Hf Hf6 1 0.24123100 0.67328700 0.95178000 1.0 Hf Hf7 1 0.24123100 0.32671300 0.04822000 1.0 Hf Hf8 1 0.00000000 0.83366600 0.18088300 1.0 Hf Hf9 1 0.00000000 0.16633400 0.81911700 1.0 Hf Hf10 1 0.00000000 0.33366600 0.31911700 1.0 Hf Hf11 1 0.00000000 0.66633400 0.68088300 1.0 Ge Ge12 1 0.34688400 0.84551600 0.18253900 1.0 Ge Ge13 1 0.34688400 0.15448400 0.81746100 1.0 Ge Ge14 1 0.65311600 0.34551600 0.31746100 1.0 Ge Ge15 1 0.65311600 0.65448400 0.68253900 1.0 Ge Ge16 1 0.65311600 0.15448400 0.81746100 1.0 Ge Ge17 1 0.65311600 0.84551600 0.18253900 1.0 Ge Ge18 1 0.34688400 0.65448400 0.68253900 1.0 Ge Ge19 1 0.34688400 0.34551600 0.31746100 1.0 Ge Ge20 1 0.50000000 0.54682500 0.11310700 1.0 Ge Ge21 1 0.50000000 0.45317500 0.88689300 1.0 Ge Ge22 1 0.50000000 0.04682500 0.38689300 1.0 Ge Ge23 1 0.50000000 0.95317500 0.61310700 1.0 Ge Ge24 1 0.00000000 0.53624100 0.11608800 1.0 Ge Ge25 1 0.00000000 0.46375900 0.88391200 1.0 Ge Ge26 1 0.00000000 0.03624100 0.38391200 1.0 Ge Ge27 1 0.00000000 0.96375900 0.61608800 1.0 Ge Ge28 1 0.50000000 0.63660900 0.40506400 1.0 Ge Ge29 1 0.50000000 0.36339100 0.59493600 1.0 Ge Ge30 1 0.50000000 0.13660900 0.09493600 1.0 Ge Ge31 1 0.50000000 0.86339100 0.90506400 1.0 Ge Ge32 1 0.00000000 0.63205300 0.40161100 1.0 Ge Ge33 1 0.00000000 0.36794700 0.59838900 1.0 Ge Ge34 1 0.00000000 0.13205300 0.09838900 1.0 Ge Ge35 1 0.00000000 0.86794700 0.90161100 1.0 Ru Ru36 1 0.25029000 0.59766300 0.24253900 1.0 Ru Ru37 1 0.25029000 0.40233700 0.75746100 1.0 Ru Ru38 1 0.74971000 0.09766300 0.25746100 1.0 Ru Ru39 1 0.74971000 0.90233700 0.74253900 1.0 Ru Ru40 1 0.74971000 0.40233700 0.75746100 1.0 Ru Ru41 1 0.74971000 0.59766300 0.24253900 1.0 Ru Ru42 1 0.25029000 0.90233700 0.74253900 1.0 Ru Ru43 1 0.25029000 0.09766300 0.25746100 1.0 Ru Ru44 1 0.24651700 0.50000000 0.50000000 1.0 Ru Ru45 1 0.75348300 0.00000000 0.00000000 1.0 Ru Ru46 1 0.75348300 0.50000000 0.50000000 1.0 Ru Ru47 1 0.24651700 0.00000000 0.00000000 1.0