# generated using pymatgen data_HfFeGe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.91921200 _cell_length_b 9.11382000 _cell_length_c 10.15226100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfFeGe2 _chemical_formula_sum 'Hf12 Fe12 Ge24' _cell_volume 732.73205404 _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 0.74381600 0.82589000 0.04895800 1.0 Hf Hf1 1 0.74381600 0.17411000 0.95104200 1.0 Hf Hf2 1 0.25618400 0.67411000 0.54895800 1.0 Hf Hf3 1 0.25618400 0.32589000 0.45104200 1.0 Hf Hf4 1 0.25618400 0.17411000 0.95104200 1.0 Hf Hf5 1 0.25618400 0.82589000 0.04895800 1.0 Hf Hf6 1 0.74381600 0.32589000 0.45104200 1.0 Hf Hf7 1 0.74381600 0.67411000 0.54895800 1.0 Hf Hf8 1 0.50000000 0.83528500 0.32097400 1.0 Hf Hf9 1 0.50000000 0.16471500 0.67902600 1.0 Hf Hf10 1 0.50000000 0.66471500 0.82097400 1.0 Hf Hf11 1 0.50000000 0.33528500 0.17902600 1.0 Fe Fe12 1 0.74938200 0.59193900 0.25374800 1.0 Fe Fe13 1 0.74938200 0.40806100 0.74625200 1.0 Fe Fe14 1 0.25061800 0.90806100 0.75374800 1.0 Fe Fe15 1 0.25061800 0.09193900 0.24625200 1.0 Fe Fe16 1 0.25061800 0.40806100 0.74625200 1.0 Fe Fe17 1 0.25061800 0.59193900 0.25374800 1.0 Fe Fe18 1 0.74938200 0.09193900 0.24625200 1.0 Fe Fe19 1 0.74938200 0.90806100 0.75374800 1.0 Fe Fe20 1 0.74509600 0.00000000 0.50000000 1.0 Fe Fe21 1 0.25490400 0.50000000 0.00000000 1.0 Fe Fe22 1 0.25490400 0.00000000 0.50000000 1.0 Fe Fe23 1 0.74509600 0.50000000 0.00000000 1.0 Ge Ge24 1 0.84342700 0.84146600 0.31918500 1.0 Ge Ge25 1 0.84342700 0.15853400 0.68081500 1.0 Ge Ge26 1 0.15657300 0.65853400 0.81918500 1.0 Ge Ge27 1 0.15657300 0.34146600 0.18081500 1.0 Ge Ge28 1 0.15657300 0.15853400 0.68081500 1.0 Ge Ge29 1 0.15657300 0.84146600 0.31918500 1.0 Ge Ge30 1 0.84342700 0.34146600 0.18081500 1.0 Ge Ge31 1 0.84342700 0.65853400 0.81918500 1.0 Ge Ge32 1 0.50000000 0.54054500 0.37983100 1.0 Ge Ge33 1 0.50000000 0.45945500 0.62016900 1.0 Ge Ge34 1 0.50000000 0.95945500 0.87983100 1.0 Ge Ge35 1 0.50000000 0.04054500 0.12016900 1.0 Ge Ge36 1 0.00000000 0.54753800 0.37884100 1.0 Ge Ge37 1 0.00000000 0.45246200 0.62115900 1.0 Ge Ge38 1 0.00000000 0.95246200 0.87884100 1.0 Ge Ge39 1 0.00000000 0.04753800 0.12115900 1.0 Ge Ge40 1 0.50000000 0.62768000 0.10223600 1.0 Ge Ge41 1 0.50000000 0.37232000 0.89776400 1.0 Ge Ge42 1 0.50000000 0.87232000 0.60223600 1.0 Ge Ge43 1 0.50000000 0.12768000 0.39776400 1.0 Ge Ge44 1 0.00000000 0.62416000 0.09869400 1.0 Ge Ge45 1 0.00000000 0.37584000 0.90130600 1.0 Ge Ge46 1 0.00000000 0.87584000 0.59869400 1.0 Ge Ge47 1 0.00000000 0.12416000 0.40130600 1.0