# generated using pymatgen data_Hf8Ti9Nb3Ge16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.77554702 _cell_length_b 6.88430181 _cell_length_c 13.03062259 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.02183742 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf8Ti9Nb3Ge16 _chemical_formula_sum 'Hf8 Ti9 Nb3 Ge16' _cell_volume 607.81218142 _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 Hf Hf0 1 0.48920273 0.67662057 0.59429932 1.0 Hf Hf1 1 0.99079133 0.82538623 0.90510733 1.0 Hf Hf2 1 0.51043665 0.32449076 0.09423310 1.0 Hf Hf3 1 0.01006643 0.17598236 0.40533830 1.0 Hf Hf4 1 0.51043665 0.32449076 0.40576690 1.0 Hf Hf5 1 0.01006643 0.17598236 0.09466170 1.0 Hf Hf6 1 0.48920273 0.67662057 0.90570068 1.0 Hf Hf7 1 0.99079133 0.82538623 0.59489267 1.0 Ti Ti8 1 0.65396540 0.16844357 0.62558240 1.0 Ti Ti9 1 0.15690343 0.33023916 0.87445340 1.0 Ti Ti10 1 0.34394387 0.83020980 0.12478510 1.0 Ti Ti11 1 0.84436682 0.66887329 0.37598592 1.0 Ti Ti12 1 0.34394387 0.83020980 0.37521490 1.0 Ti Ti13 1 0.84436682 0.66887329 0.12401408 1.0 Ti Ti14 1 0.65396540 0.16844357 0.87441760 1.0 Ti Ti15 1 0.15690343 0.33023916 0.62554660 1.0 Ti Ti16 1 0.82851396 0.49541154 0.75000000 1.0 Nb Nb17 1 0.32828712 0.00399323 0.75000000 1.0 Nb Nb18 1 0.17219140 0.50493886 0.25000000 1.0 Nb Nb19 1 0.67204048 0.99534076 0.25000000 1.0 Ge Ge20 1 0.68452351 0.96011917 0.46223401 1.0 Ge Ge21 1 0.18426333 0.54020378 0.03733593 1.0 Ge Ge22 1 0.31555329 0.04078436 0.96199383 1.0 Ge Ge23 1 0.81591986 0.46016089 0.54066733 1.0 Ge Ge24 1 0.31555329 0.04078436 0.53800617 1.0 Ge Ge25 1 0.81591986 0.46016089 0.95933267 1.0 Ge Ge26 1 0.68452351 0.96011917 0.03776599 1.0 Ge Ge27 1 0.18426333 0.54020378 0.46266407 1.0 Ge Ge28 1 0.45885328 0.38315515 0.75000000 1.0 Ge Ge29 1 0.95318789 0.12229722 0.75000000 1.0 Ge Ge30 1 0.54546119 0.61940378 0.25000000 1.0 Ge Ge31 1 0.04465648 0.88014766 0.25000000 1.0 Ge Ge32 1 0.69293723 0.85336150 0.75000000 1.0 Ge Ge33 1 0.18590777 0.63857892 0.75000000 1.0 Ge Ge34 1 0.30911803 0.14087266 0.25000000 1.0 Ge Ge35 1 0.80897288 0.35946785 0.25000000 1.0