# generated using pymatgen data_Nb5Ge4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.77820900 _cell_length_b 6.84453000 _cell_length_c 13.24457400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb5Ge4 _chemical_formula_sum 'Nb20 Ge16' _cell_volume 614.46419475 _cell_formula_units_Z 4 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 Nb Nb0 1 0.01953200 0.32476800 0.91382600 1.0 Nb Nb1 1 0.51953200 0.17523200 0.58617400 1.0 Nb Nb2 1 0.48046800 0.82476800 0.08617400 1.0 Nb Nb3 1 0.98046800 0.67523200 0.41382600 1.0 Nb Nb4 1 0.01953200 0.32476800 0.58617400 1.0 Nb Nb5 1 0.51953200 0.17523200 0.91382600 1.0 Nb Nb6 1 0.48046800 0.82476800 0.41382600 1.0 Nb Nb7 1 0.98046800 0.67523200 0.08617400 1.0 Nb Nb8 1 0.84639400 0.83577500 0.87552700 1.0 Nb Nb9 1 0.34639400 0.66422500 0.62447300 1.0 Nb Nb10 1 0.65360600 0.33577500 0.12447300 1.0 Nb Nb11 1 0.15360600 0.16422500 0.37552700 1.0 Nb Nb12 1 0.15360600 0.16422500 0.12447300 1.0 Nb Nb13 1 0.65360600 0.33577500 0.37552700 1.0 Nb Nb14 1 0.34639400 0.66422500 0.87552700 1.0 Nb Nb15 1 0.84639400 0.83577500 0.62447300 1.0 Nb Nb16 1 0.17205700 0.99185200 0.75000000 1.0 Nb Nb17 1 0.67205700 0.50814800 0.75000000 1.0 Nb Nb18 1 0.32794300 0.49185200 0.25000000 1.0 Nb Nb19 1 0.82794300 0.00814800 0.25000000 1.0 Ge Ge20 1 0.68924900 0.53462300 0.95881500 1.0 Ge Ge21 1 0.18924900 0.96537700 0.54118500 1.0 Ge Ge22 1 0.81075100 0.03462300 0.04118500 1.0 Ge Ge23 1 0.31075100 0.46537700 0.45881500 1.0 Ge Ge24 1 0.31075100 0.46537700 0.04118500 1.0 Ge Ge25 1 0.81075100 0.03462300 0.45881500 1.0 Ge Ge26 1 0.18924900 0.96537700 0.95881500 1.0 Ge Ge27 1 0.68924900 0.53462300 0.54118500 1.0 Ge Ge28 1 0.31877800 0.33963600 0.75000000 1.0 Ge Ge29 1 0.81877800 0.16036400 0.75000000 1.0 Ge Ge30 1 0.18122200 0.83963600 0.25000000 1.0 Ge Ge31 1 0.68122200 0.66036400 0.25000000 1.0 Ge Ge32 1 0.04620800 0.60373900 0.75000000 1.0 Ge Ge33 1 0.54620800 0.89626100 0.75000000 1.0 Ge Ge34 1 0.45379200 0.10373900 0.25000000 1.0 Ge Ge35 1 0.95379200 0.39626100 0.25000000 1.0