# generated using pymatgen data_Zr6Nb4Ga5Ge _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.99369228 _cell_length_b 7.98426423 _cell_length_c 5.47663553 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.03908146 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Nb4Ga5Ge _chemical_formula_sum 'Zr6 Nb4 Ga5 Ge1' _cell_volume 302.59074038 _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 Zr Zr0 1 0.75002424 0.74926666 0.25000000 1.0 Zr Zr1 1 0.74707012 1.00000000 0.75000000 1.0 Zr Zr2 1 0.00075758 0.25073334 0.25000000 1.0 Zr Zr3 1 0.24920356 0.25052097 0.75000000 1.0 Zr Zr4 1 0.25178026 0.00000000 0.25000000 1.0 Zr Zr5 1 0.99868159 0.74947903 0.75000000 1.0 Nb Nb6 1 0.66654509 0.33219150 0.99982665 1.0 Nb Nb7 1 0.66654509 0.33219150 0.50017335 1.0 Nb Nb8 1 0.33435259 0.66780850 0.50017335 1.0 Nb Nb9 1 0.33435259 0.66780850 0.99982665 1.0 Ga Ga10 1 0.60335882 0.60298400 0.75000000 1.0 Ga Ga11 1 0.00037581 0.39701600 0.75000000 1.0 Ga Ga12 1 0.00068590 0.60403055 0.25000000 1.0 Ga Ga13 1 0.39665535 0.39596945 0.25000000 1.0 Ga Ga14 1 0.39311546 1.00000000 0.75000000 1.0 Ge Ge15 1 0.60649594 0.00000000 0.25000000 1.0