# generated using pymatgen data_Nb5Ga(B2Ru5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.35388178 _cell_length_b 9.35388178 _cell_length_c 3.00468490 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb5Ga(B2Ru5)2 _chemical_formula_sum 'Nb5 Ga1 B4 Ru10' _cell_volume 262.89521880 _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 Nb Nb0 1 0.82090939 0.67464462 0.00000000 1.0 Nb Nb1 1 0.17909061 0.32535538 0.00000000 1.0 Nb Nb2 1 0.32535538 0.82090939 0.00000000 1.0 Nb Nb3 1 0.67464462 0.17909061 0.00000000 1.0 Nb Nb4 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga5 1 0.50000000 0.50000000 0.00000000 1.0 B B6 1 0.61657267 0.87106204 0.00000000 1.0 B B7 1 0.38342733 0.12893796 0.00000000 1.0 B B8 1 0.12893796 0.61657267 0.00000000 1.0 B B9 1 0.87106204 0.38342733 0.00000000 1.0 Ru Ru10 1 0.50000000 0.00000000 0.50000000 1.0 Ru Ru11 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru12 1 0.56991467 0.71442674 0.50000000 1.0 Ru Ru13 1 0.43008533 0.28557326 0.50000000 1.0 Ru Ru14 1 0.07211432 0.78004216 0.50000000 1.0 Ru Ru15 1 0.92788568 0.21995784 0.50000000 1.0 Ru Ru16 1 0.28557326 0.56991467 0.50000000 1.0 Ru Ru17 1 0.71442674 0.43008533 0.50000000 1.0 Ru Ru18 1 0.21995784 0.07211432 0.50000000 1.0 Ru Ru19 1 0.78004216 0.92788568 0.50000000 1.0