# generated using pymatgen data_MgNb2GeRu4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.40353454 _cell_length_b 6.19473292 _cell_length_c 13.17313059 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99997165 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgNb2GeRu4 _chemical_formula_sum 'Mg3 Nb6 Ge3 Ru12' _cell_volume 359.34614599 _cell_formula_units_Z 3 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 Mg Mg0 1 0.99998227 0.50000000 0.00090500 1.0 Mg Mg1 1 0.50009334 0.00000000 0.16669568 1.0 Mg Mg2 1 0.00005596 0.50000000 0.33240996 1.0 Nb Nb3 1 0.00000017 0.00000000 0.00225954 1.0 Nb Nb4 1 0.49998765 0.50000000 0.16666889 1.0 Nb Nb5 1 0.00001625 0.00000000 0.33108339 1.0 Nb Nb6 1 0.49999999 0.50000000 0.49826797 1.0 Nb Nb7 1 0.99997192 0.00000000 0.66666565 1.0 Nb Nb8 1 0.49999190 0.50000000 0.83507383 1.0 Ge Ge9 1 0.49999443 0.00000000 0.49829458 1.0 Ge Ge10 1 0.99998106 0.50000000 0.66666284 1.0 Ge Ge11 1 0.49998322 0.00000000 0.83503889 1.0 Ru Ru12 1 0.49999210 0.24850734 0.99521314 1.0 Ru Ru13 1 0.49999210 0.75149266 0.99521314 1.0 Ru Ru14 1 0.00000945 0.24873177 0.16666304 1.0 Ru Ru15 1 0.00000945 0.75126823 0.16666304 1.0 Ru Ru16 1 0.50001427 0.24851367 0.33812252 1.0 Ru Ru17 1 0.50001427 0.75148733 0.33812252 1.0 Ru Ru18 1 0.99999431 0.24970223 0.50475455 1.0 Ru Ru19 1 0.99999431 0.75029677 0.50475455 1.0 Ru Ru20 1 0.49997739 0.24827961 0.66666340 1.0 Ru Ru21 1 0.49997739 0.75172139 0.66666340 1.0 Ru Ru22 1 0.99998190 0.24969971 0.82857074 1.0 Ru Ru23 1 0.99998190 0.75030029 0.82857074 1.0