# generated using pymatgen data_Nb3Zn2SnRu6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.41259815 _cell_length_b 6.24197034 _cell_length_c 13.21994504 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99974124 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3Zn2SnRu6 _chemical_formula_sum 'Nb6 Zn4 Sn2 Ru12' _cell_volume 364.12100160 _cell_formula_units_Z 2 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 0.99999328 0.00000000 0.99205545 1.0 Nb Nb1 1 0.49991080 0.50000000 0.17460753 1.0 Nb Nb2 1 0.99989915 0.00000000 0.34297144 1.0 Nb Nb3 1 0.50000042 0.50000000 0.50377529 1.0 Nb Nb4 1 0.00010208 0.00000000 0.66290264 1.0 Nb Nb5 1 0.50009472 0.50000000 0.82368010 1.0 Zn Zn6 1 0.99989755 0.50000000 0.33533496 1.0 Zn Zn7 1 0.49999454 0.00000000 0.50086594 1.0 Zn Zn8 1 0.00009883 0.50000000 0.66577881 1.0 Zn Zn9 1 0.50009140 0.00000000 0.83134383 1.0 Sn Sn10 1 0.99999474 0.50000000 0.99830324 1.0 Sn Sn11 1 0.49991662 0.00000000 0.16836872 1.0 Ru Ru12 1 0.49999573 0.24727432 0.99793110 1.0 Ru Ru13 1 0.49999573 0.75272768 0.99793110 1.0 Ru Ru14 1 0.99991292 0.25272549 0.16873254 1.0 Ru Ru15 1 0.99991292 0.74727451 0.16873254 1.0 Ru Ru16 1 0.49990687 0.25287249 0.33670482 1.0 Ru Ru17 1 0.49990687 0.74712751 0.33670482 1.0 Ru Ru18 1 0.99999640 0.25119117 0.50056224 1.0 Ru Ru19 1 0.99999640 0.74880883 0.50056224 1.0 Ru Ru20 1 0.50009772 0.24879366 0.66611482 1.0 Ru Ru21 1 0.50009772 0.75120634 0.66611482 1.0 Ru Ru22 1 0.00008880 0.24712595 0.82996099 1.0 Ru Ru23 1 0.00008880 0.75287405 0.82996099 1.0