# generated using pymatgen data_Nb11ReRu4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.44679541 _cell_length_b 6.44679541 _cell_length_c 6.44679541 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb11ReRu4 _chemical_formula_sum 'Nb11 Re1 Ru4' _cell_volume 267.93636702 _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 0.50000000 0.00000000 0.00000000 1.0 Nb Nb1 1 0.00000000 0.50000000 0.00000000 1.0 Nb Nb2 1 0.24984440 0.24984440 0.24984440 1.0 Nb Nb3 1 0.75015560 0.24984440 0.24984440 1.0 Nb Nb4 1 0.24984440 0.75015560 0.24984440 1.0 Nb Nb5 1 0.75015560 0.75015560 0.24984440 1.0 Nb Nb6 1 0.00000000 0.00000000 0.50000000 1.0 Nb Nb7 1 0.24984440 0.24984440 0.75015560 1.0 Nb Nb8 1 0.75015560 0.24984440 0.75015560 1.0 Nb Nb9 1 0.24984440 0.75015560 0.75015560 1.0 Nb Nb10 1 0.75015560 0.75015560 0.75015560 1.0 Re Re11 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru12 1 0.50000000 0.50000000 0.00000000 1.0 Ru Ru13 1 0.50000000 0.00000000 0.50000000 1.0 Ru Ru14 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru15 1 0.50000000 0.50000000 0.50000000 1.0