# generated using pymatgen data_Nb12TcMo6Os5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.53504001 _cell_length_b 6.41499084 _cell_length_c 13.60454473 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb12TcMo6Os5 _chemical_formula_sum 'Nb12 Tc1 Mo6 Os5' _cell_volume 395.78668224 _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 0.50000076 0.24930062 0.99930523 1.0 Nb Nb1 1 0.50000076 0.75069938 0.99930523 1.0 Nb Nb2 1 0.00000123 0.25008942 0.16649246 1.0 Nb Nb3 1 0.00000123 0.74991058 0.16649246 1.0 Nb Nb4 1 0.50000233 0.25000711 0.33333400 1.0 Nb Nb5 1 0.50000233 0.74999289 0.33333400 1.0 Nb Nb6 1 0.00000123 0.25008742 0.50017354 1.0 Nb Nb7 1 0.00000123 0.74991258 0.50017354 1.0 Nb Nb8 1 0.49999676 0.24930062 0.66736077 1.0 Nb Nb9 1 0.49999676 0.75069938 0.66736077 1.0 Nb Nb10 1 0.99999749 0.24869245 0.83333400 1.0 Nb Nb11 1 0.99999749 0.75130755 0.83333400 1.0 Tc Tc12 1 0.50000007 0.00000000 0.83333500 1.0 Mo Mo13 1 0.99999915 0.00000000 0.00095577 1.0 Mo Mo14 1 0.50000320 0.49999900 0.16667607 1.0 Mo Mo15 1 0.00000226 0.00000000 0.33333300 1.0 Mo Mo16 1 0.49999820 0.49999900 0.49999093 1.0 Mo Mo17 1 0.99999915 0.00000000 0.66571123 1.0 Mo Mo18 1 0.49999794 0.49999900 0.83333300 1.0 Os Os19 1 0.99999871 0.49999900 0.00032491 1.0 Os Os20 1 0.50000343 0.00000000 0.16716263 1.0 Os Os21 1 0.00000217 0.49999900 0.33333500 1.0 Os Os22 1 0.49999843 0.00000000 0.49950437 1.0 Os Os23 1 0.99999871 0.49999900 0.66634009 1.0