# generated using pymatgen data_Nb3CrOs2N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.27823118 _cell_length_b 8.27823093 _cell_length_c 8.27823162 _cell_angle_alpha 59.99999724 _cell_angle_beta 59.99999822 _cell_angle_gamma 59.99999784 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3CrOs2N _chemical_formula_sum 'Nb12 Cr4 Os8 N4' _cell_volume 401.14154411 _cell_formula_units_Z 4 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 0.81845102 0.43154898 0.43154898 1.0 Nb Nb1 1 0.43154998 0.81845002 0.81845002 1.0 Nb Nb2 1 0.43154898 0.81845102 0.43154898 1.0 Nb Nb3 1 0.43154898 0.43154898 0.81845102 1.0 Nb Nb4 1 0.81845002 0.43154998 0.81845002 1.0 Nb Nb5 1 0.81845002 0.81845002 0.43154998 1.0 Nb Nb6 1 0.56845002 0.18154998 0.56845002 1.0 Nb Nb7 1 0.18154898 0.56845102 0.18154898 1.0 Nb Nb8 1 0.18154998 0.56845002 0.56845002 1.0 Nb Nb9 1 0.56845002 0.56845002 0.18154998 1.0 Nb Nb10 1 0.56845102 0.18154898 0.18154898 1.0 Nb Nb11 1 0.18154898 0.18154898 0.56845102 1.0 Cr Cr12 1 0.00000000 0.00000000 0.00000000 1.0 Cr Cr13 1 0.00000000 0.00000000 0.50000000 1.0 Cr Cr14 1 0.50000000 0.00000000 0.00000000 1.0 Cr Cr15 1 0.00000000 0.50000000 0.00000000 1.0 Os Os16 1 0.20713579 0.20713579 0.20713579 1.0 Os Os17 1 0.20713579 0.20713579 0.87859264 1.0 Os Os18 1 0.87859264 0.20713579 0.20713579 1.0 Os Os19 1 0.20713579 0.87859264 0.20713579 1.0 Os Os20 1 0.79286321 0.79286321 0.79286321 1.0 Os Os21 1 0.79286321 0.79286321 0.12140636 1.0 Os Os22 1 0.79286321 0.12140636 0.79286321 1.0 Os Os23 1 0.12140636 0.79286321 0.79286321 1.0 N N24 1 0.50000000 0.50000000 0.50000000 1.0 N N25 1 0.50000000 0.50000000 0.99999800 1.0 N N26 1 0.99999800 0.50000000 0.50000000 1.0 N N27 1 0.50000000 0.99999800 0.50000000 1.0