# generated using pymatgen data_Nb2B2Mo _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.12571917 _cell_length_b 6.12571917 _cell_length_c 3.29151858 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb2B2Mo _chemical_formula_sum 'Nb4 B4 Mo2' _cell_volume 123.51237616 _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 0.67906466 0.17906466 0.50000000 1.0 Nb Nb1 1 0.32093534 0.82093534 0.50000000 1.0 Nb Nb2 1 0.17906466 0.32093534 0.50000000 1.0 Nb Nb3 1 0.82093534 0.67906466 0.50000000 1.0 B B4 1 0.10826448 0.60826448 -0.00000000 1.0 B B5 1 0.89173552 0.39173552 0.00000000 1.0 B B6 1 0.60826448 0.89173552 0.00000000 1.0 B B7 1 0.39173552 0.10826448 -0.00000000 1.0 Mo Mo8 1 0.00000000 0.00000000 -0.00000000 1.0 Mo Mo9 1 0.50000000 0.50000000 -0.00000000 1.0