# generated using pymatgen data_Nb8SiNi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.22836250 _cell_length_b 6.22836250 _cell_length_c 4.92800702 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb8SiNi3 _chemical_formula_sum 'Nb8 Si1 Ni3' _cell_volume 191.16970947 _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 0.34030138 0.15581477 0.50171159 1.0 Nb Nb1 1 0.65969862 0.84418523 0.50171159 1.0 Nb Nb2 1 0.15581477 0.65969862 0.50171159 1.0 Nb Nb3 1 0.84418523 0.34030138 0.50171159 1.0 Nb Nb4 1 0.34030138 0.84418523 0.99828841 1.0 Nb Nb5 1 0.84418523 0.65969862 0.99828841 1.0 Nb Nb6 1 0.15581477 0.34030138 0.99828841 1.0 Nb Nb7 1 0.65969862 0.15581477 0.99828841 1.0 Si Si8 1 0.50000000 0.50000000 0.25000000 1.0 Ni Ni9 1 0.50000000 0.50000000 0.75000000 1.0 Ni Ni10 1 0.00000000 0.00000000 0.75000000 1.0 Ni Ni11 1 0.00000000 0.00000000 0.25000000 1.0