# generated using pymatgen data_NbZnNi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.38335332 _cell_length_b 10.38335332 _cell_length_c 10.38335332 _cell_angle_alpha 127.92605178 _cell_angle_beta 117.51323171 _cell_angle_gamma 85.60699111 _symmetry_Int_Tables_number 1 _chemical_formula_structural NbZnNi2 _chemical_formula_sum 'Nb1 Zn1 Ni2' _cell_volume 747.98964306 _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 0.00000000 0.50000000 0.50000000 1.0 Zn Zn1 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni2 1 0.00000000 0.26291500 0.26291500 1.0 Ni Ni3 1 0.00000000 0.73708500 0.73708500 1.0