# generated using pymatgen data_PuNi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.73149206 _cell_length_b 8.73149206 _cell_length_c 8.73149198 _cell_angle_alpha 33.15407708 _cell_angle_beta 33.15407708 _cell_angle_gamma 33.15407469 _symmetry_Int_Tables_number 1 _chemical_formula_structural PuNi3 _chemical_formula_sum 'Pu3 Ni9' _cell_volume 177.22526483 _cell_formula_units_Z 3 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 Pu Pu0 1 0.14261300 0.14261300 0.14261300 1.0 Pu Pu1 1 0.00000000 0.00000000 0.00000000 1.0 Pu Pu2 1 0.85738700 0.85738700 0.85738700 1.0 Ni Ni3 1 0.41751800 0.41751800 0.91846000 1.0 Ni Ni4 1 0.41751800 0.91846000 0.41751800 1.0 Ni Ni5 1 0.66736600 0.66736600 0.66736600 1.0 Ni Ni6 1 0.58248200 0.58248200 0.08154000 1.0 Ni Ni7 1 0.91846000 0.41751800 0.41751800 1.0 Ni Ni8 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni9 1 0.58248200 0.08154000 0.58248200 1.0 Ni Ni10 1 0.33263400 0.33263400 0.33263400 1.0 Ni Ni11 1 0.08154000 0.58248200 0.58248200 1.0