# generated using pymatgen data_Lu3(SiNi3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.46623190 _cell_length_b 7.46623190 _cell_length_c 7.46623190 _cell_angle_alpha 109.47122063 _cell_angle_beta 109.47122063 _cell_angle_gamma 109.47122063 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu3(SiNi3)2 _chemical_formula_sum 'Lu6 Si4 Ni12' _cell_volume 320.39264282 _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 Lu Lu0 1 0.71690000 0.71690000 0.00000000 1.0 Lu Lu1 1 0.28310000 0.00000000 0.28310000 1.0 Lu Lu2 1 0.00000000 0.28310000 0.28310000 1.0 Lu Lu3 1 0.28310000 0.28310000 0.00000000 1.0 Lu Lu4 1 0.71690000 0.00000000 0.71690000 1.0 Lu Lu5 1 0.00000000 0.71690000 0.71690000 1.0 Si Si6 1 0.00000000 0.00000000 0.50000000 1.0 Si Si7 1 0.00000000 0.50000000 0.00000000 1.0 Si Si8 1 0.50000000 0.00000000 0.00000000 1.0 Si Si9 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni10 1 0.33160800 0.33160800 0.66321600 1.0 Ni Ni11 1 0.66839200 0.00000000 0.33160800 1.0 Ni Ni12 1 0.00000000 0.66839200 0.33160800 1.0 Ni Ni13 1 0.66839200 0.33160800 0.00000000 1.0 Ni Ni14 1 0.33160800 0.66321600 0.33160800 1.0 Ni Ni15 1 0.00000000 0.33160800 0.66839200 1.0 Ni Ni16 1 0.33160800 0.66839200 0.00000000 1.0 Ni Ni17 1 0.33160800 0.00000000 0.66839200 1.0 Ni Ni18 1 0.66321600 0.33160800 0.33160800 1.0 Ni Ni19 1 0.66839200 0.66839200 0.33678400 1.0 Ni Ni20 1 0.66839200 0.33678400 0.66839200 1.0 Ni Ni21 1 0.33678400 0.66839200 0.66839200 1.0