# generated using pymatgen data_Lu3BC3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.51746443 _cell_length_b 3.51746336 _cell_length_c 15.65073935 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.34794219 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu3BC3 _chemical_formula_sum 'Lu6 B2 C6' _cell_volume 193.63601985 _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 0.58322523 0.41677477 0.89539191 1.0 Lu Lu1 1 0.41677477 0.58322523 0.39539191 1.0 Lu Lu2 1 0.41677477 0.58322523 0.10460809 1.0 Lu Lu3 1 0.58322523 0.41677477 0.60460809 1.0 Lu Lu4 1 0.91045610 0.08954390 0.25000000 1.0 Lu Lu5 1 0.08954390 0.91045610 0.75000000 1.0 B B6 1 -0.00000000 0.00000000 0.00000000 1.0 B B7 1 -0.00000000 0.00000000 0.50000000 1.0 C C8 1 0.09530470 0.90469530 0.91248170 1.0 C C9 1 0.90469530 0.09530470 0.41248170 1.0 C C10 1 0.90469530 0.09530470 0.08751830 1.0 C C11 1 0.09530470 0.90469530 0.58751830 1.0 C C12 1 0.59755359 0.40244641 0.75000000 1.0 C C13 1 0.40244641 0.59755359 0.25000000 1.0