# generated using pymatgen data_Lu15C19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.92645500 _cell_length_b 7.92645500 _cell_length_c 15.17118500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu15C19 _chemical_formula_sum 'Lu30 C38' _cell_volume 953.18566211 _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 0.70287400 0.90705500 0.50000000 1.0 Lu Lu1 1 0.20287400 0.59294500 0.00000000 1.0 Lu Lu2 1 0.29712600 0.09294500 0.50000000 1.0 Lu Lu3 1 0.79712600 0.40705500 0.00000000 1.0 Lu Lu4 1 0.90705500 0.29712600 0.50000000 1.0 Lu Lu5 1 0.59294500 0.79712600 0.00000000 1.0 Lu Lu6 1 0.09294500 0.70287400 0.50000000 1.0 Lu Lu7 1 0.40705500 0.20287400 0.00000000 1.0 Lu Lu8 1 0.78407100 0.59839300 0.64879100 1.0 Lu Lu9 1 0.28407100 0.90160700 0.85120900 1.0 Lu Lu10 1 0.21592900 0.40160700 0.64879100 1.0 Lu Lu11 1 0.71592900 0.09839300 0.85120900 1.0 Lu Lu12 1 0.59839300 0.21592900 0.35120900 1.0 Lu Lu13 1 0.90160700 0.71592900 0.14879100 1.0 Lu Lu14 1 0.40160700 0.78407100 0.35120900 1.0 Lu Lu15 1 0.09839300 0.28407100 0.14879100 1.0 Lu Lu16 1 0.59839300 0.21592900 0.64879100 1.0 Lu Lu17 1 0.09839300 0.28407100 0.85120900 1.0 Lu Lu18 1 0.40160700 0.78407100 0.64879100 1.0 Lu Lu19 1 0.90160700 0.71592900 0.85120900 1.0 Lu Lu20 1 0.21592900 0.40160700 0.35120900 1.0 Lu Lu21 1 0.28407100 0.90160700 0.14879100 1.0 Lu Lu22 1 0.78407100 0.59839300 0.35120900 1.0 Lu Lu23 1 0.71592900 0.09839300 0.14879100 1.0 Lu Lu24 1 0.00000000 0.00000000 0.33161900 1.0 Lu Lu25 1 0.50000000 0.50000000 0.16838100 1.0 Lu Lu26 1 0.00000000 0.00000000 0.66838100 1.0 Lu Lu27 1 0.50000000 0.50000000 0.83161900 1.0 Lu Lu28 1 0.50000000 0.50000000 0.50000000 1.0 Lu Lu29 1 0.00000000 0.00000000 0.00000000 1.0 C C30 1 0.60260500 0.19750000 0.50000000 1.0 C C31 1 0.10260500 0.30250000 0.00000000 1.0 C C32 1 0.39739500 0.80250000 0.50000000 1.0 C C33 1 0.89739500 0.69750000 0.00000000 1.0 C C34 1 0.19750000 0.39739500 0.50000000 1.0 C C35 1 0.30250000 0.89739500 0.00000000 1.0 C C36 1 0.80250000 0.60260500 0.50000000 1.0 C C37 1 0.69750000 0.10260500 0.00000000 1.0 C C38 1 0.69728300 0.90571200 0.66742800 1.0 C C39 1 0.19728300 0.59428800 0.83257200 1.0 C C40 1 0.30271700 0.09428800 0.66742800 1.0 C C41 1 0.80271700 0.40571200 0.83257200 1.0 C C42 1 0.90571200 0.30271700 0.33257200 1.0 C C43 1 0.59428800 0.80271700 0.16742800 1.0 C C44 1 0.09428800 0.69728300 0.33257200 1.0 C C45 1 0.40571200 0.19728300 0.16742800 1.0 C C46 1 0.65089500 0.84910500 0.75000000 1.0 C C47 1 0.15089500 0.65089500 0.75000000 1.0 C C48 1 0.34910500 0.15089500 0.75000000 1.0 C C49 1 0.84910500 0.34910500 0.75000000 1.0 C C50 1 0.84910500 0.34910500 0.25000000 1.0 C C51 1 0.65089500 0.84910500 0.25000000 1.0 C C52 1 0.15089500 0.65089500 0.25000000 1.0 C C53 1 0.34910500 0.15089500 0.25000000 1.0 C C54 1 0.90571200 0.30271700 0.66742800 1.0 C C55 1 0.40571200 0.19728300 0.83257200 1.0 C C56 1 0.09428800 0.69728300 0.66742800 1.0 C C57 1 0.59428800 0.80271700 0.83257200 1.0 C C58 1 0.30271700 0.09428800 0.33257200 1.0 C C59 1 0.19728300 0.59428800 0.16742800 1.0 C C60 1 0.69728300 0.90571200 0.33257200 1.0 C C61 1 0.80271700 0.40571200 0.16742800 1.0 C C62 1 0.50000000 0.50000000 0.66311000 1.0 C C63 1 0.00000000 0.00000000 0.83689000 1.0 C C64 1 0.50000000 0.50000000 0.33689000 1.0 C C65 1 0.00000000 0.00000000 0.16311000 1.0 C C66 1 0.50000000 0.50000000 0.00000000 1.0 C C67 1 0.00000000 0.00000000 0.50000000 1.0