# generated using pymatgen data_Lu2Fe14C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.68875900 _cell_length_b 8.68875900 _cell_length_c 11.60045300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu2Fe14C _chemical_formula_sum 'Lu8 Fe56 C4' _cell_volume 875.77078136 _cell_formula_units_Z 4 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 0.35654800 0.35654800 0.50000000 1.0 Lu Lu1 1 0.85654800 0.14345200 0.00000000 1.0 Lu Lu2 1 0.14345200 0.85654800 0.00000000 1.0 Lu Lu3 1 0.74178700 0.74178700 0.00000000 1.0 Lu Lu4 1 0.24178700 0.75821300 0.50000000 1.0 Lu Lu5 1 0.75821300 0.24178700 0.50000000 1.0 Lu Lu6 1 0.64345200 0.64345200 0.50000000 1.0 Lu Lu7 1 0.25821300 0.25821300 0.00000000 1.0 Fe Fe8 1 0.09677600 0.09677600 0.79860600 1.0 Fe Fe9 1 0.64281600 0.96395600 0.82558200 1.0 Fe Fe10 1 0.68418700 0.68418700 0.75459200 1.0 Fe Fe11 1 0.56409300 0.22517600 0.11996600 1.0 Fe Fe12 1 0.93590700 0.72517600 0.38003400 1.0 Fe Fe13 1 0.14281600 0.53604400 0.67441800 1.0 Fe Fe14 1 0.64281600 0.96395600 0.17441800 1.0 Fe Fe15 1 0.77482400 0.43590700 0.88003400 1.0 Fe Fe16 1 0.53604400 0.14281600 0.67441800 1.0 Fe Fe17 1 0.85718400 0.46395600 0.67441800 1.0 Fe Fe18 1 0.68418700 0.68418700 0.24540800 1.0 Fe Fe19 1 0.00000000 0.00000000 0.60839800 1.0 Fe Fe20 1 0.40322400 0.59677600 0.29860600 1.0 Fe Fe21 1 0.22517600 0.56409300 0.88003400 1.0 Fe Fe22 1 0.96395600 0.64281600 0.17441800 1.0 Fe Fe23 1 0.35718400 0.03604400 0.82558200 1.0 Fe Fe24 1 0.72517600 0.93590700 0.38003400 1.0 Fe Fe25 1 0.06409300 0.27482400 0.61996600 1.0 Fe Fe26 1 0.81581300 0.18418700 0.25459200 1.0 Fe Fe27 1 0.27482400 0.06409300 0.38003400 1.0 Fe Fe28 1 0.40322400 0.59677600 0.70139400 1.0 Fe Fe29 1 0.22517600 0.56409300 0.11996600 1.0 Fe Fe30 1 0.90322400 0.90322400 0.79860600 1.0 Fe Fe31 1 0.46395600 0.85718400 0.32558200 1.0 Fe Fe32 1 0.93590700 0.72517600 0.61996600 1.0 Fe Fe33 1 0.14281600 0.53604400 0.32558200 1.0 Fe Fe34 1 0.35718400 0.03604400 0.17441800 1.0 Fe Fe35 1 0.72517600 0.93590700 0.61996600 1.0 Fe Fe36 1 0.56409300 0.22517600 0.88003400 1.0 Fe Fe37 1 0.90322400 0.90322400 0.20139400 1.0 Fe Fe38 1 0.18418700 0.81581300 0.25459200 1.0 Fe Fe39 1 0.53604400 0.14281600 0.32558200 1.0 Fe Fe40 1 0.03604400 0.35718400 0.17441800 1.0 Fe Fe41 1 0.27482400 0.06409300 0.61996600 1.0 Fe Fe42 1 0.59677600 0.40322400 0.70139400 1.0 Fe Fe43 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe44 1 0.06409300 0.27482400 0.38003400 1.0 Fe Fe45 1 0.31581300 0.31581300 0.24540800 1.0 Fe Fe46 1 0.00000000 0.00000000 0.39160200 1.0 Fe Fe47 1 0.18418700 0.81581300 0.74540800 1.0 Fe Fe48 1 0.50000000 0.50000000 0.89160200 1.0 Fe Fe49 1 0.43590700 0.77482400 0.11996600 1.0 Fe Fe50 1 0.09677600 0.09677600 0.20139400 1.0 Fe Fe51 1 0.46395600 0.85718400 0.67441800 1.0 Fe Fe52 1 0.81581300 0.18418700 0.74540800 1.0 Fe Fe53 1 0.96395600 0.64281600 0.82558200 1.0 Fe Fe54 1 0.31581300 0.31581300 0.75459200 1.0 Fe Fe55 1 0.85718400 0.46395600 0.32558200 1.0 Fe Fe56 1 0.77482400 0.43590700 0.11996600 1.0 Fe Fe57 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe58 1 0.03604400 0.35718400 0.82558200 1.0 Fe Fe59 1 0.59677600 0.40322400 0.29860600 1.0 Fe Fe60 1 0.43590700 0.77482400 0.88003400 1.0 Fe Fe61 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe62 1 0.50000000 0.50000000 0.10839800 1.0 Fe Fe63 1 0.00000000 0.50000000 0.50000000 1.0 C C64 1 0.12804500 0.12804500 0.50000000 1.0 C C65 1 0.87195500 0.87195500 0.50000000 1.0 C C66 1 0.37195500 0.62804500 0.00000000 1.0 C C67 1 0.62804500 0.37195500 0.00000000 1.0