# generated using pymatgen data_LuCo4ReP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.67065274 _cell_length_b 10.20069574 _cell_length_c 11.66205439 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuCo4ReP3 _chemical_formula_sum 'Lu4 Co16 Re4 P12' _cell_volume 436.66477194 _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 0.25000000 0.58292895 0.70494656 1.0 Lu Lu1 1 0.25000000 0.91707105 0.20494656 1.0 Lu Lu2 1 0.75000000 0.41707105 0.29505344 1.0 Lu Lu3 1 0.75000000 0.08292895 0.79505344 1.0 Co Co4 1 0.25000000 0.40675514 0.48685261 1.0 Co Co5 1 0.25000000 0.09324486 0.98685261 1.0 Co Co6 1 0.75000000 0.59324486 0.51314739 1.0 Co Co7 1 0.75000000 0.90675514 0.01314739 1.0 Co Co8 1 0.25000000 0.22280990 0.17532392 1.0 Co Co9 1 0.25000000 0.27719010 0.67532392 1.0 Co Co10 1 0.75000000 0.77719010 0.82467608 1.0 Co Co11 1 0.75000000 0.72280990 0.32467608 1.0 Co Co12 1 0.25000000 0.88521874 0.70304539 1.0 Co Co13 1 0.25000000 0.61478126 0.20304539 1.0 Co Co14 1 0.75000000 0.11478126 0.29695461 1.0 Co Co15 1 0.75000000 0.38521874 0.79695461 1.0 Co Co16 1 0.25000000 0.46344051 0.93164712 1.0 Co Co17 1 0.25000000 0.03655949 0.43164712 1.0 Co Co18 1 0.75000000 0.53655949 0.06835288 1.0 Co Co19 1 0.75000000 0.96344051 0.56835288 1.0 Re Re20 1 0.25000000 0.71106408 0.99018060 1.0 Re Re21 1 0.25000000 0.78893592 0.49018060 1.0 Re Re22 1 0.75000000 0.28893592 0.00981940 1.0 Re Re23 1 0.75000000 0.21106408 0.50981940 1.0 P P24 1 0.25000000 0.42122421 0.11459942 1.0 P P25 1 0.25000000 0.07877579 0.61459942 1.0 P P26 1 0.75000000 0.57877579 0.88540058 1.0 P P27 1 0.75000000 0.92122421 0.38540058 1.0 P P28 1 0.25000000 0.26806023 0.86353314 1.0 P P29 1 0.25000000 0.23193977 0.36353314 1.0 P P30 1 0.75000000 0.73193977 0.13646686 1.0 P P31 1 0.75000000 0.76806023 0.63646686 1.0 P P32 1 0.25000000 0.59499861 0.39006513 1.0 P P33 1 0.25000000 0.90500139 0.89006513 1.0 P P34 1 0.75000000 0.40500139 0.60993487 1.0 P P35 1 0.75000000 0.09499861 0.10993487 1.0