# generated using pymatgen data_Lu3Cu11Si4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.32074564 _cell_length_b 8.32074564 _cell_length_c 8.52001700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999715 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu3Cu11Si4 _chemical_formula_sum 'Lu6 Cu22 Si8' _cell_volume 510.85258793 _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 0.80100000 0.19900000 0.75000000 1.0 Lu Lu1 1 0.19900000 0.80100000 0.25000000 1.0 Lu Lu2 1 0.39800100 0.19900000 0.75000000 1.0 Lu Lu3 1 0.60199900 0.80100000 0.25000000 1.0 Lu Lu4 1 0.80100000 0.60199900 0.75000000 1.0 Lu Lu5 1 0.19900000 0.39800100 0.25000000 1.0 Cu Cu6 1 0.43556000 0.56444000 0.75000000 1.0 Cu Cu7 1 0.56444000 0.43556000 0.25000000 1.0 Cu Cu8 1 0.12888000 0.56444000 0.75000000 1.0 Cu Cu9 1 0.87112000 0.43556000 0.25000000 1.0 Cu Cu10 1 0.43556000 0.87112000 0.75000000 1.0 Cu Cu11 1 0.56444000 0.12888000 0.25000000 1.0 Cu Cu12 1 0.84879800 0.15120200 0.40974900 1.0 Cu Cu13 1 0.15120200 0.84879800 0.59025100 1.0 Cu Cu14 1 0.30240300 0.15120200 0.40974900 1.0 Cu Cu15 1 0.15120200 0.84879800 0.90974900 1.0 Cu Cu16 1 0.69759700 0.84879800 0.59025100 1.0 Cu Cu17 1 0.84879800 0.15120200 0.09025100 1.0 Cu Cu18 1 0.84879800 0.69759700 0.40974900 1.0 Cu Cu19 1 0.69759700 0.84879800 0.90974900 1.0 Cu Cu20 1 0.15120200 0.30240300 0.59025100 1.0 Cu Cu21 1 0.30240300 0.15120200 0.09025100 1.0 Cu Cu22 1 0.15120200 0.30240300 0.90974900 1.0 Cu Cu23 1 0.84879800 0.69759700 0.09025100 1.0 Cu Cu24 1 0.66666700 0.33333300 0.00468500 1.0 Cu Cu25 1 0.33333300 0.66666700 0.99531500 1.0 Cu Cu26 1 0.33333300 0.66666700 0.50468500 1.0 Cu Cu27 1 0.66666700 0.33333300 0.49531500 1.0 Si Si28 1 0.50000000 0.50000000 0.00000000 1.0 Si Si29 1 0.00000000 0.50000000 0.00000000 1.0 Si Si30 1 0.50000000 0.50000000 0.50000000 1.0 Si Si31 1 0.50000000 0.00000000 0.00000000 1.0 Si Si32 1 0.00000000 0.50000000 0.50000000 1.0 Si Si33 1 0.50000000 0.00000000 0.50000000 1.0 Si Si34 1 0.00000000 0.00000000 0.75000000 1.0 Si Si35 1 0.00000000 0.00000000 0.25000000 1.0