# generated using pymatgen data_Y3Th2Pb3C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.18142187 _cell_length_b 9.18142285 _cell_length_c 6.62390817 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.64531643 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3Th2Pb3C _chemical_formula_sum 'Y6 Th4 Pb6 C2' _cell_volume 485.29518002 _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 Y Y0 1 0.78003508 0.78003508 0.25000000 1.0 Y Y1 1 0.21996492 0.21996492 0.75000000 1.0 Y Y2 1 0.33260515 0.66739485 0.00000000 1.0 Y Y3 1 0.66739485 0.33260515 0.00000000 1.0 Y Y4 1 0.66739485 0.33260515 0.50000000 1.0 Y Y5 1 0.33260515 0.66739485 0.50000000 1.0 Th Th6 1 0.21722269 0.99976939 0.25000000 1.0 Th Th7 1 0.78277731 0.00023061 0.75000000 1.0 Th Th8 1 0.99976939 0.21722269 0.25000000 1.0 Th Th9 1 0.00023061 0.78277731 0.75000000 1.0 Pb Pb10 1 0.59503734 0.99652872 0.25000000 1.0 Pb Pb11 1 0.40496266 0.00347128 0.75000000 1.0 Pb Pb12 1 0.99652872 0.59503734 0.25000000 1.0 Pb Pb13 1 0.00347128 0.40496266 0.75000000 1.0 Pb Pb14 1 0.40936995 0.40936995 0.25000000 1.0 Pb Pb15 1 0.59063005 0.59063005 0.75000000 1.0 C C16 1 0.00000000 0.00000000 0.00000000 1.0 C C17 1 0.00000000 0.00000000 0.50000000 1.0