# generated using pymatgen data_Nd3Th7(Pb3C)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.45497472 _cell_length_b 9.45497491 _cell_length_c 6.61008585 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000623 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3Th7(Pb3C)2 _chemical_formula_sum 'Nd3 Th7 Pb6 C2' _cell_volume 511.75071389 _cell_formula_units_Z 1 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 Nd Nd0 1 0.33333300 0.66666700 0.00000000 1.0 Nd Nd1 1 0.33333300 0.66666700 0.50000000 1.0 Nd Nd2 1 0.66666700 0.33333300 0.50000000 1.0 Th Th3 1 0.66666700 0.33333300 0.00000000 1.0 Th Th4 1 0.78175836 0.78105143 0.75014311 1.0 Th Th5 1 0.21894857 0.00070693 0.75014311 1.0 Th Th6 1 0.99929307 0.21824164 0.75014311 1.0 Th Th7 1 0.21894857 0.21824164 0.24985689 1.0 Th Th8 1 0.78175836 0.00070693 0.24985689 1.0 Th Th9 1 0.99929307 0.78105143 0.24985689 1.0 Pb Pb10 1 0.40002828 0.40125946 0.74923975 1.0 Pb Pb11 1 0.59874054 0.99876982 0.74923975 1.0 Pb Pb12 1 0.00123018 0.59997172 0.74923975 1.0 Pb Pb13 1 0.59874054 0.59997172 0.25076025 1.0 Pb Pb14 1 0.40002828 0.99876982 0.25076025 1.0 Pb Pb15 1 0.00123018 0.40125946 0.25076025 1.0 C C16 1 0.00000000 0.00000000 0.00000000 1.0 C C17 1 0.00000000 0.00000000 0.50000000 1.0