# generated using pymatgen data_Nd3Th(GePd14)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.94193220 _cell_length_b 8.94193220 _cell_length_c 7.11164793 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3Th(GePd14)2 _chemical_formula_sum 'Nd3 Th1 Ge2 Pd28' _cell_volume 568.63422262 _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 0.50000000 0.00000000 0.93486964 1.0 Nd Nd1 1 0.00000000 0.50000000 0.06513036 1.0 Nd Nd2 1 0.50000000 0.50000000 0.50000000 1.0 Th Th3 1 0.00000000 0.00000000 0.50000000 1.0 Ge Ge4 1 0.50000000 0.00000000 0.45130687 1.0 Ge Ge5 1 0.00000000 0.50000000 0.54869313 1.0 Pd Pd6 1 0.33100207 0.82955932 0.62097106 1.0 Pd Pd7 1 0.33100207 0.17044068 0.62097106 1.0 Pd Pd8 1 0.66899793 0.82955932 0.62097106 1.0 Pd Pd9 1 0.66899793 0.17044068 0.62097106 1.0 Pd Pd10 1 0.17044068 0.66899793 0.37902894 1.0 Pd Pd11 1 0.17044068 0.33100207 0.37902894 1.0 Pd Pd12 1 0.82955932 0.66899793 0.37902894 1.0 Pd Pd13 1 0.82955932 0.33100207 0.37902894 1.0 Pd Pd14 1 0.50000000 0.76772678 0.25354658 1.0 Pd Pd15 1 0.50000000 0.23227322 0.25354658 1.0 Pd Pd16 1 0.26503903 0.00000000 0.25831706 1.0 Pd Pd17 1 0.73496097 0.00000000 0.25831706 1.0 Pd Pd18 1 0.00000000 0.73496097 0.74168294 1.0 Pd Pd19 1 0.00000000 0.26503903 0.74168294 1.0 Pd Pd20 1 0.23227322 0.50000000 0.74645342 1.0 Pd Pd21 1 0.76772678 0.50000000 0.74645342 1.0 Pd Pd22 1 0.50000000 0.34782896 0.85875393 1.0 Pd Pd23 1 0.50000000 0.65217104 0.85875393 1.0 Pd Pd24 1 0.84933602 0.00000000 0.85353029 1.0 Pd Pd25 1 0.15066398 0.00000000 0.85353029 1.0 Pd Pd26 1 0.00000000 0.15066398 0.14646971 1.0 Pd Pd27 1 0.00000000 0.84933602 0.14646971 1.0 Pd Pd28 1 0.65217104 0.50000000 0.14124607 1.0 Pd Pd29 1 0.34782896 0.50000000 0.14124607 1.0 Pd Pd30 1 0.24925997 0.75074003 0.00000000 1.0 Pd Pd31 1 0.24925997 0.24925997 0.00000000 1.0 Pd Pd32 1 0.75074003 0.75074003 0.00000000 1.0 Pd Pd33 1 0.75074003 0.24925997 0.00000000 1.0