# generated using pymatgen data_CaNdGePd14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.92703197 _cell_length_b 8.92703197 _cell_length_c 7.06016541 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaNdGePd14 _chemical_formula_sum 'Ca2 Nd2 Ge2 Pd28' _cell_volume 562.63799419 _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 Ca Ca0 1 0.00000000 0.00000000 0.50000000 1.0 Ca Ca1 1 0.50000000 0.50000000 0.50000000 1.0 Nd Nd2 1 0.50000000 0.00000000 0.93805507 1.0 Nd Nd3 1 0.00000000 0.50000000 0.06194493 1.0 Ge Ge4 1 0.50000000 0.00000000 0.45099676 1.0 Ge Ge5 1 0.00000000 0.50000000 0.54900324 1.0 Pd Pd6 1 0.32990691 0.82990691 0.62202360 1.0 Pd Pd7 1 0.32990691 0.17009309 0.62202360 1.0 Pd Pd8 1 0.67009309 0.82990691 0.62202360 1.0 Pd Pd9 1 0.67009309 0.17009309 0.62202360 1.0 Pd Pd10 1 0.17009309 0.67009309 0.37797640 1.0 Pd Pd11 1 0.17009309 0.32990691 0.37797640 1.0 Pd Pd12 1 0.82990691 0.67009309 0.37797640 1.0 Pd Pd13 1 0.82990691 0.32990691 0.37797640 1.0 Pd Pd14 1 0.50000000 0.76676729 0.25558853 1.0 Pd Pd15 1 0.50000000 0.23323271 0.25558853 1.0 Pd Pd16 1 0.26676729 0.00000000 0.25558853 1.0 Pd Pd17 1 0.73323271 0.00000000 0.25558853 1.0 Pd Pd18 1 0.00000000 0.73323271 0.74441147 1.0 Pd Pd19 1 0.00000000 0.26676729 0.74441147 1.0 Pd Pd20 1 0.23323271 0.50000000 0.74441147 1.0 Pd Pd21 1 0.76676729 0.50000000 0.74441147 1.0 Pd Pd22 1 0.50000000 0.34898790 0.85770013 1.0 Pd Pd23 1 0.50000000 0.65101210 0.85770013 1.0 Pd Pd24 1 0.84898790 0.00000000 0.85770013 1.0 Pd Pd25 1 0.15101210 0.00000000 0.85770013 1.0 Pd Pd26 1 0.00000000 0.15101210 0.14229987 1.0 Pd Pd27 1 0.00000000 0.84898790 0.14229987 1.0 Pd Pd28 1 0.65101210 0.50000000 0.14229987 1.0 Pd Pd29 1 0.34898790 0.50000000 0.14229987 1.0 Pd Pd30 1 0.25000000 0.75000000 0.00000000 1.0 Pd Pd31 1 0.25000000 0.25000000 0.00000000 1.0 Pd Pd32 1 0.75000000 0.75000000 0.00000000 1.0 Pd Pd33 1 0.75000000 0.25000000 0.00000000 1.0