# generated using pymatgen data_Nd(PPd3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.46211175 _cell_length_b 8.46211175 _cell_length_c 8.46211175 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd(PPd3)2 _chemical_formula_sum 'Nd4 P8 Pd24' _cell_volume 605.94927322 _cell_formula_units_Z 4 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 0.50000000 0.00000000 1.0 Nd Nd1 1 0.50000000 0.00000000 0.50000000 1.0 Nd Nd2 1 0.00000000 0.50000000 0.50000000 1.0 Nd Nd3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.80771911 0.30771911 0.19228089 1.0 P P5 1 0.19228089 0.80771911 0.30771911 1.0 P P6 1 0.69228089 0.69228089 0.69228089 1.0 P P7 1 0.30771911 0.19228089 0.80771911 1.0 P P8 1 0.19228089 0.69228089 0.80771911 1.0 P P9 1 0.80771911 0.19228089 0.69228089 1.0 P P10 1 0.30771911 0.30771911 0.30771911 1.0 P P11 1 0.69228089 0.80771911 0.19228089 1.0 Pd Pd12 1 0.42114092 0.84776505 0.16319025 1.0 Pd Pd13 1 0.57885908 0.34776505 0.33680975 1.0 Pd Pd14 1 0.07885908 0.15223495 0.66319025 1.0 Pd Pd15 1 0.92114092 0.65223495 0.83680975 1.0 Pd Pd16 1 0.16319025 0.42114092 0.84776505 1.0 Pd Pd17 1 0.33680975 0.57885908 0.34776505 1.0 Pd Pd18 1 0.66319025 0.07885908 0.15223495 1.0 Pd Pd19 1 0.83680975 0.92114092 0.65223495 1.0 Pd Pd20 1 0.84776505 0.16319025 0.42114092 1.0 Pd Pd21 1 0.34776505 0.33680975 0.57885908 1.0 Pd Pd22 1 0.15223495 0.66319025 0.07885908 1.0 Pd Pd23 1 0.65223495 0.83680975 0.92114092 1.0 Pd Pd24 1 0.57885908 0.15223495 0.83680975 1.0 Pd Pd25 1 0.42114092 0.65223495 0.66319025 1.0 Pd Pd26 1 0.92114092 0.84776505 0.33680975 1.0 Pd Pd27 1 0.07885908 0.34776505 0.16319025 1.0 Pd Pd28 1 0.83680975 0.57885908 0.15223495 1.0 Pd Pd29 1 0.66319025 0.42114092 0.65223495 1.0 Pd Pd30 1 0.33680975 0.92114092 0.84776505 1.0 Pd Pd31 1 0.16319025 0.07885908 0.34776505 1.0 Pd Pd32 1 0.15223495 0.83680975 0.57885908 1.0 Pd Pd33 1 0.65223495 0.66319025 0.42114092 1.0 Pd Pd34 1 0.84776505 0.33680975 0.92114092 1.0 Pd Pd35 1 0.34776505 0.16319025 0.07885908 1.0