# generated using pymatgen data_Nd2H3Pd17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.95980391 _cell_length_b 6.95980311 _cell_length_c 6.95980457 _cell_angle_alpha 82.62256925 _cell_angle_beta 82.62256773 _cell_angle_gamma 82.62256574 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2H3Pd17 _chemical_formula_sum 'Nd2 H3 Pd17' _cell_volume 329.41285907 _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 0.66953954 0.66953954 0.66953954 1.0 Nd Nd1 1 0.33046046 0.33046046 0.33046046 1.0 H H2 1 0.50000000 0.50000000 0.00000000 1.0 H H3 1 0.00000000 0.50000000 0.50000000 1.0 H H4 1 0.50000000 0.00000000 0.50000000 1.0 Pd Pd5 1 0.00000000 0.00000000 0.50000000 1.0 Pd Pd6 1 0.50000000 0.00000000 0.00000000 1.0 Pd Pd7 1 0.00000000 0.50000000 0.00000000 1.0 Pd Pd8 1 0.70108917 0.29891083 0.00000000 1.0 Pd Pd9 1 0.00000000 0.70108917 0.29891083 1.0 Pd Pd10 1 0.29891083 1.00000000 0.70108917 1.0 Pd Pd11 1 1.00000000 0.29891083 0.70108917 1.0 Pd Pd12 1 0.70108917 0.00000000 0.29891083 1.0 Pd Pd13 1 0.29891083 0.70108917 1.00000000 1.0 Pd Pd14 1 0.34904123 0.34904123 0.84398369 1.0 Pd Pd15 1 0.84398369 0.34904123 0.34904123 1.0 Pd Pd16 1 0.34904123 0.84398369 0.34904123 1.0 Pd Pd17 1 0.65095877 0.65095877 0.15601631 1.0 Pd Pd18 1 0.15601631 0.65095877 0.65095877 1.0 Pd Pd19 1 0.65095877 0.15601631 0.65095877 1.0 Pd Pd20 1 0.89922857 0.89922857 0.89922857 1.0 Pd Pd21 1 0.10077143 0.10077143 0.10077143 1.0