# generated using pymatgen data_Nd2Ni3H3Pd14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.85281599 _cell_length_b 6.85281605 _cell_length_c 6.85281613 _cell_angle_alpha 82.94803143 _cell_angle_beta 82.94804124 _cell_angle_gamma 82.94803960 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Ni3H3Pd14 _chemical_formula_sum 'Nd2 Ni3 H3 Pd14' _cell_volume 315.06460709 _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 0.66561461 0.66561461 0.66561461 1.0 Nd Nd1 1 0.33438539 0.33438539 0.33438539 1.0 Ni Ni2 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni3 1 0.50000000 0.00000000 0.00000000 1.0 Ni Ni4 1 0.00000000 0.50000000 0.00000000 1.0 H H5 1 0.50000000 0.50000000 0.00000000 1.0 H H6 1 0.00000000 0.50000000 0.50000000 1.0 H H7 1 0.50000000 0.00000000 0.50000000 1.0 Pd Pd8 1 0.70530814 0.29469186 1.00000000 1.0 Pd Pd9 1 0.00000000 0.70530814 0.29469186 1.0 Pd Pd10 1 0.29469186 0.00000000 0.70530814 1.0 Pd Pd11 1 1.00000000 0.29469186 0.70530814 1.0 Pd Pd12 1 0.70530814 1.00000000 0.29469186 1.0 Pd Pd13 1 0.29469186 0.70530814 0.00000000 1.0 Pd Pd14 1 0.34496170 0.34496170 0.85820662 1.0 Pd Pd15 1 0.85820662 0.34496170 0.34496170 1.0 Pd Pd16 1 0.34496170 0.85820662 0.34496170 1.0 Pd Pd17 1 0.65503830 0.65503830 0.14179338 1.0 Pd Pd18 1 0.14179338 0.65503830 0.65503830 1.0 Pd Pd19 1 0.65503830 0.14179338 0.65503830 1.0 Pd Pd20 1 0.89804225 0.89804225 0.89804225 1.0 Pd Pd21 1 0.10195775 0.10195775 0.10195775 1.0