# generated using pymatgen data_Nd3Pa(Al3Rh)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.57060080 _cell_length_b 7.56478298 _cell_length_c 9.47468146 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.34726061 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3Pa(Al3Rh)6 _chemical_formula_sum 'Nd3 Pa1 Al18 Rh6' _cell_volume 472.97828133 _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 0.00564701 0.32870689 0.25000000 1.0 Nd Nd1 1 0.67196767 0.99387361 0.75000000 1.0 Nd Nd2 1 0.32898247 0.00521915 0.25000000 1.0 Pa Pa3 1 0.99636763 0.67283078 0.75000000 1.0 Al Al4 1 0.13492196 0.13107999 0.75000000 1.0 Al Al5 1 0.86870854 0.86925587 0.25000000 1.0 Al Al6 1 0.00279220 0.33492047 0.57491423 1.0 Al Al7 1 0.99599143 0.66407781 0.42632338 1.0 Al Al8 1 0.99599143 0.66407781 0.07367662 1.0 Al Al9 1 0.33739131 0.00434756 0.92505526 1.0 Al Al10 1 0.00279220 0.33492047 0.92508577 1.0 Al Al11 1 0.66452692 0.99687885 0.07307250 1.0 Al Al12 1 0.66452692 0.99687885 0.42692750 1.0 Al Al13 1 0.33739131 0.00434756 0.57494474 1.0 Al Al14 1 0.33421109 0.33435266 0.04511030 1.0 Al Al15 1 0.66423538 0.66470528 0.95337051 1.0 Al Al16 1 0.66423538 0.66470528 0.54662949 1.0 Al Al17 1 0.33421109 0.33435266 0.45488970 1.0 Al Al18 1 0.33641756 0.54586028 0.75000000 1.0 Al Al19 1 0.65882756 0.45150918 0.25000000 1.0 Al Al20 1 0.55016839 0.34641987 0.75000000 1.0 Al Al21 1 0.45217125 0.65946292 0.25000000 1.0 Rh Rh22 1 0.67375744 0.33076814 0.50295235 1.0 Rh Rh23 1 0.32597086 0.67168733 0.50334124 1.0 Rh Rh24 1 0.32597086 0.67168733 0.99665876 1.0 Rh Rh25 1 0.67375744 0.33076814 0.99704765 1.0 Rh Rh26 1 0.99903534 0.99615263 0.50419756 1.0 Rh Rh27 1 0.99903534 0.99615263 0.99580244 1.0