# generated using pymatgen data_NdPa3(Al3Rh)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.58927550 _cell_length_b 7.58494901 _cell_length_c 9.36714976 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.42674108 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdPa3(Al3Rh)6 _chemical_formula_sum 'Nd1 Pa3 Al18 Rh6' _cell_volume 469.64632141 _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 0.32783470 0.00559824 0.25000000 1.0 Pa Pa1 1 0.99672967 0.67697468 0.75000000 1.0 Pa Pa2 1 0.99945600 0.32340707 0.25000000 1.0 Pa Pa3 1 0.67859287 0.99871877 0.75000000 1.0 Al Al4 1 0.13534305 0.13584269 0.75000000 1.0 Al Al5 1 0.86780477 0.86884658 0.25000000 1.0 Al Al6 1 0.00397684 0.33713785 0.57451541 1.0 Al Al7 1 0.99759961 0.66439360 0.42665450 1.0 Al Al8 1 0.99759961 0.66439360 0.07334550 1.0 Al Al9 1 0.33646970 0.00272318 0.92383864 1.0 Al Al10 1 0.00397684 0.33713785 0.92548459 1.0 Al Al11 1 0.66253422 0.99569694 0.07506247 1.0 Al Al12 1 0.66253422 0.99569694 0.42493753 1.0 Al Al13 1 0.33646970 0.00272318 0.57616136 1.0 Al Al14 1 0.33367812 0.33333079 0.04639062 1.0 Al Al15 1 0.66380135 0.66389686 0.95550280 1.0 Al Al16 1 0.66380135 0.66389686 0.54449720 1.0 Al Al17 1 0.33367812 0.33333079 0.45360938 1.0 Al Al18 1 0.34432343 0.55124491 0.75000000 1.0 Al Al19 1 0.66042013 0.45232925 0.25000000 1.0 Al Al20 1 0.54972036 0.34323744 0.75000000 1.0 Al Al21 1 0.44741298 0.65376950 0.25000000 1.0 Rh Rh22 1 0.67346104 0.32778528 0.50173254 1.0 Rh Rh23 1 0.32737944 0.67140020 0.50189064 1.0 Rh Rh24 1 0.32737944 0.67140020 0.99810936 1.0 Rh Rh25 1 0.67346104 0.32778528 0.99826746 1.0 Rh Rh26 1 0.99728221 0.99865072 0.50307641 1.0 Rh Rh27 1 0.99728221 0.99865072 0.99692359 1.0