# generated using pymatgen data_Nd6YP12Rh17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.98475228 _cell_length_b 11.25656380 _cell_length_c 12.95804247 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6YP12Rh17 _chemical_formula_sum 'Nd6 Y1 P12 Rh17' _cell_volume 581.22804807 _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 0.00000000 0.50000000 0.52377959 1.0 Nd Nd1 1 0.50000000 0.00000000 0.47783828 1.0 Nd Nd2 1 0.50000000 0.81913823 0.20712908 1.0 Nd Nd3 1 0.50000000 0.18086177 0.20712908 1.0 Nd Nd4 1 0.00000000 0.68223747 0.79533422 1.0 Nd Nd5 1 0.00000000 0.31776253 0.79533422 1.0 Y Y6 1 0.50000000 0.50000000 0.15510608 1.0 P P7 1 0.50000000 0.50000000 0.87980594 1.0 P P8 1 0.00000000 0.00000000 0.11634391 1.0 P P9 1 0.50000000 0.50000000 0.36162244 1.0 P P10 1 0.00000000 0.00000000 0.65191255 1.0 P P11 1 0.50000000 0.31067330 0.61877794 1.0 P P12 1 0.50000000 0.68932670 0.61877794 1.0 P P13 1 0.00000000 0.18898831 0.38641070 1.0 P P14 1 0.00000000 0.81101169 0.38641070 1.0 P P15 1 0.50000000 0.85173504 0.88875622 1.0 P P16 1 0.50000000 0.14826496 0.88875622 1.0 P P17 1 0.00000000 0.66411679 0.10134497 1.0 P P18 1 0.00000000 0.33588321 0.10134497 1.0 Rh Rh19 1 0.00000000 0.00000000 0.82829701 1.0 Rh Rh20 1 0.50000000 0.50000000 0.70159763 1.0 Rh Rh21 1 0.00000000 0.00000000 0.29645030 1.0 Rh Rh22 1 0.00000000 0.50000000 0.98318212 1.0 Rh Rh23 1 0.50000000 0.00000000 0.01576605 1.0 Rh Rh24 1 0.50000000 0.32703526 0.98565101 1.0 Rh Rh25 1 0.50000000 0.67296474 0.98565101 1.0 Rh Rh26 1 0.00000000 0.16202595 0.00369996 1.0 Rh Rh27 1 0.00000000 0.83797405 0.00369996 1.0 Rh Rh28 1 0.50000000 0.28773862 0.43676855 1.0 Rh Rh29 1 0.50000000 0.71226138 0.43676855 1.0 Rh Rh30 1 0.00000000 0.20034456 0.57215465 1.0 Rh Rh31 1 0.00000000 0.79965544 0.57215465 1.0 Rh Rh32 1 0.50000000 0.87674992 0.71001642 1.0 Rh Rh33 1 0.50000000 0.12325008 0.71001642 1.0 Rh Rh34 1 0.00000000 0.62667987 0.29810583 1.0 Rh Rh35 1 0.00000000 0.37332013 0.29810583 1.0