# generated using pymatgen data_Nd3Tc(P3Rh4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.95647013 _cell_length_b 11.15955651 _cell_length_c 12.85109873 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3Tc(P3Rh4)2 _chemical_formula_sum 'Nd6 Tc2 P12 Rh16' _cell_volume 567.40751909 _cell_formula_units_Z 2 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 0.52066615 1.0 Nd Nd1 1 0.50000000 0.00000000 0.47933385 1.0 Nd Nd2 1 0.50000000 0.81622120 0.20498282 1.0 Nd Nd3 1 0.50000000 0.18377880 0.20498282 1.0 Nd Nd4 1 0.00000000 0.68377880 0.79501718 1.0 Nd Nd5 1 0.00000000 0.31622120 0.79501718 1.0 Tc Tc6 1 0.50000000 0.50000000 0.16011169 1.0 Tc Tc7 1 0.00000000 0.00000000 0.83988831 1.0 P P8 1 0.50000000 0.50000000 0.88074812 1.0 P P9 1 0.00000000 0.00000000 0.11925188 1.0 P P10 1 0.50000000 0.50000000 0.34228138 1.0 P P11 1 0.00000000 0.00000000 0.65771862 1.0 P P12 1 0.50000000 0.31208381 0.61682116 1.0 P P13 1 0.50000000 0.68791619 0.61682116 1.0 P P14 1 0.00000000 0.18791619 0.38317884 1.0 P P15 1 0.00000000 0.81208381 0.38317884 1.0 P P16 1 0.50000000 0.84935684 0.89037156 1.0 P P17 1 0.50000000 0.15064316 0.89037156 1.0 P P18 1 0.00000000 0.65064316 0.10962844 1.0 P P19 1 0.00000000 0.34935684 0.10962844 1.0 Rh Rh20 1 0.50000000 0.50000000 0.70166866 1.0 Rh Rh21 1 0.00000000 0.00000000 0.29833134 1.0 Rh Rh22 1 0.00000000 0.50000000 0.98953954 1.0 Rh Rh23 1 0.50000000 0.00000000 0.01046046 1.0 Rh Rh24 1 0.50000000 0.33166018 0.98715431 1.0 Rh Rh25 1 0.50000000 0.66833982 0.98715431 1.0 Rh Rh26 1 0.00000000 0.16833982 0.01284569 1.0 Rh Rh27 1 0.00000000 0.83166018 0.01284569 1.0 Rh Rh28 1 0.50000000 0.29382013 0.43084272 1.0 Rh Rh29 1 0.50000000 0.70617987 0.43084272 1.0 Rh Rh30 1 0.00000000 0.20617987 0.56915728 1.0 Rh Rh31 1 0.00000000 0.79382013 0.56915728 1.0 Rh Rh32 1 0.50000000 0.87717202 0.71052775 1.0 Rh Rh33 1 0.50000000 0.12282798 0.71052775 1.0 Rh Rh34 1 0.00000000 0.62282798 0.28947225 1.0 Rh Rh35 1 0.00000000 0.37717202 0.28947225 1.0