# generated using pymatgen data_NdYP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.38164860 _cell_length_b 9.38164734 _cell_length_c 3.94595504 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999754 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdYP7Ru12 _chemical_formula_sum 'Nd1 Y1 P7 Ru12' _cell_volume 300.77451842 _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 0.33333300 0.66666700 0.00000000 1.0 Y Y1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.60490312 0.71738832 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28261168 0.88751481 0.50000000 1.0 P P5 1 0.11248519 0.39509688 0.50000000 1.0 P P6 1 0.88757288 0.57453174 0.00000000 1.0 P P7 1 0.42546826 0.31304214 0.00000000 1.0 P P8 1 0.68695786 0.11242712 0.00000000 1.0 Ru Ru9 1 0.55977626 0.95349774 0.50000000 1.0 Ru Ru10 1 0.39372348 0.44022374 0.50000000 1.0 Ru Ru11 1 0.91433042 0.11983783 0.50000000 1.0 Ru Ru12 1 0.20550741 0.08566958 0.50000000 1.0 Ru Ru13 1 0.88016217 0.79449259 0.50000000 1.0 Ru Ru14 1 0.72927627 0.89156180 0.00000000 1.0 Ru Ru15 1 0.10843820 0.83771347 0.00000000 1.0 Ru Ru16 1 0.16228653 0.27072373 0.00000000 1.0 Ru Ru17 1 0.42312088 0.06812366 0.00000000 1.0 Ru Ru18 1 0.93187634 0.35499922 0.00000000 1.0 Ru Ru19 1 0.64500078 0.57687912 0.00000000 1.0 Ru Ru20 1 0.04650226 0.60627652 0.50000000 1.0