# generated using pymatgen data_NdTh9O20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.86169773 _cell_length_b 7.91996146 _cell_length_c 8.86124726 _cell_angle_alpha 102.93349197 _cell_angle_beta 97.41586658 _cell_angle_gamma 106.79143719 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdTh9O20 _chemical_formula_sum 'Nd1 Th9 O20' _cell_volume 439.53907003 _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 0.00000000 1.0 Th Th1 1 0.79993043 0.59978167 0.60160162 1.0 Th Th2 1 0.60236455 0.20122625 0.19938787 1.0 Th Th3 1 0.80061879 0.10116366 0.60156310 1.0 Th Th4 1 0.39763545 0.79877375 0.80061213 1.0 Th Th5 1 0.59981105 0.69887189 0.19876360 1.0 Th Th6 1 0.20006957 0.40021833 0.39839838 1.0 Th Th7 1 0.40018895 0.30112811 0.80123640 1.0 Th Th8 1 -0.00000000 -0.00000000 0.00000000 1.0 Th Th9 1 0.19938121 0.89883634 0.39843690 1.0 O O10 1 0.64892289 0.92507293 0.04940207 1.0 O O11 1 0.44896350 0.52518957 0.64914597 1.0 O O12 1 0.64456292 0.42332109 0.05134201 1.0 O O13 1 0.74511487 0.37264369 0.74552378 1.0 O O14 1 0.25254388 0.12541000 0.24986460 1.0 O O15 1 0.44895632 0.02385117 0.64984631 1.0 O O16 1 0.05036507 0.72908624 0.84729800 1.0 O O17 1 0.55104368 0.97614883 0.35015369 1.0 O O18 1 0.74745612 0.87459000 0.75013540 1.0 O O19 1 0.25488513 0.62735631 0.25447622 1.0 O O20 1 0.35543708 0.57667891 0.94865799 1.0 O O21 1 0.85135934 0.32584283 0.45073554 1.0 O O22 1 0.05096548 0.21962241 0.84701665 1.0 O O23 1 0.55103650 0.47481043 0.35085403 1.0 O O24 1 0.14982374 0.17510167 0.54869656 1.0 O O25 1 0.35107711 0.07492707 0.95059793 1.0 O O26 1 0.85017626 0.82489833 0.45130344 1.0 O O27 1 0.94903452 0.78037759 0.15298335 1.0 O O28 1 0.14864066 0.67415717 0.54926446 1.0 O O29 1 0.94963493 0.27091376 0.15270200 1.0