# generated using pymatgen data_Nd9(BiO)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.33633011 _cell_length_b 10.33633011 _cell_length_c 9.29218116 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd9(BiO)5 _chemical_formula_sum 'Nd18 Bi10 O10' _cell_volume 992.77403520 _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 0.50000000 0.00000000 0.67245344 1.0 Nd Nd1 1 0.00000000 0.50000000 0.32754656 1.0 Nd Nd2 1 0.10435614 0.20520417 0.65993220 1.0 Nd Nd3 1 0.89564386 0.79479583 0.65993220 1.0 Nd Nd4 1 0.29479583 0.60435614 0.65993220 1.0 Nd Nd5 1 0.70520417 0.39564386 0.65993220 1.0 Nd Nd6 1 0.39564386 0.29479583 0.34006780 1.0 Nd Nd7 1 0.60435614 0.70520417 0.34006780 1.0 Nd Nd8 1 0.20520417 0.89564386 0.34006780 1.0 Nd Nd9 1 0.79479583 0.10435614 0.34006780 1.0 Nd Nd10 1 0.72606096 0.91791951 0.00136862 1.0 Nd Nd11 1 0.27393904 0.08208049 0.00136862 1.0 Nd Nd12 1 0.58208049 0.22606096 0.00136862 1.0 Nd Nd13 1 0.41791951 0.77393904 0.00136862 1.0 Nd Nd14 1 0.77393904 0.58208049 0.99863138 1.0 Nd Nd15 1 0.22606096 0.41791951 0.99863138 1.0 Nd Nd16 1 0.91791951 0.27393904 0.99863138 1.0 Nd Nd17 1 0.08208049 0.72606096 0.99863138 1.0 Bi Bi18 1 0.50000000 0.00000000 0.31354706 1.0 Bi Bi19 1 0.00000000 0.50000000 0.68645294 1.0 Bi Bi20 1 0.40381148 0.30432705 0.69959274 1.0 Bi Bi21 1 0.59618852 0.69567295 0.69959274 1.0 Bi Bi22 1 0.19567295 0.90381148 0.69959274 1.0 Bi Bi23 1 0.80432705 0.09618852 0.69959274 1.0 Bi Bi24 1 0.09618852 0.19567295 0.30040726 1.0 Bi Bi25 1 0.90381148 0.80432705 0.30040726 1.0 Bi Bi26 1 0.30432705 0.59618852 0.30040726 1.0 Bi Bi27 1 0.69567295 0.40381148 0.30040726 1.0 O O28 1 0.50000000 0.00000000 0.93388541 1.0 O O29 1 0.00000000 0.50000000 0.06611459 1.0 O O30 1 0.77425335 0.12090497 0.08683764 1.0 O O31 1 0.22574665 0.87909503 0.08683764 1.0 O O32 1 0.37909503 0.27425335 0.08683764 1.0 O O33 1 0.62090497 0.72574665 0.08683764 1.0 O O34 1 0.72574665 0.37909503 0.91316236 1.0 O O35 1 0.27425335 0.62090497 0.91316236 1.0 O O36 1 0.12090497 0.22574665 0.91316236 1.0 O O37 1 0.87909503 0.77425335 0.91316236 1.0