# generated using pymatgen data_NdAsO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.60696415 _cell_length_b 7.60696415 _cell_length_c 7.60696415 _cell_angle_alpha 128.49397060 _cell_angle_beta 128.49397060 _cell_angle_gamma 75.82617055 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdAsO2 _chemical_formula_sum 'Nd4 As4 O8' _cell_volume 262.24367240 _cell_formula_units_Z 4 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 0.87500000 0.62500000 0.25000000 1.0 Nd Nd1 1 0.37500000 0.62500000 0.75000000 1.0 Nd Nd2 1 0.37500000 0.62500000 0.25000000 1.0 Nd Nd3 1 0.37500000 0.12500000 0.75000000 1.0 As As4 1 0.37500000 0.12500000 0.25000000 1.0 As As5 1 0.87500000 0.12500000 0.75000000 1.0 As As6 1 0.87500000 0.12500000 0.25000000 1.0 As As7 1 0.87500000 0.62500000 0.75000000 1.0 O O8 1 0.17187800 0.41620400 0.24432700 1.0 O O9 1 0.17187800 0.92755100 0.75567300 1.0 O O10 1 0.16620400 0.42187800 0.74432700 1.0 O O11 1 0.57812200 0.83379600 0.25567300 1.0 O O12 1 0.67755100 0.42187800 0.25567300 1.0 O O13 1 0.57812200 0.32244900 0.74432700 1.0 O O14 1 0.58379600 0.82812200 0.75567300 1.0 O O15 1 0.07244900 0.82812200 0.24432700 1.0