# CIF generated by HEAS from Alexandria entry agm005676871 data_agm005676871 _cell_length_a 3.96888 _cell_length_b 4.24974 _cell_length_c 9.33142 _cell_angle_alpha 117.08898 _cell_angle_beta 73.06496 _cell_angle_gamma 122.37385 _cell_volume 118.10948 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Nd1 Nd 0.62477 0.99066 0.67831 1.00000 Nd2 Nd 0.37523 0.00934 0.32169 1.00000 S1 S 0.85788 0.82198 0.89307 1.00000 S2 S 0.14212 0.17802 0.10693 1.00000 O1 O 0.66505 0.72566 0.39307 1.00000 O2 O 0.33495 0.27434 0.60693 1.00000