# CIF generated by HEAS from Alexandria entry agm005199532 data_agm005199532 _cell_length_a 4.20083 _cell_length_b 4.20083 _cell_length_c 7.22301 _cell_angle_alpha 73.09444 _cell_angle_beta 73.09444 _cell_angle_gamma 60.00000 _cell_volume 103.97826 _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 Ca1 Ca 0.49993 0.49993 0.50020 1.00000 Nd1 Nd 0.99868 0.99868 0.00396 1.00000 As1 As 0.25132 0.25132 0.24603 1.00000 S1 S 0.75006 0.75006 0.74981 1.00000