# CIF generated by HEAS from Alexandria entry agm002002102 data_agm002002102 _cell_length_a 3.74806 _cell_length_b 3.74806 _cell_length_c 8.68516 _cell_angle_alpha 77.53908 _cell_angle_beta 77.53908 _cell_angle_gamma 60.00000 _cell_volume 102.33040 _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 As1 As 0.50000 0.50000 0.50000 1.00000 Nd1 Nd 0.00000 0.00000 0.00000 1.00000 S1 S 0.11067 0.11067 0.66798 1.00000 S2 S 0.88933 0.88933 0.33202 1.00000