# CIF generated by HEAS from Alexandria entry agm005113702 data_agm005113702 _cell_length_a 3.53306 _cell_length_b 3.53306 _cell_length_c 7.14595 _cell_angle_alpha 75.68768 _cell_angle_beta 75.68768 _cell_angle_gamma 60.00000 _cell_volume 74.03498 _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 Pa1 Pa 0.09082 0.09082 0.72753 1.00000 Pa2 Pa 0.24264 0.24264 0.27208 1.00000 C1 C 0.49967 0.49967 0.50100 1.00000 S1 S 0.66687 0.66687 0.99939 1.00000