# CIF generated by HEAS from Alexandria entry agm005570026 data_agm005570026 _cell_length_a 6.68033 _cell_length_b 6.51662 _cell_length_c 6.51662 _cell_angle_alpha 83.34462 _cell_angle_beta 89.97128 _cell_angle_gamma 89.97126 _cell_volume 281.77736 _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 0.50000 0.73653 0.26347 1.00000 Ca2 Ca 0.50000 0.26347 0.73653 1.00000 Pa1 Pa 0.00010 0.72600 0.72600 1.00000 Pa2 Pa 0.99990 0.27400 0.27400 1.00000 S1 S 0.24908 0.99997 0.50015 1.00000 S2 S 0.75092 0.49985 0.00003 1.00000 S3 S 0.75092 0.00003 0.49985 1.00000 S4 S 0.24908 0.50015 0.99997 1.00000 S5 S 0.00000 0.00000 0.00000 1.00000 S6 S 0.76607 0.50015 0.50015 1.00000 S7 S 0.23393 0.49985 0.49985 1.00000