# CIF generated by HEAS from Alexandria entry agm005238166 data_agm005238166 _cell_length_a 3.91398 _cell_length_b 6.74315 _cell_length_c 13.04643 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 344.32886 _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 0.93634 0.00000 1.00000 Ca2 Ca 0.00000 0.06366 0.50000 1.00000 Fe1 Fe 0.00000 0.49900 0.84367 1.00000 Fe2 Fe 0.50000 0.50100 0.65633 1.00000 Fe3 Fe 0.50000 0.50100 0.34367 1.00000 Fe4 Fe 0.00000 0.49900 0.15633 1.00000 S1 S 0.50000 0.35554 0.50000 1.00000 S2 S 0.00000 0.64446 0.00000 1.00000 S3 S 0.50000 0.67051 0.80484 1.00000 S4 S 0.00000 0.32949 0.69516 1.00000 S5 S 0.50000 0.67051 0.19516 1.00000 S6 S 0.00000 0.32949 0.30484 1.00000 S7 S 0.00000 0.19906 0.08232 1.00000 S8 S 0.50000 0.80094 0.41768 1.00000 S9 S 0.50000 0.80094 0.58232 1.00000 S10 S 0.00000 0.19906 0.91768 1.00000