# CIF generated by HEAS from Alexandria entry agm006222004 data_agm006222004 _cell_length_a 6.52182 _cell_length_b 6.60641 _cell_length_c 16.19330 _cell_angle_alpha 97.19078 _cell_angle_beta 75.30970 _cell_angle_gamma 119.57733 _cell_volume 586.94915 _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 Fe1 Fe 0.24813 0.51759 0.83099 1.00000 Fe2 Fe 0.98055 0.98241 0.33099 1.00000 Fe3 Fe 0.87740 0.59347 0.67168 1.00000 Fe4 Fe 0.53393 0.90653 0.17168 1.00000 Fe5 Fe 0.64860 0.92196 0.85017 1.00000 Fe6 Fe 0.97663 0.57804 0.35017 1.00000 Fe7 Fe 0.82676 0.03132 0.68093 1.00000 Fe8 Fe 0.04544 0.46868 0.18093 1.00000 Fe9 Fe 0.30914 0.56456 0.65715 1.00000 Fe10 Fe 0.99457 0.93544 0.15715 1.00000 Fe11 Fe 0.67065 0.50732 0.83728 1.00000 Fe12 Fe 0.41333 0.99268 0.33728 1.00000 Fe13 Fe 0.32673 0.50018 0.47791 1.00000 Fe14 Fe 0.07655 0.99982 0.97791 1.00000 Fe15 Fe 0.45720 0.08169 0.51266 1.00000 Fe16 Fe 0.62551 0.41831 0.01266 1.00000 Fe17 Fe 0.88625 0.07842 0.50098 1.00000 Fe18 Fe 0.05783 0.42158 0.00098 1.00000 Fe19 Fe 0.90289 0.50879 0.51018 1.00000 Fe20 Fe 0.64411 0.99121 0.01018 1.00000 Fe21 Fe 0.27303 0.10928 0.80985 1.00000 Fe22 Fe 0.41375 0.39072 0.30985 1.00000 S1 S 0.73816 0.77404 0.07341 1.00000 S2 S 0.21412 0.72596 0.57341 1.00000 S3 S 0.97820 0.64377 0.91993 1.00000 S4 S 0.58443 0.85623 0.41993 1.00000 S5 S 0.46576 0.40243 0.73029 1.00000 S6 S 0.31333 0.09757 0.23029 1.00000 S7 S 0.19247 0.22068 0.57915 1.00000 S8 S 0.22179 0.27932 0.07915 1.00000 S9 S 0.58204 0.35586 0.41251 1.00000 S10 S 0.47618 0.14414 0.91251 1.00000 S11 S 0.70103 0.72310 0.58590 1.00000 S12 S 0.22793 0.77690 0.08590 1.00000 S13 S 0.07652 0.86557 0.43493 1.00000 S14 S 0.46094 0.63443 0.93493 1.00000 S15 S 0.72683 0.28463 0.09972 1.00000 S16 S 0.69220 0.21537 0.59972 1.00000 S17 S 0.97940 0.15852 0.89909 1.00000 S18 S 0.07088 0.34148 0.39909 1.00000 S19 S 0.81735 0.12422 0.24704 1.00000 S20 S 0.94312 0.37578 0.74704 1.00000 S21 S 0.94952 0.88227 0.75752 1.00000 S22 S 0.31725 0.61773 0.25752 1.00000 S23 S 0.81566 0.63315 0.25411 1.00000 S24 S 0.43251 0.86685 0.75411 1.00000