# CIF generated by HEAS from Alexandria entry agm002016555 data_agm002016555 _cell_length_a 7.60136 _cell_length_b 4.12042 _cell_length_c 9.21572 _cell_angle_alpha 90.00000 _cell_angle_beta 122.99508 _cell_angle_gamma 90.00000 _cell_volume 242.09047 _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 Sc1 Sc 0.22267 0.00000 0.06735 1.00000 Sc2 Sc 0.22267 0.50000 0.56735 1.00000 Sc3 Sc 0.64422 0.00000 0.68975 1.00000 Sc4 Sc 0.64422 0.50000 0.18975 1.00000 Fe1 Fe 0.03414 0.00000 0.69569 1.00000 Fe2 Fe 0.03414 0.50000 0.19569 1.00000 Fe3 Fe 0.22472 0.00000 0.35215 1.00000 Fe4 Fe 0.22472 0.50000 0.85215 1.00000 Fe5 Fe 0.93684 0.00000 0.37582 1.00000 Fe6 Fe 0.93684 0.50000 0.87582 1.00000 Fe7 Fe 0.84785 0.00000 0.06990 1.00000 Fe8 Fe 0.84785 0.50000 0.56990 1.00000 Ru1 Ru 0.42578 0.00000 0.88111 1.00000 Ru2 Ru 0.42578 0.50000 0.38111 1.00000 Ru3 Ru 0.63157 0.00000 0.40136 1.00000 Ru4 Ru 0.63157 0.50000 0.90136 1.00000