# CIF generated by HEAS from Alexandria entry agm005652122 data_agm005652122 _cell_length_a 3.57591 _cell_length_b 5.62611 _cell_length_c 12.23469 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 246.14316 _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 0.75000 0.86933 0.59803 1.00000 Sc2 Sc 0.75000 0.36933 0.90197 1.00000 Sc3 Sc 0.25000 0.63067 0.09803 1.00000 Sc4 Sc 0.25000 0.13067 0.40197 1.00000 Pa1 Pa 0.75000 0.63429 0.33976 1.00000 Pa2 Pa 0.75000 0.13429 0.16024 1.00000 Pa3 Pa 0.25000 0.86571 0.83976 1.00000 Pa4 Pa 0.25000 0.36571 0.66024 1.00000 Fe1 Fe 0.25000 0.64754 0.46383 1.00000 Fe2 Fe 0.75000 0.35246 0.53617 1.00000 Fe3 Fe 0.75000 0.85246 0.96383 1.00000 Fe4 Fe 0.25000 0.14754 0.03617 1.00000