# CIF generated by HEAS from Alexandria entry agm002829019 data_agm002829019 _cell_length_a 3.66267 _cell_length_b 3.66267 _cell_length_c 9.68758 _cell_angle_alpha 79.10328 _cell_angle_beta 79.10328 _cell_angle_gamma 90.00000 _cell_volume 125.22991 _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 Ni1 Ni 0.50000 0.50000 0.00000 1.00000 Ni2 Ni 0.25000 0.75000 0.50000 1.00000 Tl1 Tl 0.00000 0.00000 0.00000 1.00000 Tl2 Tl 0.75000 0.25000 0.50000 1.00000 Fe1 Fe 0.59823 0.12500 0.25000 1.00000 Fe2 Fe 0.15177 0.62500 0.25000 1.00000 Fe3 Fe 0.37500 0.40177 0.75000 1.00000 Fe4 Fe 0.87500 0.84823 0.75000 1.00000