# CIF generated by HEAS from Alexandria entry agm002829558 data_agm002829558 _cell_length_a 5.42424 _cell_length_b 5.42424 _cell_length_c 6.63381 _cell_angle_alpha 65.86845 _cell_angle_beta 65.86845 _cell_angle_gamma 90.00000 _cell_volume 159.25163 _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 Tc1 Tc 0.58044 0.12500 0.25000 1.00000 Tc2 Tc 0.16956 0.62500 0.25000 1.00000 Tc3 Tc 0.37500 0.41956 0.75000 1.00000 Tc4 Tc 0.87500 0.83044 0.75000 1.00000 Br1 Br 0.00000 0.00000 0.00000 1.00000 Br2 Br 0.75000 0.25000 0.50000 1.00000 Fe1 Fe 0.50000 0.50000 0.00000 1.00000 Fe2 Fe 0.25000 0.75000 0.50000 1.00000