# CIF generated by HEAS from Alexandria entry agm005443587 data_agm005443587 _cell_length_a 8.01351 _cell_length_b 8.01351 _cell_length_c 3.16418 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.48035 _cell_volume 175.11167 _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 C1 C 0.86433 0.86433 0.25000 1.00000 C2 C 0.13567 0.13567 0.75000 1.00000 Br1 Br 0.33694 0.11229 0.25000 1.00000 Br2 Br 0.66306 0.88771 0.75000 1.00000 Br3 Br 0.11229 0.33694 0.25000 1.00000 Br4 Br 0.88771 0.66306 0.75000 1.00000