# CIF generated by HEAS from Alexandria entry agm004053989 data_agm004053989 _cell_length_a 4.39509 _cell_length_b 4.39509 _cell_length_c 7.02710 _cell_angle_alpha 89.64554 _cell_angle_beta 89.64554 _cell_angle_gamma 60.03149 _cell_volume 117.58975 _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 Ba1 Ba 0.45901 0.45901 0.54294 1.00000 Br1 Br 0.12723 0.12723 0.25000 1.00000 Cu1 Cu 0.12349 0.12349 0.86319 1.00000 Cu2 Cu 0.79027 0.79027 0.84387 1.00000