# CIF generated by HEAS from Alexandria entry agm002201404 data_agm002201404 _cell_length_a 3.36039 _cell_length_b 3.36039 _cell_length_c 7.86068 _cell_angle_alpha 77.60136 _cell_angle_beta 77.60180 _cell_angle_gamma 60.02920 _cell_volume 74.49352 _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 Nb1 Nb 0.99997 0.99997 0.99976 1.00000 Br1 Br 0.41684 0.41685 0.75072 1.00000 Br2 Br 0.25002 0.25001 0.24882 1.00000