# CIF generated by HEAS from Alexandria entry agm035543798 data_agm035543798 _cell_length_a 3.52430 _cell_length_b 8.31958 _cell_length_c 7.97922 _cell_angle_alpha 94.41953 _cell_angle_beta 92.28305 _cell_angle_gamma 102.21708 _cell_volume 227.59944 _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 0.81033 0.62971 0.44824 1.00000 Nb2 Nb 0.18967 0.37029 0.55176 1.00000 I1 I 0.00000 0.00000 0.50000 1.00000 Br1 Br 0.64725 0.33039 0.30282 1.00000 Br2 Br 0.31419 0.68186 0.20200 1.00000 Br3 Br 0.35275 0.66961 0.69718 1.00000 Br4 Br 0.68581 0.31814 0.79800 1.00000