# CIF generated by HEAS from Alexandria entry agm005751628 data_agm005751628 _cell_length_a 3.85030 _cell_length_b 4.95128 _cell_length_c 8.38330 _cell_angle_alpha 89.02182 _cell_angle_beta 76.76060 _cell_angle_gamma 89.99967 _cell_volume 155.54698 _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 0.00000 0.99968 0.99999 1.00000 Se1 Se 0.99999 0.50001 0.99999 1.00000 I1 I 0.37014 0.99265 0.26043 1.00000 I2 I 0.62986 0.00768 0.73956 1.00000