# CIF generated by HEAS from Alexandria entry agm002873449 data_agm002873449 _cell_length_a 6.60290 _cell_length_b 6.60290 _cell_length_c 6.60199 _cell_angle_alpha 59.99545 _cell_angle_beta 59.99545 _cell_angle_gamma 90.00000 _cell_volume 203.50262 _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 0.37563 0.12500 0.25000 1.00000 Nb2 Nb 0.37437 0.62500 0.25000 1.00000 Nb3 Nb 0.37500 0.62437 0.75000 1.00000 Nb4 Nb 0.87500 0.62563 0.75000 1.00000 Ba1 Ba 0.00000 0.00000 0.00000 1.00000 Ba2 Ba 0.75000 0.25000 0.50000 1.00000 O1 O 0.50000 0.50000 0.00000 1.00000 O2 O 0.25000 0.75000 0.50000 1.00000