# CIF generated by HEAS from Alexandria entry agm007408963 data_agm007408963 _cell_length_a 5.08586 _cell_length_b 5.08586 _cell_length_c 6.59164 _cell_angle_alpha 67.55978 _cell_angle_beta 112.44022 _cell_angle_gamma 127.67252 _cell_volume 122.13977 _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 0.00000 0.00000 0.00000 1.00000 Nb1 Nb 0.50000 0.50000 0.50000 1.00000 Zn1 Zn 0.23186 0.76814 0.61547 1.00000 Zn2 Zn 0.76814 0.23186 0.38453 1.00000 H1 H 0.04917 0.95083 0.40341 1.00000 H2 H 0.44509 0.55491 0.75637 1.00000 H3 H 0.95083 0.04917 0.59659 1.00000 H4 H 0.44657 0.10390 0.75343 1.00000 H5 H 0.55343 0.89610 0.24657 1.00000 H6 H 0.89610 0.55343 0.75343 1.00000 H7 H 0.10390 0.44657 0.24657 1.00000 H8 H 0.55491 0.44509 0.24363 1.00000