# CIF generated by HEAS from Alexandria entry agm007409084 data_agm007409084 _cell_length_a 2.98804 _cell_length_b 2.98804 _cell_length_c 4.03567 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 36.03209 _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 0.50000 0.50000 0.56535 1.00000 Fe1 Fe 0.00000 0.00000 0.10184 1.00000 H1 H 0.00000 0.50000 0.91562 1.00000 H2 H 0.00000 0.00000 0.50042 1.00000 H3 H 0.50000 0.00000 0.91562 1.00000