# CIF generated by HEAS from Alexandria entry agm106799862 data_agm106799862 _cell_length_a 6.51169 _cell_length_b 3.20489 _cell_length_c 6.83212 _cell_angle_alpha 90.00000 _cell_angle_beta 88.73102 _cell_angle_gamma 90.00000 _cell_volume 142.54613 _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 Ti1 Ti 0.38301 0.25000 0.65009 1.00000 Ti2 Ti 0.61699 0.75000 0.34991 1.00000 Ti3 Ti 0.35748 0.25000 0.08786 1.00000 Ti4 Ti 0.64252 0.75000 0.91214 1.00000 Ti5 Ti 0.13543 0.75000 0.38244 1.00000 Ti6 Ti 0.86457 0.25000 0.61756 1.00000 Nb1 Nb 0.11237 0.75000 0.85906 1.00000 Nb2 Nb 0.88763 0.25000 0.14094 1.00000 H1 H 0.37119 0.25000 0.36991 1.00000 H2 H 0.62881 0.75000 0.63009 1.00000