# CIF generated by HEAS from Alexandria entry agm046861426 data_agm046861426 _cell_length_a 7.20739 _cell_length_b 7.20739 _cell_length_c 7.30960 _cell_angle_alpha 59.73207 _cell_angle_beta 59.73207 _cell_angle_gamma 38.22735 _cell_volume 198.73367 _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 Sc1 Sc 0.50000 0.50000 0.00000 1.00000 Ti1 Ti 0.15575 0.15575 0.88473 1.00000 Ti2 Ti 0.04254 0.04254 0.64441 1.00000 Ti3 Ti 0.69765 0.69765 0.55554 1.00000 Ti4 Ti 0.60253 0.60253 0.28862 1.00000 Ti5 Ti 0.39747 0.39747 0.71138 1.00000 Ti6 Ti 0.30235 0.30235 0.44446 1.00000 Ti7 Ti 0.95746 0.95746 0.35559 1.00000 Ti8 Ti 0.84425 0.84425 0.11527 1.00000 Nb1 Nb 0.79218 0.79218 0.80937 1.00000 Nb2 Nb 0.20782 0.20782 0.19063 1.00000