# CIF generated by HEAS from Alexandria entry agm005677771 data_agm005677771 _cell_length_a 7.32249 _cell_length_b 8.24788 _cell_length_c 8.24788 _cell_angle_alpha 57.47794 _cell_angle_beta 63.64694 _cell_angle_gamma 63.64693 _cell_volume 362.21287 _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 Zr1 Zr 0.01743 0.00000 1.00000 1.00000 Zr2 Zr 0.01743 0.50000 0.50000 1.00000 Zr3 Zr 0.75352 0.38707 0.34781 1.00000 Zr4 Zr 0.48841 0.61293 0.65219 1.00000 Zr5 Zr 0.48841 0.15219 0.11293 1.00000 Zr6 Zr 0.75352 0.84781 0.88707 1.00000 Sc1 Sc 0.16156 0.03718 0.53718 1.00000 Sc2 Sc 0.73592 0.96282 0.46282 1.00000 Sc3 Sc 0.32056 0.77406 0.27406 1.00000 Sc4 Sc 0.36869 0.22594 0.72594 1.00000 Sc5 Sc 0.76327 0.44321 0.94321 1.00000 Sc6 Sc 0.14968 0.55679 0.05679 1.00000 Os1 Os 0.77090 0.23047 0.73047 1.00000 Os2 Os 0.73184 0.76953 0.26953 1.00000 Os3 Os 0.09729 0.21875 0.10590 1.00000 Os4 Os 0.42194 0.78125 0.89410 1.00000 Os5 Os 0.42194 0.39410 0.28125 1.00000 Os6 Os 0.09729 0.60590 0.71875 1.00000