# CIF generated by HEAS from Alexandria entry agm003454658 data_agm003454658 _cell_length_a 3.91220 _cell_length_b 6.54563 _cell_length_c 13.00315 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 107.38799 _cell_volume 317.76598 _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 0.13413 0.26826 0.44106 1.00000 Zr2 Zr 0.86587 0.73174 0.94106 1.00000 Zr3 Zr 0.13413 0.26826 0.05894 1.00000 Zr4 Zr 0.86587 0.73174 0.55894 1.00000 Pa1 Pa 0.61221 0.22443 0.75000 1.00000 Pa2 Pa 0.38779 0.77557 0.25000 1.00000 As1 As 0.77026 0.54052 0.13050 1.00000 As2 As 0.77026 0.54052 0.36950 1.00000 As3 As 0.22974 0.45948 0.86950 1.00000 As4 As 0.22974 0.45948 0.63050 1.00000 As5 As 0.94631 0.89261 0.75000 1.00000 As6 As 0.05369 0.10739 0.25000 1.00000 As7 As 0.50000 0.00000 0.00000 1.00000 As8 As 0.50000 0.00000 0.50000 1.00000