# CIF generated by HEAS from Alexandria entry agm004899028 data_agm004899028 _cell_length_a 6.29722 _cell_length_b 6.05126 _cell_length_c 8.10392 _cell_angle_alpha 90.00299 _cell_angle_beta 90.00080 _cell_angle_gamma 88.58499 _cell_volume 308.71466 _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 Nd1 Nd 0.00000 0.00000 0.50000 1.00000 Pa1 Pa 0.50008 0.50010 0.75842 1.00000 Pa2 Pa 0.49992 0.49990 0.24158 1.00000 Ti1 Ti 0.00000 0.00000 0.00000 1.00000 S1 S 0.16998 0.77940 0.21844 1.00000 S2 S 0.68180 0.72757 0.00010 1.00000 S3 S 0.83009 0.22066 0.21846 1.00000 S4 S 0.83002 0.22060 0.78156 1.00000 S5 S 0.31820 0.27243 0.99990 1.00000 S6 S 0.16991 0.77934 0.78154 1.00000 S7 S 0.65065 0.71966 0.49993 1.00000 S8 S 0.34935 0.28034 0.50007 1.00000