# CIF generated by HEAS from Alexandria entry agm011679639 data_agm011679639 _cell_length_a 5.08258 _cell_length_b 6.69497 _cell_length_c 8.45333 _cell_angle_alpha 108.83630 _cell_angle_beta 90.83659 _cell_angle_gamma 92.18587 _cell_volume 271.93389 _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 0.50000 0.50000 0.50000 1.00000 Nd2 Nd 0.00000 0.00000 0.50000 1.00000 Nd3 Nd 0.50000 0.50000 0.00000 1.00000 Th1 Th 0.00000 0.00000 0.00000 1.00000 B1 B 0.50508 0.99110 0.74240 1.00000 B2 B 0.98625 0.48769 0.25093 1.00000 B3 B 0.49492 0.00890 0.25760 1.00000 B4 B 0.01375 0.51231 0.74907 1.00000 O1 O 0.78078 0.99927 0.75174 1.00000 O2 O 0.25841 0.47961 0.24488 1.00000 O3 O 0.86597 0.63629 0.38198 1.00000 O4 O 0.36955 0.11449 0.87733 1.00000 O5 O 0.37676 0.86337 0.59873 1.00000 O6 O 0.82560 0.33163 0.13584 1.00000 O7 O 0.21922 0.00073 0.24826 1.00000 O8 O 0.74159 0.52039 0.75512 1.00000 O9 O 0.13403 0.36371 0.61802 1.00000 O10 O 0.63045 0.88551 0.12267 1.00000 O11 O 0.62324 0.13663 0.40127 1.00000 O12 O 0.17440 0.66837 0.86416 1.00000