# CIF generated by HEAS from Alexandria entry agm006494271 data_agm006494271 _cell_length_a 5.93311 _cell_length_b 5.93311 _cell_length_c 5.93311 _cell_angle_alpha 63.29223 _cell_angle_beta 63.29223 _cell_angle_gamma 63.29223 _cell_volume 158.45316 _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 0.37841 0.37841 0.37841 1.00000 Nd2 Nd 0.62159 0.62159 0.62159 1.00000 Ti1 Ti 0.00000 0.00000 0.00000 1.00000 H1 H 0.15177 0.67539 0.67539 1.00000 H2 H 0.62315 0.11871 0.11871 1.00000 H3 H 0.11871 0.11871 0.62315 1.00000 H4 H 0.67539 0.67539 0.15177 1.00000 H5 H 0.11871 0.62315 0.11871 1.00000 H6 H 0.67539 0.15177 0.67539 1.00000 H7 H 0.84823 0.32461 0.32461 1.00000 H8 H 0.37685 0.88129 0.88129 1.00000 H9 H 0.88129 0.88129 0.37685 1.00000 H10 H 0.32461 0.32461 0.84823 1.00000 H11 H 0.88129 0.37685 0.88129 1.00000 H12 H 0.32461 0.84823 0.32461 1.00000 Ru1 Ru 0.00000 0.00000 0.50000 1.00000 Ru2 Ru 0.00000 0.50000 0.00000 1.00000 Ru3 Ru 0.50000 0.00000 0.00000 1.00000