# CIF generated by HEAS from Alexandria entry agm007403733 data_agm007403733 _cell_length_a 5.28928 _cell_length_b 5.28928 _cell_length_c 5.78071 _cell_angle_alpha 73.94358 _cell_angle_beta 73.94358 _cell_angle_gamma 45.95073 _cell_volume 110.86858 _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 0.00000 1.00000 Ti1 Ti 0.00000 0.00000 0.50000 1.00000 Cu1 Cu 0.27591 0.27591 0.59618 1.00000 Cu2 Cu 0.72409 0.72409 0.40382 1.00000 H1 H 0.07332 0.07332 0.14507 1.00000 H2 H 0.36979 0.88880 0.64304 1.00000 H3 H 0.92668 0.92668 0.85493 1.00000 H4 H 0.88880 0.36979 0.64304 1.00000 H5 H 0.11120 0.63021 0.35696 1.00000 H6 H 0.41832 0.41832 0.67342 1.00000 H7 H 0.58168 0.58168 0.32658 1.00000 H8 H 0.63021 0.11120 0.35696 1.00000