# CIF generated by HEAS from Alexandria entry agm007397809 data_agm007397809 _cell_length_a 5.06085 _cell_length_b 5.06085 _cell_length_c 5.37042 _cell_angle_alpha 76.70287 _cell_angle_beta 76.70287 _cell_angle_gamma 47.25543 _cell_volume 97.77890 _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 0.50000 0.50000 0.00000 1.00000 Sc1 Sc 0.00000 0.00000 0.50000 1.00000 Cu1 Cu 0.76980 0.76980 0.16941 1.00000 Cu2 Cu 0.23020 0.23020 0.83059 1.00000 H1 H 0.91535 0.91535 0.90506 1.00000 H2 H 0.59721 0.13045 0.31336 1.00000 H3 H 0.08465 0.08465 0.09494 1.00000 H4 H 0.13045 0.59721 0.31336 1.00000 H5 H 0.86955 0.40279 0.68664 1.00000 H6 H 0.58870 0.58870 0.32020 1.00000 H7 H 0.41130 0.41130 0.67980 1.00000 H8 H 0.40279 0.86955 0.68664 1.00000