# CIF generated by HEAS from Alexandria entry agm002811482 data_agm002811482 _cell_length_a 3.88041 _cell_length_b 3.88041 _cell_length_c 11.24879 _cell_angle_alpha 80.06787 _cell_angle_beta 80.06787 _cell_angle_gamma 90.00000 _cell_volume 164.26351 _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 Nb1 Nb 0.64229 0.12500 0.25000 1.00000 Nb2 Nb 0.10771 0.62500 0.25000 1.00000 Nb3 Nb 0.37500 0.35771 0.75000 1.00000 Nb4 Nb 0.87500 0.89229 0.75000 1.00000 Ca1 Ca 0.50000 0.50000 0.00000 1.00000 Ca2 Ca 0.25000 0.75000 0.50000 1.00000 Cu1 Cu 0.00000 0.00000 0.00000 1.00000 Cu2 Cu 0.75000 0.25000 0.50000 1.00000