# CIF generated by HEAS from Alexandria entry agm002012276 data_agm002012276 _cell_length_a 3.36250 _cell_length_b 3.36250 _cell_length_c 8.89069 _cell_angle_alpha 79.09960 _cell_angle_beta 79.09960 _cell_angle_gamma 60.00000 _cell_volume 84.95372 _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 Ca1 Ca 0.00000 0.00000 0.00000 1.00000 Zr1 Zr 0.12125 0.12125 0.63625 1.00000 Zr2 Zr 0.87875 0.87875 0.36375 1.00000 N1 N 0.50000 0.50000 0.50000 1.00000