#------------------------------------------------------------------------------ #$Date: 2022-10-26 12:36:22 +0100 (Wed, 26 Oct 2022) $ #$Revision: 278814 $ #$URL: svn://www.crystallography.net/cod/cif/3/00/04/3000419.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_3000419 loop_ _publ_author_name 'Amira. T. Mohamed' M.M.Arman. Ebtesam.E.Ateia. _publ_section_title ; A facile novel synthesis of AgCuO2 delafossite nanoparticles and evaluation of their antibacterial activity ; _journal_name_full 'Personal communication to COD' _journal_year 2022 _chemical_formula_sum 'Ag Cu O2' _chemical_name_common AgCuO2 _space_group_IT_number 194 _space_group_name_Hall '-P 6c 2c' _space_group_name_H-M_alt 'P 63/m m c' _cell_angle_alpha 90.000000 _cell_angle_beta 90.000000 _cell_angle_gamma 120.000000 _cell_formula_units_Z 2 _cell_length_a 3.039000 _cell_length_b 3.039000 _cell_length_c 12.395000 _cell_volume 99.138 _cod_data_source_file AgCuO2H.cif _cod_data_source_block AgCuO2H _cod_depositor_comments ;Releasing structure 3000419 into public domain as personal communication to COD. ; _cod_original_formula_sum 'Ag1 Cu1 O2' _cod_database_code 3000419 _original_cell_volume 99.137643 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' '-y, x-y, z' 'y, -x+y, -z' '-x+y, -x, z' 'x-y, x, -z' '-x, -y, z+1/2' 'x, y, -z+1/2' 'y, -x+y, z+1/2' '-y, x-y, -z+1/2' 'x-y, x, z+1/2' '-x+y, -x, -z+1/2' 'y, x, -z' '-y, -x, z' 'x-y, -y, -z' '-x+y, y, z' '-x, -x+y, -z' 'x, x-y, z' '-y, -x, -z+1/2' 'y, x, z+1/2' '-x+y, y, -z+1/2' 'x-y, -y, z+1/2' 'x, x-y, -z+1/2' '-x, -x+y, z+1/2' loop_ _atom_site_label _atom_site_occupancy _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_adp_type _atom_site_type_symbol Cu1 1.0 0.000000 0.000000 0.000000 Uiso Cu O1 1.0 0.333333 0.666667 0.083333 Uiso O Ag1 1.0 0.333333 0.666667 0.250000 Uiso Ag