#------------------------------------------------------------------------------ #$Date: 2016-01-01 12:19:34 +0200 (Fri, 01 Jan 2016) $ #$Revision: 171876 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/54/07/1540753.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_1540753 loop_ _publ_author_name 'Zachwieja, U.' 'Jacobs, H.' _publ_section_title ; Kolumnarstrukturen bei Tri- und Diamminnitraten, (M (N H3)3) (N O3) und (M (N H3)2) (N O3) des einwertigen Kupfres und Silbers ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 37 _journal_page_last 50 _journal_volume 571 _journal_year 1989 _chemical_formula_sum 'Ag H6 N3 O3' _chemical_name_systematic '(Ag (N H3)2) (N O3)' _space_group_IT_number 58 _symmetry_space_group_name_Hall '-P 2 2n' _symmetry_space_group_name_H-M 'P n n m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 10.573 _cell_length_b 8.11 _cell_length_c 6.286 _cell_volume 539.006 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Zachwieja_ZAACAB_1989_1183.cif _cod_data_source_block H6Ag1N3O3 _cod_original_cell_volume 539.0058 _cod_chemical_formula_sum_orig 'H6 Ag1 N3 O3' _cod_database_code 1540753 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,z x+1/2,-y+1/2,-z+1/2 -x+1/2,y+1/2,-z+1/2 -x,-y,-z x,y,-z -x-1/2,y-1/2,z-1/2 x-1/2,-y-1/2,z-1/2 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv O2 O-2 0.346 0.002 0.158 1 0.0 N2 N-3 0.32 0.371 0 1 0.0 Ag2 Ag+1 0 0 0.5 1 0.0 N3 N+5 0.34 0.925 0 1 0.0 Ag1 Ag+1 0 0 0 1 0.0 O1 O-2 0.329 0.782 0 1 0.0 N1 N-3 0.977 0.264 0 1 0.0