#------------------------------------------------------------------------------ #$Date: 2013-12-28 15:58:47 +0200 (Sat, 28 Dec 2013) $ #$Revision: 91933 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/00/19/2001971.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2001971 loop_ _publ_author_name 'Pohl, D.' 'Gross, T.' _publ_section_title ; Caesium nitrate (II) at 296 K ; _journal_issue 2 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 316 _journal_page_last 318 _journal_volume 49 _journal_year 1993 _chemical_formula_sum 'Cs N O3' _chemical_formula_weight 194.91 _symmetry_cell_setting trigonal _symmetry_space_group_name_H-M 'P 31' _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 120.0 _cell_formula_units_Z 9 _cell_length_a 10.902(2) _cell_length_b 10.902(2) _cell_length_c 7.740(2) _cell_volume 796.7(3) _diffrn_radiation_type Ag _diffrn_radiation_wavelength 0.56087 _exptl_absorpt_coefficient_mu 5.44 _exptl_crystal_density_diffrn 3.656(2) _exptl_crystal_F_000 765 _[local]_cod_data_source_file se0089.cif _[local]_cod_data_source_block se0089_structure_1_of_1 _[local]_cod_chemical_formula_sum_orig 'Cs1 N1 O3' _cod_original_cell_volume 796.7(4) _cod_database_code 2001971 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Cs(1) .44810(10) .55570(10) .6527(3) Cs(2) .12050(10) .22200(10) .0 Cs(3) -.21610(10) .22820(10) .63330(10) N(1) .4629(7) .5933(7) .1604(16) N(2) .1085(7) .2034(7) -.4692(12) N(3) -.2290(9) .2345(7) .109(2) O(1) .4417(7) .6650(8) .2670(10) O(2) .4004(10) .4650(7) .1673(15) O(3) .5510(7) .6605(8) .0452(11) O(4) .0045(6) .1134(6) -.3876(11) O(5) .2265(5) .2314(7) -.4274(12) O(6) .0828(10) .2565(8) -.5985(11) O(7) -.2484(13) .1638(9) .2304(11) O(8) -.1073(6) .3216(7) .0481(13) O(9) -.3311(6) .2231(6) .0210(11) _journal_paper_doi 10.1107/S0108270192006504