#------------------------------------------------------------------------------ #$Date: 2010-01-30 13:59:17 +0000 (Sat, 30 Jan 2010) $ #$Revision: 966 $ #$URL: svn://www.crystallography.net/cod/cif/2/2101387.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_2101387 loop_ _publ_author_name 'Maslen, E. N.' 'Streltsov, V. A.' 'Streltsova, N. R.' 'Ishizawa, N.' _publ_section_title ; Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO~3~, MgCO~3~ and MnCO~3~ ; _journal_issue 6 _journal_name_full 'Acta Crystallographica Section B' _journal_page_first 929 _journal_page_last 939 _journal_volume 51 _journal_year 1995 _chemical_formula_sum 'C Mn O3' _[local]_cod_chemical_formula_sum_orig 'C1 Mn1 O3' _chemical_formula_weight 114.95 _symmetry_cell_setting trigonal _symmetry_space_group_name_Hall '-R 3 2"c' _symmetry_space_group_name_H-M 'R -3 c {hexagonal axes}' _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 120.0 _cell_formula_units_Z 6 _cell_length_a 4.7730(10) _cell_length_b 4.7730(10) _cell_length_c 15.6420(10) _cell_volume 308.60(10) _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71073 _exptl_absorpt_coefficient_mu 5.86 _exptl_crystal_density_diffrn 3.711 _exptl_crystal_F_000 330 _[local]_cod_data_source_file as0682.cif loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Mn .0 .0 .0 C .0 .0 .25 O .26950(10) .0 .25 _cod_database_code 2101387