#------------------------------------------------------------------------------ #$Date: 2013-05-05 17:21:46 +0300 (Sun, 05 May 2013) $ #$Revision: 85285 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/00/99/9009935.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided the American Mineralogist Crystal Structure Database, # http://rruff.geo.arizona.edu/AMS/amcsd.php # # 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_9009935 loop_ _publ_author_name 'Lippmann, F.' _publ_section_title ; Die kristallstruktur des norsethit, BaMg(CO3)2, im vergleich zum dolomit, CaMg(CO3)2 ; _journal_name_full Naturwissenschaften _journal_page_first 514 _journal_page_last 514 _journal_volume 54 _journal_year 1967 _chemical_formula_sum 'C2 Ba Mg O6' _chemical_name_mineral Norsethite _space_group_IT_number 155 _symmetry_space_group_name_Hall 'R 3 2"' _symmetry_space_group_name_H-M 'R 3 2 :H' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_length_a 5.017 _cell_length_b 5.017 _cell_length_c 16.77 _cell_volume 365.554 _exptl_crystal_density_diffrn 3.838 _[local]_cod_cif_authors_sg_H-M 'R 3 2' _[local]_cod_chemical_formula_sum_orig 'Ba Mg C2 O6' _cod_database_code 9009935 loop_ _symmetry_equiv_pos_as_xyz x,y,z 2/3+x,1/3+y,1/3+z 1/3+x,2/3+y,2/3+z -x,-x+y,-z 2/3-x,1/3-x+y,1/3-z 1/3-x,2/3-x+y,2/3-z y,x,-z 2/3+y,1/3+x,1/3-z 1/3+y,2/3+x,2/3-z x-y,-y,-z 2/3+x-y,1/3-y,1/3-z 1/3+x-y,2/3-y,2/3-z -y,x-y,z 2/3-y,1/3+x-y,1/3+z 1/3-y,2/3+x-y,2/3+z -x+y,-x,z 2/3-x+y,1/3-x,1/3+z 1/3-x+y,2/3-x,2/3+z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Ba 0.00000 0.00000 0.00000 Mg 0.00000 0.00000 0.50000 C 0.00000 0.00000 0.24200 O 0.19900 -0.08900 0.24200