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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/41/8104189.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_8104189
loop_
_publ_author_name
'Zheng, Y.-Q.'
'Adam, A.'
_publ_section_title
;
 Crystal structure of dirubidium
 trans-tetraaquabis(carbonato)cobaltate(II), Rb2 (Co (C O3)2 (H2 O)4) and
 dirubidium trans-tetraaquabis(carbonato)-nickelate(II), Rb2 (Ni (C O3)2
 (H2 O)4)
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              447
_journal_page_last               448
_journal_volume                  210
_journal_year                    1995
_chemical_formula_sum            'C2 H8 Ni O10 Rb2'
_chemical_name_systematic        'Rb2 (Ni (C O3)2 (H2 O)4)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 99.73
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   11.357
_cell_length_b                   6.348
_cell_length_c                   6.971
_cell_volume                     495.340
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Zheng_ZEKRDZ_1995_1704.cif
_cod_data_source_block           C2H8Ni1O10Rb2
_cod_original_cell_volume        495.3395
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'C2 H8 Ni1 O10 Rb2'
_cod_database_code               8104189
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-z
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
C1 C+4 0.32818 0.15119 0.57304 1 0.0
O5 O-2 0.56188 0.33713 0.2736 1 0.0
Ni1 Ni+2 0.5 0.5 0.5 1 0.0
O3 O-2 0.406 0.07813 0.71431 1 0.0
H4 H+1 0.5838 0.19763 0.2724 1 0.0
O1 O-2 0.35463 0.30534 0.46964 1 0.0
H3 H+1 0.62884 0.39388 0.20185 1 0.0
O4 O-2 0.59478 0.2955 0.69863 1 0.0
O2 O-2 0.22398 0.06867 0.5376 1 0.0
H2 H+1 0.12583 0.15762 0.30728 1 0.0
Rb1 Rb+1 0.32393 0.1391 0.07705 1 0.0
H1 H+1 0.46902 0.76602 0.27282 1 0.0
