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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/44/8104438.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_8104438
loop_
_publ_author_name
'Kluefers, P.'
_publ_section_title
;
 Die Kristallstrukturen von K Co (C O)4 und Rb Co (C O)4
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              253
_journal_page_last               260
_journal_volume                  167
_journal_year                    1984
_chemical_formula_sum            'C4 Co O4 Rb'
_chemical_name_systematic        'Rb Co (C O)4'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-I 2yc'
_symmetry_space_group_name_H-M   'I 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 93.92
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   14.621
_cell_length_b                   5.746
_cell_length_c                   18.22
_cell_volume                     1527.122
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Kluefers_ZEKRDZ_1984_1935.cif
_cod_data_source_block           C4Co1O4Rb1
_cod_original_sg_symbol_Hall     '-C 2yc (x,y,-x+z)'
_cod_original_formula_sum        'C4 Co1 O4 Rb1'
_cod_database_code               8104438
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z+1/2
-x+1/2,y+1/2,-z+1
-x+1/2,-y+1/2,-z+1/2
x+1/2,-y+1/2,z
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
O3 O-2 0.1391 0.2969 0.2362 1 0.0
C1 C+1 0.0973 0.3244 0.4398 1 0.0
C3 C+1 0.1294 0.3896 0.2912 1 0.0
Co1 Co+3 0.11309 0.53383 0.3741 1 0.0
O2 O-2 0.2564 0.8693 0.409 1 0.0
C2 C+1 0.2 0.7329 0.3944 1 0.0
Rb1 Rb+1 0.13526 0.21463 0.08038 1 0.0
O4 O-2 -0.0477 0.8241 0.3455 1 0.0
O1 O-2 0.0834 0.1801 0.4824 1 0.0
C4 C+1 0.0141 0.708 0.3574 1 0.0
