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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/1/53/07/1530721.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_1530721
loop_
_publ_author_name
'Schleid, T.'
'Meyer, G.'
_publ_section_title
;
 An oxychloride of divalent ytterbium: Yb4 O Cl6
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              161
_journal_page_last               166
_journal_volume                  127
_journal_year                    1987
_chemical_formula_sum            'Cl6 O Yb4'
_chemical_name_systematic        'Yb4 O Cl6'
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   9.146
_cell_length_b                   9.146
_cell_length_c                   6.894
_cell_volume                     499.418
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Schleid_JCOMAH_1987_1367.cif
_cod_data_source_block           Cl6O1Yb4
_cod_original_cell_volume        499.4181
_cod_original_formula_sum        'Cl6 O1 Yb4'
_cod_database_code               1530721
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
y,x,z+1/2
-x+y,y,z
-x,-x+y,z+1/2
-y,-x,z
x-y,-y,z+1/2
x,x-y,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
O1 O-2 0.3333 0.6667 0.1076 1 0.0
Cl2 Cl-1 0.466 0.534 0.7117 1 0.0
Cl1 Cl-1 0.138 0.862 0.3885 1 0.0
Yb1 Yb+2 0.3333 0.6667 0.4333 1 0.0
Yb2 Yb+2 0.19665 0.80335 0 1 0.0
