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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/1/53/29/1532946.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_1532946
loop_
_publ_author_name
'Morozov, V.A.'
'Lazoryak, B.I.'
'Amelinckx, S.'
'Lebedev, O.I.'
'van Tendeloo, G.'
_publ_section_title
;
 Structures of three polymorphs of the complex oxide K5 Yb (Mo O4)4
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              76
_journal_page_last               87
_journal_volume                  176
_journal_year                    2003
_chemical_formula_sum            'K5 Mo4 O16 Yb'
_chemical_name_systematic        'K5 Yb (Mo O4)4'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 114.559
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.8236
_cell_length_b                   12.1293
_cell_length_c                   10.5151
_cell_volume                     1719.577
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Morozov_JSSCBI_2003_259.cif
_cod_data_source_block           K5Mo4O16Yb1
_cod_original_formula_sum        'K5 Mo4 O16 Yb1'
_cod_database_code               1532946
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
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-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
O3 O-2 0.1495 0.3797 0.0305 1 0.0
O8 O-2 0.1662 0.7649 0.2342 1 0.0
O6 O-2 0.1056 0.8914 0.9894 1 0.0
O1 O-2 0.9863 0.4027 0.0753 1 0.0
K3 K+1 0.2841 0.8944 0.9401 1 0.0
K1 K+1 0.5 0.1132 0.25 1 0.0
O7 O-2 0.0959 0.9839 0.2324 1 0.0
O4 O-2 0.1126 0.2328 0.2327 1 0.0
O2 O-2 0.1654 0.469 0.2752 1 0.0
K2 K+1 0.2941 0.3714 0.932 1 0.0
Mo1 Mo+6 0.1035 0.368 0.155 1 0.0
O5 O-2 0.9741 0.8216 0.0992 1 0.0
Mo2 Mo+6 0.0913 0.8667 0.139 1 0.0
Yb1 Yb+3 0 0.119 0.25 1 0.0
