#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/37/4343702.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_4343702
loop_
_publ_author_name
'Ayasse, C.'
'Eick, H.A.'
_publ_section_title
;
 Synthesis and crystal structure of triytterbium chloroorthosilicate, Yb3
 (Si O4)2 Cl
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1140
_journal_page_last               1143
_journal_volume                  12
_journal_year                    1973
_chemical_formula_sum            'Cl O8 Si2 Yb3'
_chemical_name_systematic        'Yb3 (Si O4)2 Cl'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.731
_cell_length_b                   17.556
_cell_length_c                   6.129
_cell_volume                     724.260
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Ayasse_INOCAJ_1973_1171.cif
_cod_data_source_block           Cl1O8Si2Yb3
_cod_original_cell_volume        724.2605
_cod_original_formula_sum        'Cl1 O8 Si2 Yb3'
_cod_database_code               4343702
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
x,-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 0.3284 0.1187 0.0282 1 0.0
Yb2 Yb+3 0.2902 0.25 0.8849 1 0.0
Si1 Si+4 0.0232 0.0996 0.6213 1 0.0
O2 O-2 0.1915 0.0966 0.447 1 0.0
Yb1 Yb+3 0.013 0.0903 0.1276 1 0.0
O4 O-2 0.0356 0.175 0.7717 1 0.0
O1 O-2 0.0089 0.031 0.7935 1 0.0
Cl1 Cl-1 0.0367 0.25 0.2357 1 0.0
