#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/37/8103750.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_8103750
loop_
_publ_author_name
'Friese, K.'
'Hoennerscheid, A.'
'Jansen, M.'
_publ_section_title
;
 Crystal structure determination of systematically intergrown compounds:
 Li5 (O H)2 Br3 and Li2 (O H) Br
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              536
_journal_page_last               541
_journal_volume                  218
_journal_year                    2003
_chemical_formula_sum            'Br H Li2 O'
_chemical_name_systematic        'Li2 (O H) Br'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.04594
_cell_length_b                   4.04594
_cell_length_c                   4.04594
_cell_volume                     66.231
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Friese_ZEKRDZ_2003_1780.cif
_cod_data_source_block           H1Br1Li2O1
_cod_original_cell_volume        66.23054
_cod_original_formula_sum        'H1 Br1 Li2 O1'
_cod_database_code               8103750
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
z,x,y
-x,z,y
-z,-x,y
x,-z,y
z,-x,-y
x,z,-y
-z,x,-y
-x,-z,-y
y,z,x
y,-z,-x
z,y,-x
-y,z,-x
-z,-y,-x
-y,-z,x
z,-y,x
-z,y,x
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
-z,-x,-y
x,-z,-y
z,x,-y
-x,z,-y
-z,x,y
-x,-z,y
z,-x,y
x,z,y
-y,-z,-x
-y,z,x
-z,-y,x
y,-z,x
z,y,x
y,z,-x
-z,y,-x
z,-y,-x
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 0 0 1 0.0
Li1 Li+1 0.5 0 0.5 0.667 0.0
Br1 Br-1 0.5 0.5 0.5 1 0.0
