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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/8/10/35/8103585.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_8103585
loop_
_publ_author_name
'Rouse, R.C.'
'Peacor, D.R.'
'Maxim, B.R.'
_publ_section_title
;
 The crystal structure of germanimum dibromide
;
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, 
Kristallchemie (145,1977-148,1979)
;
_journal_page_first              161
_journal_page_last               171
_journal_volume                  145
_journal_year                    1977
_chemical_formula_sum            'Br2 Ge'
_chemical_name_systematic        'Ge Br2'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 101.9
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   11.68
_cell_length_b                   9.12
_cell_length_c                   7.02
_cell_volume                     731.711
_citation_journal_id_ASTM        ZKKKAJ
_cod_data_source_file            Rouse_ZKKKAJ_1977_167.cif
_cod_data_source_block           Br2Ge1
_cod_original_cell_volume        731.7111
_cod_original_formula_sum        'Br2 Ge1'
_cod_database_code               8103585
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-z
x,-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
Br2 Br-1 0.8884 0.3331 0.397 1 0.0
Br1 Br-1 0.3369 0.1201 0.2622 1 0.0
Ge1 Ge+2 0.0121 0.1254 0.2693 1 0.0
Br4 Br-1 0.5968 0.2056 0.0583 1 0.0
Br3 Br-1 0.1402 0.4441 0.1747 1 0.0
Ge2 Ge+2 0.45 0.3435 0.2197 1 0.0
