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#$Date: 2016-01-09 14:51:45 +0200 (Sat, 09 Jan 2016) $
#$Revision: 174215 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/74/2107434.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2107434
loop_
_publ_author_name
'Cadee, M.C.'
'Verschoor, G.C.'
_publ_section_title
;
 Barium tin chromium oxide, a new hollandite phase
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              3554
_journal_page_last               3558
_journal_volume                  34
_journal_year                    1978
_chemical_formula_sum            'Ba0.7 Cr1.4 O8 Sn1.6'
_chemical_name_systematic        'Ba0.7 Sn1.6 Cr1.4 O8'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 134.27
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   14.728
_cell_length_b                   3.108
_cell_length_c                   10.012
_cell_volume                     328.166
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Cadee_ACBCAR_1978_1749.cif
_cod_data_source_block           Ba0.7Cr1.4O8Sn1.6
_cod_original_cell_volume        328.1663
_cod_database_code               2107434
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-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
Cr2 Cr 0.8549 0 0.1864 0.35 0.0
O4 O 0.6594 0 0.9667 1 0.0
Cr1 Cr 0.3383 0 0.492 0.35 0.0
O2 O 0.0432 0 0.3556 1 0.0
Ba1 Ba 0 0.167 0 0.35 0.0
O3 O 0.6457 0 0.6883 1 0.0
Sn2 Sn 0.8549 0 0.1864 0.4 0.0
O1 O 0.2929 0 0.6475 1 0.0
Sn1 Sn 0.3383 0 0.492 0.4 0.0
