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#$Date: 2013-05-03 00:20:24 +0300 (Fri, 03 May 2013) $
#$Revision: 85115 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/51/16/1511635.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_1511635
loop_
_publ_author_name
'Lundstroem, T.'
'Bolmgren, H.'
'Okada, S.'
_publ_section_title
;
 Structure refinement of the boron suboxide B6 O by the Rietveld method
;
_journal_name_full               'AIP Conference Proceedings'
_journal_page_first              197
_journal_page_last               200
_journal_volume                  231
_journal_year                    1991
_chemical_formula_sum            'B6 O'
_chemical_name_systematic        'B6 O'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   5.3862
_cell_length_b                   5.3862
_cell_length_c                   12.319
_cell_volume                     309.507
_citation_journal_id_ASTM        APCPCS
_[local]_cod_data_source_file    boron4-x_289.cif
_[local]_cod_data_source_block   B6O1
_[local]_cod_chemical_formula_sum_orig 'B6 O1'
_cod_original_cell_volume        309.5074
_cod_database_code               1511635
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+1/3
-x+2/3,-x+y+1/3,-z+1/3
x-y+2/3,-y+1/3,-z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+2/3
-x+1/3,-x+y+2/3,-z+2/3
x-y+1/3,-y+2/3,-z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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
B1 B 0.159 0.841 0.6414 1 0.0
B2 B 0.1149 0.8851 0.883 1 0.0
O1 O 0 0 0.3757 1 0.0