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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/1/52/96/1529621.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_1529621
loop_
_publ_author_name
'Belokoneva, E.L.'
'Azizov, A.V.'
'Leonjuk, N.I.'
'Belov, N.V.'
'Simonov, M.A.'
_publ_section_title
;
 The crystal structure of Y Al3 (B O3)4
;
_journal_name_full
'Zhurnal Strukturnoi Khimii (Issue-No. from 1981)'
_journal_page_first              196
_journal_page_last               198
_journal_volume                  22
_journal_year                    1981
_chemical_formula_sum            'Al3 B4 O12 Y'
_chemical_name_systematic        'Y Al3 (B O3)4'
_space_group_IT_number           155
_symmetry_space_group_name_Hall  'R 3 2"'
_symmetry_space_group_name_H-M   'R 3 2 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   9.295
_cell_length_b                   9.295
_cell_length_c                   7.243
_cell_volume                     541.936
_citation_journal_id_ASTM        ZSTKAI
_cod_data_source_file            Belokoneva_ZSTKAI_1981_1398.cif
_cod_data_source_block           Al3B4O12Y1
_cod_original_cell_volume        541.9359
_cod_original_formula_sum        'Al3 B4 O12 Y1'
_cod_database_code               1529621
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+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
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
B2 B+3 0.4436 0 0.5 1 0.0
Al1 Al+3 0.5554 0 0 1 0.0
Y1 Y+3 0 0 0 1 0.0
O1 O-2 0.8512 0 0.5 1 0.0
O2 O-2 0.5907 0 0.5 1 0.0
B1 B+3 0 0 0.5 1 0.0
O3 O-2 0.4499 0.1498 0.4786 1 0.0
