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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/1/53/01/1530140.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_1530140
loop_
_publ_author_name
'Kazanskaya, E.V.'
'Sandomirskii, P.A.'
'Belov, N.V.'
'Simonov, M.A.'
_publ_section_title
;
 The crystal structure of Li Cd B O3
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1340
_journal_page_last               1343
_journal_volume                  238
_journal_year                    1978
_chemical_formula_sum            'B Cd Li O3'
_chemical_name_systematic        'Li Cd (B O3)'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   8.309
_cell_length_b                   8.309
_cell_length_c                   3.259
_cell_volume                     194.855
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Kazanskaya_DANKAS_1978_1238.cif
_cod_data_source_block           B1Cd1Li1O3
_cod_original_cell_volume        194.8554
_cod_original_formula_sum        'B1 Cd1 Li1 O3'
_cod_database_code               1530140
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+y,-x,-z
-y,x-y,z
x,y,-z
-x+y,-x,z
-y,x-y,-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
O3 O-2 0.189 0.06 0 1 0.0
O1 O-2 0.247 0.475 0.5 1 0.0
B1 B+3 0 0 0 1 0.0
O2 O-2 0.582 0.438 0.5 1 0.0
B2 B+3 0.6667 0.3333 0.5 1 0.0
Cd1 Cd+2 0.3651 0.368 0 1 0.0
Li1 Li+1 0.004 0.293 0.5 1 0.0
B3 B+3 0.3333 0.6667 0.5 1 0.0
