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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/1/51/12/1511200.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_1511200
loop_
_publ_author_name
'Ftini, M. M.'
'Haddad, A.'
'Jouini, T.'
_publ_section_title
;
 Synthesis and crystal structure of K₃Sb₄BO₁₃
;
_journal_issue                   1
_journal_name_full               'Journal of Chemical Crystallography'
_journal_page_first              49
_journal_page_last               53
_journal_paper_doi               10.1023/A:1009598116581
_journal_volume                  30
_journal_year                    2000
_chemical_formula_sum            'B K3 O13 Sb4'
_chemical_name_systematic        'K3 (B Sb4 O13)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                82.00(1)
_cell_angle_beta                 99.77(1)
_cell_angle_gamma                117.08(1)
_cell_formula_units_Z            2
_cell_length_a                   7.133(1)
_cell_length_b                   7.232(1)
_cell_length_c                   13.259(2)
_cell_volume                     598.665
_citation_journal_id_ASTM        JCCYEV
_cod_data_source_file            boron0-1_307.cif
_cod_data_source_block           B1K3O13Sb4
_cod_original_formula_sum        'B1 K3 O13 Sb4'
_cod_database_code               1511200
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-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
O12 O-2 -0.0521 -0.3506 -0.0645 1 0.0
K2 K+1 0.0993 -0.6047 0.44523 1 0.0
O2 O-2 0.2267 -0.1808 0.0693 1 0.0
Sb2 Sb+5 0.16796 -0.70613 0.20676 1 0.0
O9 O-2 -0.5367 -0.9863 0.2509 1 0.0
K3 K+1 0.3095 -0.7802 -0.03259 1 0.0
O7 O-2 0.448 -0.6164 0.16 1 0.0
B1 B+3 -0.1591 -0.7303 0.0228 1 0.0
Sb3 Sb+5 0.16304 -0.20975 0.20951 1 0.0
O13 O-2 0.1613 -0.1949 0.3609 1 0.0
K1 K+1 0.2939 -0.7821 -0.30652 1 0.0
O3 O-2 0.0649 -0.9931 0.1694 1 0.0
O4 O-2 0.3257 -0.327 0.6375 1 0.0
O11 O-2 -0.3233 -0.7511 0.0727 1 0.0
O5 O-2 0.2694 -0.4181 0.2463 1 0.0
O1 O-2 -0.5924 0.0846 0.5391 1 0.0
Sb4 Sb+5 -0.31802 -0.69116 0.21278 1 0.0
O6 O-2 0.2583 -0.7753 0.35 1 0.0
O10 O-2 -0.136 -0.3984 0.1925 1 0.0
O8 O-2 -0.103 -0.7893 0.2589 1 0.0
Sb1 Sb+5 0.5804 -0.06652 0.60509 1 0.0
