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#$Date: 2017-09-11 16:25:09 +0300 (Mon, 11 Sep 2017) $
#$Revision: 200452 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/00/82/1008207.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_1008207
loop_
_publ_author_name
'Averbuch-Pouchot, M T'
_publ_section_title
;
Crystal Chemistry of Some Addition Compounds of Alkali Iodates with
Telluric Acid
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              368
_journal_page_last               378
_journal_paper_doi               10.1016/S0022-4596(83)80015-2
_journal_volume                  49
_journal_year                    1983
_chemical_formula_structural     'N H4 I O3 Te (O H)6 (H2 O)'
_chemical_formula_sum            'H12 I N O10 Te'
_chemical_name_systematic        'Ammonium iodate telluric acid'
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                88.84(5)
_cell_angle_beta                 90.81(5)
_cell_angle_gamma                104.48(5)
_cell_formula_units_Z            2
_cell_length_a                   10.97(1)
_cell_length_b                   6.916(5)
_cell_length_c                   6.550(4)
_cell_volume                     481.0
_refine_ls_R_factor_all          0.046
_cod_database_code               1008207
_cod_depositor_comments
;
 Removing dummy H atoms since the hydrogen atoms they represent are already
 marked using the _atom_site_attached_hydrogens data item.

 Antanas Vaitkus,
 2017-09-11
;
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
I1 I5+ 2 i 0.78437(4) 0.22754(6) 0.21609(6) 1. 0 d
Te1 Te6+ 2 i 0.30046(4) 0.41653(6) 0.28120(6) 1. 0 d
N1 N3- 2 i -0.0035(7) 0.815(1) 0.246(1) 1. 4 d
O1 O2- 2 i 0.2441(5) 0.6494(8) 0.2067(8) 1. 1 d
O2 O2- 2 i 0.4742(5) 0.5552(9) 0.2313(10) 1. 1 d
O3 O2- 2 i 0.3630(5) 0.1909(8) 0.3553(9) 1. 1 d
O4 O2- 2 i 0.3173(6) 0.5105(9) 0.5556(8) 1. 1 d
O5 O2- 2 i 0.2875(7) 0.3538(9) -0.0016(8) 1. 1 d
O6 O2- 2 i 0.1335(6) 0.2623(9) 0.3353(10) 1. 1 d
O7 O2- 2 i 0.1776(5) 0.9718(8) 0.9223(9) 1. 0 d
O8 O2- 2 i 0.0647(5) 0.5981(9) 0.7827(10) 1. 0 d
O9 O2- 2 i 0.2113(6) 0.8744(8) 0.5271(8) 1. 0 d
O10 O2- 2 i 0.4704(6) 0.0172(10) 0.7944(11) 1. 2 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
I5+ 5.000
Te6+ 6.000
N3- -3.000
O2- -2.000
