#------------------------------------------------------------------------------
#$Date: 2024-05-09 11:47:05 +0300 (Thu, 09 May 2024) $
#$Revision: 291792 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/12/9011214.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9011214
loop_
_publ_author_name
'Jones, P. G.'
'Sheldrick, G. M.'
'Schwarzmann, E.'
_publ_section_title
;
 Antimony(III) arsenic(V) oxide
;
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              1923
_journal_page_last               1925
_journal_paper_doi               10.1107/S0567740880007492
_journal_volume                  36
_journal_year                    1980
_chemical_formula_structural     AsSbO4
_chemical_formula_sum            'As O4 Sb'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 93.55
_cell_angle_gamma                90
_cell_length_a                   4.794
_cell_length_b                   6.925
_cell_length_c                   5.307
_cell_formula_units_Z            2
_cell_volume                     175.846
_database_code_amcsd             0009713
_exptl_crystal_density_diffrn    4.923
_cod_original_formula_sum        'As Sb O4'
_cod_database_code               9011214
_amcsd_formula_title             AsSbO4
loop_
_space_group_symop_operation_xyz
x,y,z
x,1/2-y,z
-x,1/2+y,-z
-x,-y,-z
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
As 0.01300 0.00100 0.01000 0.00000 -0.00200 0.00000
Sb 0.01400 0.02000 0.01100 0.00000 0.00200 0.00000
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
As 0.71720 0.25000 0.11010 0.00800
Sb 0.20670 0.25000 0.67820 0.01500
O1 0.83480 0.25000 0.81900 0.02700
O2 0.36990 0.25000 0.03750 0.03500
O3 0.80690 0.06250 0.28470 0.04200
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0009713
