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#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/76/1527664.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_1527664
loop_
_publ_author_name
'Koehl, P.'
'Reinen, D.'
'Schultze-Rhonhof, E.'
_publ_section_title
;
 Die Kristallstruktur von Perowskiten A2 Ni M O6. I. Das Sr2 (Ni Te) O6
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              129
_journal_page_last               143
_journal_volume                  378
_journal_year                    1970
_chemical_formula_sum            'Ni O6 Sr2 Te'
_chemical_name_systematic        'Sr2 Ni Te O6'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 54.67
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.649
_cell_length_b                   5.613
_cell_length_c                   5.581
_cell_volume                     246.599
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Koehl_ZAACAB_1970_1921.cif
_cod_data_source_block           Ni1O6Sr2Te1
_cod_original_cell_volume        246.5992
_cod_original_formula_sum        'Ni1 O6 Sr2 Te1'
_cod_database_code               1527664
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,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
O2 O-2 0.242 0 -0.242 1 0.0
Te1 Te+6 0 0 0 1 0.0
Sr1 Sr+2 0.25 0 0.25 1 0.0
O1 O-2 -0.0021 -0.2398 0.2417 1 0.0
Ni1 Ni+2 0 0 0.5 1 0.0
