#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/60/1536015.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_1536015
loop_
_publ_author_name
'James, M.'
'Cassidy, D.'
'Goossens, D.J.'
'Withers, R.L.'
_publ_section_title
;
 The phase diagram and tetragonal superstructures of the rare earth
 cobaltate phases Ln1-x Srx Co O3-d (Ln = La(3+), Pr(3+), Nd(3+), Sm(3+),
 Gd(3+), Y(3+), Ho(3+), Dy(3+), Er(3+), Tm(3+) and Yb(3+))
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1886
_journal_page_last               1895
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Co Gd0.1 O2.76 Sr0.9'
_chemical_name_systematic        'Gd0.1 Sr0.9 (Co O2.76)'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   7.69
_cell_length_b                   7.69
_cell_length_c                   15.421
_cell_volume                     911.938
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            James_JSSCBI_2004_1423.cif
_cod_data_source_block           Co1Gd0.1O2.76Sr0.9
_cod_original_cell_volume        911.9378
_cod_original_formula_sum        'Co1 Gd0.1 O2.76 Sr0.9'
_cod_database_code               1536015
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+1/2,z+1/2
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 0.259 0 0 0.52 0.0
Gd1 Gd+3 0 0 0.1335 0.4 0.0
Co2 Co+3 0.25 0.25 0.25 1 0.0
Co1 Co+3 0.2417 0.2417 0 1 0.0
Sr1 Sr+2 0 0 0.1335 0.6 0.0
O4 O-2 0 0.267 0.259 1 0.0
O3 O-2 0.243 0.5 0 1 0.0
O1 O-2 0.235 0.235 0.119 1 0.0
Sr2 Sr+2 0 0 0.6295 1 0.0
Sr3 Sr+2 0 0.5 0.1327 1 0.0
