#------------------------------------------------------------------------------
#$Date: 2015-09-12 16:42:21 +0200 (Sat 12 de Sep de 2015) $
#$Revision: 155988 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/07/1530783.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_1530783
loop_
_publ_author_name
'Sirotinkin, S.P.'
'Pokrovskii, A.N.'
'Kovba, L.M.'
_publ_section_title
;
 Crystal structures of certain double and simple rare earth sulfates
;
_journal_name_full               Kristallografiya
_journal_page_first              385
_journal_page_last               389
_journal_volume                  26
_journal_year                    1981
_chemical_formula_sum            'Er2 O12 S3'
_chemical_name_systematic        'Er2 (S O4)3'
_space_group_IT_number           60
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.442
_cell_length_b                   9.001
_cell_length_c                   9.837
_cell_volume                     1101.650
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Sirotinkin_KRISAJ_1981_1964.cif
_cod_data_source_block           Er2O12S3
_cod_original_cell_volume        1101.65
_cod_database_code               1530783
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x,y,-z+1/2
-x,-y,-z
x-1/2,y-1/2,-z-1/2
-x-1/2,y-1/2,z
x,-y,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
O4 O-2 0.257 0.371 0.395 1 0.0
S1 S+6 0 0.47 0.25 1 0.0
O3 O-2 0.393 0.394 0.219 1 0.0
O1 O-2 0.121 0.053 0.404 1 0.0
Er1 Er+3 0.3773 0.2622 0.039 1 0.0
O6 O-2 0.397 0.058 0.2 1 0.0
S2 S+6 0.361 0.394 0.368 1 0.0
O2 O-2 0.433 0.305 0.436 1 0.0
O5 O-2 0.053 0.363 0.343 1 0.0
