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#$Date: 2015-07-12 17:04:35 +0300 (Sun, 12 Jul 2015) $
#$Revision: 146659 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/56/1525631.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_1525631
loop_
_publ_author_name
'Belaya, S.V.'
'Vasil'eva, I.G.'
'Podberezskaya, N.V.'
'Pervukhina, N.V.'
'Eliseev, A.P.'
_publ_section_title
;
 Holmium polysulfides: crystal growth, structure and properties
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              26
_journal_page_last               33
_journal_volume                  323
_journal_year                    2001
_chemical_formula_sum            'Ho S1.885'
_chemical_name_systematic        'Ho S1.885'
_space_group_IT_number           129
_symmetry_space_group_name_Hall  '-P 4a 2a'
_symmetry_space_group_name_H-M   'P 4/n m m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.82
_cell_length_b                   3.82
_cell_length_c                   7.84
_cell_volume                     114.404
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Belaya_JALCEU_2001_1306.cif
_cod_data_source_block           Ho1S1.885
_cod_original_cell_volume        114.4044
_cod_chemical_formula_sum_orig   'Ho1 S1.885'
_cod_database_code               1525631
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x,z
-x+1/2,-y+1/2,z
y,-x+1/2,z
x+1/2,-y,-z
y+1/2,x+1/2,-z
-x,y+1/2,-z
-y,-x,-z
-x,-y,-z
y-1/2,-x,-z
x-1/2,y-1/2,-z
-y,x-1/2,-z
-x-1/2,y,z
-y-1/2,-x-1/2,z
x,-y-1/2,z
y,x,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
S1 S-2 0.25 0.25 0.6354 1 0.0
Ho1 Ho+3 0.25 0.25 0.273 1 0.0
S2 S-1 0.25 0.75 0 0.8864 0.0