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#$Date: 2015-10-14 12:19:35 +0300 (Wed, 14 Oct 2015) $
#$Revision: 168194 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/10/42/8104281.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_8104281
loop_
_publ_author_name
'Wiedemeier, H.'
'von Schnering, H.G.'
_publ_section_title
;
 Refinement of the structures of Ge S, Ge Se, Sn S, and Sn Se
;
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, 
Kristallchemie (145,1977-148,1979)
;
_journal_page_first              295
_journal_page_last               303
_journal_volume                  148
_journal_year                    1978
_chemical_formula_sum            'S Sn'
_chemical_name_systematic        'Sn S'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.2
_cell_length_b                   3.987
_cell_length_c                   4.334
_cell_volume                     193.532
_citation_journal_id_ASTM        ZKKKAJ
_cod_data_source_file            Wiedemeier_ZKKKAJ_1978_1760.cif
_cod_data_source_block           S1Sn1
_cod_original_cell_volume        193.5322
_cod_chemical_formula_sum_orig   'S1 Sn1'
_cod_database_code               8104281
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
x,-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
S1 S 0.8508 0.25 0.4793 1 0.0
Sn1 Sn 0.1194 0.25 0.1198 1 0.0