#------------------------------------------------------------------------------
#$Date: 2015-10-09 18:12:50 +0300 (Fri, 09 Oct 2015) $
#$Revision: 162365 $
#$URL: svn://www.crystallography.net/cod/cif/2/02/01/2020143.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2020143
loop_
_publ_author_name
'Mazurier, A.'
'Thevet, F.'
'Jaulmes, S.'
_publ_section_title
;
 Structure de pentasulfure de digallium et de dietain, Ga2 Sn2 S5
;
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              814
_journal_page_last               816
_journal_volume                  39
_journal_year                    1983
_chemical_formula_sum            'Ga2 S5 Sn2'
_chemical_name_systematic        'Ga2 Sn2 S5'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.41
_cell_length_b                   6.22
_cell_length_c                   10.88
_cell_volume                     839.829
_citation_journal_id_ASTM        ACSCEE
_cod_data_source_file            Mazurier_ACSCEE_1983_240.cif
_cod_data_source_block           Ga2S5Sn2
_cod_original_cell_volume        839.8293
_cod_database_code               2020143
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x+1/2,y+1/2,z+1/2
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
S5 S-2 0.8289 0.964 0.4668 1 0.0
Sn2 Sn+2 0.9548 0.0508 0.982 1 0.0
S3 S-2 0.9405 0.6377 0.0364 1 0.0
S2 S-2 0.9969 0.138 0.2246 1 0.0
S1 S-2 0.7142 0.9879 0.1353 1 0.0
Ga2 Ga+3 0.7321 0.1374 0.6129 1 0.0
S4 S-2 0.2729 0.0066 0.3046 1 0.0
Sn1 Sn+2 0.4788 0.0545 0.7554 1 0.0
Ga1 Ga+3 0.6804 0.645 0.7824 1 0.0
