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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/70/2107098.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_2107098
loop_
_publ_author_name
'Mazurier, A.'
'Etienne, J.'
_publ_section_title
;
 Structure cristalline de La Ge S5
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              817
_journal_page_last               821
_journal_volume                  29
_journal_year                    1973
_chemical_formula_sum            'Ge La2 S5'
_chemical_name_systematic        'La2 Ge S5'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ac'
_symmetry_space_group_name_H-M   'P 1 1 21/a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                101.39
_cell_formula_units_Z            4
_cell_length_a                   7.893
_cell_length_b                   7.641
_cell_length_c                   12.702
_cell_volume                     750.976
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Mazurier_ACBCAR_1973_653.cif
_cod_data_source_block           Ge1La2S5
_cod_original_cell_volume        750.9757
_cod_original_sg_symbol_Hall     '-P 2ybc (z,x,y)'
_cod_original_formula_sum        'Ge1 La2 S5'
_cod_database_code               2107098
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
-x,-y,-z
x-1/2,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
S5 S-2 0.5474 0.5349 0.2326 1 0.0
S4 S-2 0.6977 0.1287 0.2051 1 0.0
S3 S-2 0.2163 0.5784 0.0061 1 0.0
La1 La+3 0.0419 0.2395 0.0935 1 0.0
La2 La+3 0.3649 0.8401 0.1667 1 0.0
Ge1 Ge+4 0.5912 0.338 0.1165 1 0.0
S2 S-2 0.5004 0.8613 0.379 1 0.0
S1 S-2 0.3815 0.1706 0.0259 1 0.0
