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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/1/54/03/1540303.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_1540303
loop_
_publ_author_name
'Koppelhuber-Bitschnau, B.'
'Mautner, F.A.'
'Yvon, K.'
_publ_section_title
;
 Low-temperature structural phase transition in Sr Mo6 S8 studied by x-tay
 powder diffraction
;
_journal_name_full
;
Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)
;
_journal_page_first              505
_journal_page_last               509
_journal_volume                  121
_journal_year                    1990
_chemical_formula_sum            'Mo6 S8 Sr'
_chemical_name_systematic        'Sr (Mo6 S8)'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-P 3*'
_symmetry_space_group_name_H-M   'R -3 :R'
_cell_angle_alpha                88.998
_cell_angle_beta                 88.998
_cell_angle_gamma                88.998
_cell_formula_units_Z            1
_cell_length_a                   6.563
_cell_length_b                   6.563
_cell_length_c                   6.563
_cell_volume                     282.560
_citation_journal_id_ASTM        MOCMB7
_cod_data_source_file            Koppelhuber-Bitschnau_MOCMB7_1990_1174.cif
_cod_data_source_block           Mo6S8Sr1
_cod_original_cell_volume        282.5597
_cod_original_sg_symbol_Hall     '-R 3 (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'Mo6 S8 Sr1'
_cod_database_code               1540303
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
z,x,y
y,z,x
-x,-y,-z
-z,-x,-y
-y,-z,-x
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 0.379 0.1308 0.7357 1 0.0
S2 S-2 0.241 0.241 0.241 1 0.0
Mo1 Mo+2 0.229 0.4192 0.5631 1 0.0
Sr1 Sr+2 0 0 0 1 0.0
