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#$Date: 2024-05-02 13:48:35 +0300 (Thu, 02 May 2024) $
#$Revision: 291455 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/77/9007734.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9007734
loop_
_publ_author_name
'Kubel, F.'
'Yvon, K.'
_publ_section_title
;
 Structural phase transitions in Chevrel phases containing divalent
 metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8
 at low temperature
 Sample: T = 112 K
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              181
_journal_page_last               186
_journal_paper_doi               10.1107/S0108270189005913
_journal_volume                  46
_journal_year                    1990
_chemical_formula_structural     EuMo6S8
_chemical_formula_sum            'Eu 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                88.809
_cell_angle_beta                 88.809
_cell_angle_gamma                88.809
_cell_length_a                   6.5378
_cell_length_b                   6.5378
_cell_length_c                   6.5378
_cell_formula_units_Z            1
_cell_volume                     279.265
_database_code_amcsd             0010094
_diffrn_ambient_temperature      112
_exptl_crystal_density_diffrn    5.852
_cod_original_sg_symbol_H-M      'R -3'
_cod_database_code               9007734
_amcsd_formula_title             EuMo6S8
loop_
_space_group_symop_operation_xyz
x,y,z
-z,-x,-y
y,z,x
-x,-y,-z
z,x,y
-y,-z,-x
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Eu 0.00450 0.00450 0.00450 -0.00210 -0.00210 -0.00210
Mo 0.00180 0.00160 0.00140 -0.00080 -0.00030 -0.00060
S1 0.00220 0.00340 0.00350 -0.00130 -0.00050 -0.00050
S2 0.00400 0.00400 0.00400 -0.00010 -0.00010 -0.00010
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Eu 0.00000 0.00000 0.00000
Mo 0.22840 0.56297 0.41866
S1 0.12444 0.38158 0.74434
S2 0.24490 0.24490 0.24490
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0010094
