#------------------------------------------------------------------------------
#$Date: 2016-02-13 13:50:18 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176428 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/48/1524854.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_1524854
loop_
_publ_author_name
'Marezio, M.'
'Dernier, P.D.'
'Corenzwit, E.'
'Remeika, J.P.'
'Matthias, B.T.'
_publ_section_title
;
 Superconductivity of ternary sulfides and the structure of Pb Mo6 S8
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              657
_journal_page_last               657
_journal_volume                  8
_journal_year                    1973
_chemical_formula_sum            'Mo6 Pb0.92 S20'
_chemical_name_systematic        'Mo6 Pb0.92 S4.25'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-P 3*'
_symmetry_space_group_name_H-M   'R -3 :R'
_cell_angle_alpha                89.37
_cell_angle_beta                 89.37
_cell_angle_gamma                89.37
_cell_formula_units_Z            1
_cell_length_a                   6.548
_cell_length_b                   6.548
_cell_length_c                   6.548
_cell_volume                     280.703
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Marezio_MRBUAC_1973_116.cif
_cod_data_source_block           Mo6Pb0.92S20
_cod_original_cell_volume        280.7035
_cod_original_sg_symbol_Hall     '-R 3 (-y+z,x+z,-x+y+z)'
_cod_database_code               1524854
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
S2 S 0.3832 0.1256 0.7429 3 0.0
Pb1 Pb 0 0 0 0.92 0.0
Mo1 Mo 0.2273 0.4159 0.5617 1 0.0
S1 S 0.2424 0.2424 0.2424 1 0.0
