#------------------------------------------------------------------------------
#$Date: 2015-10-07 18:11:05 +0300 (Wed, 07 Oct 2015) $
#$Revision: 160793 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/41/4344191.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_4344191
loop_
_publ_author_name
'Bennett, M.J.'
'Brencic, J.V.'
'Cotton, F.A.'
_publ_section_title
;
 The preparation and structural characterization of trirubidium
 octachlorodimolybdenum. A binuclear structure with strong metal-metal
 bonding.
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1060
_journal_page_last               1065
_journal_volume                  8
_journal_year                    1969
_chemical_formula_sum            'Cl8 Mo2 Rb3'
_chemical_name_systematic        'Rb3 (Mo2 Cl8)'
_space_group_IT_number           190
_symmetry_space_group_name_Hall  'P -6c -2c'
_symmetry_space_group_name_H-M   'P -6 2 c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.19
_cell_length_b                   7.19
_cell_length_c                   16.662
_cell_volume                     745.960
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Bennett_INOCAJ_1969_1056.cif
_cod_data_source_block           Cl8Mo2Rb3
_cod_original_cell_volume        745.96
_cod_database_code               4344191
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+y,-x,-z+1/2
-y,x-y,z
x,y,-z+1/2
-x+y,-x,z
-y,x-y,-z+1/2
y,x,z+1/2
x-y,-y,-z
-x,-x+y,z+1/2
y,x,-z
x-y,-y,z+1/2
-x,-x+y,-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
Mo1 Mo+2 0.3333 0.6667 0.1786 1 0.0
Rb1 Rb+1 0.3333 0.6667 0.5721 1 0.0
Cl1 Cl-1 0.474 0.0166 0.25 0.6667 0.0
Rb2 Rb+1 0 0 0.25 1 0.0
Cl2 Cl-1 0.1805 0.3491 0.0987 1 0.0
