#------------------------------------------------------------------------------
#$Date: 2015-07-14 00:52:02 +0200 (mar 14 de jul de 2015) $
#$Revision: 151433 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/65/2106576.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_2106576
loop_
_publ_author_name
'Omaly, J.'
'Kohlmuller, R.'
'Batail, P.'
'Chevalier, R.'
_publ_section_title
;
 Structure de l'oxyde de plomb et de rhodium Ob3 Rh7 O15
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              1040
_journal_page_last               1044
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'O15 Pb3 Rh7'
_chemical_name_systematic        'Pb3 Rh7 O15'
_space_group_IT_number           193
_symmetry_space_group_name_Hall  '-P 6c 2'
_symmetry_space_group_name_H-M   'P 63/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            4
_cell_length_a                   10.342
_cell_length_b                   10.342
_cell_length_c                   13.27
_cell_volume                     1229.166
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Omaly_ACBCAR_1980_72.cif
_cod_data_source_block           O15Pb3Rh7
_cod_database_code               2106576
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
x-y,-y,-z+1/2
x,x-y,-z
y,x,-z+1/2
-x+y,y,-z
-x,-x+y,-z+1/2
-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
-x+y,y,z-1/2
-x,-x+y,z
-y,-x,z-1/2
x-y,-y,z
x,x-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
Pb2 Pb+2 0.6048 0 0.25 1 0.0
Rh2 Rh+3 0.3333 0.6667 0.1489 1 0.0
O1 O-2 0.1579 0.6659 0.0808 1 0.0
O4 O-2 0.8294 0 0.0795 1 0.0
Pb1 Pb+2 0.2635 0 0.25 1 0.0
O2 O-2 0.3343 0 0.0804 1 0.0
Rh1 Rh+3 0 0 0 1 0.0
O3 O-2 0.5201 0.1784 0.25 1 0.0
Rh4 Rh+3 0.1684 -0.1684 0 1 0.0
Rh3 Rh+4 0.5 0 0 1 0.0
