#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/59/1525996.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_1525996
loop_
_publ_author_name
'Mentre, O.'
'Kanke, Y.'
'Kita, E.'
'Dhaussy, A.C.'
'Hata, Y.'
'Conflant, P.'
_publ_section_title
;
 Structural and magnetic transitions in Pb V6 O11
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              1744041
_journal_page_last               17440411
_journal_volume                  64
_journal_year                    2001
_chemical_formula_sum            'O11 Pb V6'
_chemical_name_systematic        'Pb V6 O11'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.789
_cell_length_b                   5.789
_cell_length_c                   13.226
_cell_volume                     383.854
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Mentre_PRBMDO_2001_1907.cif
_cod_data_source_block           O11Pb1V6
_cod_original_cell_volume        383.8542
_cod_original_formula_sum        'O11 Pb1 V6'
_cod_database_code               1525996
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
-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
Pb1 Pb+2 0.3333 0.6667 0.25 1 0.0
V3 V+3 0.3333 0.6667 0.75 1 0.0
O3 O-2 0.3333 0.6667 0.588 1 0.0
O2 O-2 0.152 0.304 0.75 1 0.0
O1 O-2 0.1724 0.3448 0.0808 1 0.0
V2 V+4 0 0 0.1467 1 0.0
V1 V+3 0.5 0 0 1 0.0
