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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/62/1526219.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_1526219
loop_
_publ_author_name
'Gurbanova, O.A.'
'Rastsvetaeva, R.K.'
'Chukanov, N.V.'
_publ_section_title
;
 Crystal structure of a new member of the brackebushite group Pb2 Fe (V
 O4)2 (O H)
;
_journal_name_full               'Doklady Akad. Nauk'
_journal_page_first              204
_journal_page_last               207
_journal_volume                  378
_journal_year                    2001
_chemical_formula_sum            'Al0.1 Fe0.75 H Mn0.15 O9 Pb1.8 V2 Zn0.2'
_chemical_name_systematic
'(Pb1.8 Zn0.2) (Mn0.15 Al0.1 Fe0.75) (V O4)2 (O H)'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 111.1
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.782
_cell_length_b                   6.148
_cell_length_c                   7.628
_cell_volume                     384.236
_citation_journal_id_ASTM        DAKNEQ
_cod_data_source_file            Gurbanova_DAKNEQ_2001_1038.cif
_cod_data_source_block           H1Al0.1Fe0.75Mn0.15O9Pb1.8V2Zn0.2
_cod_original_cell_volume        384.2359
_cod_original_formula_sum        'H1 Al0.1 Fe0.75 Mn0.15 O9 Pb1.8 V2 Zn0.2'
_cod_database_code               1526219
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
x,-y-1/2,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
V1 V+5 0.8267 0.75 0.5543 1 0.0
O7 O-2 0.071 0.75 0.17 1 0.0
O6 O-2 0.536 0.75 0.076 1 0.0
Pb1 Pb+2 0.4028 0.75 0.3271 0.8 0.0
O4 O-2 0.551 0.75 0.733 1 0.0
O3 O-2 0.937 0.75 0.795 1 0.0
Pb2 Pb+2 0.2504 0.75 0.7346 1 0.0
O1 O-2 0.7 0.973 0.494 1 0.0
O5 O-2 0.216 0.016 -0.011 1 0.0
O2 O-2 0.958 0.75 0.45 1 0.0
Al1 Al+3 0 0 0 0.1 0.0
Zn1 Zn+2 0.4028 0.75 0.3271 0.2 0.0
Mn1 Mn+3 0 0 0 0.15 0.0
Fe1 Fe+3 0 0 0 0.75 0.0
V2 V+5 0.6648 0.75 0.9588 1 0.0
