#------------------------------------------------------------------------------
#$Date: 2024-05-02 12:48:35 +0200 (Thu 02 de May de 2024) $
#$Revision: 291455 $
#$URL: svn://www.crystallography.net/cod/cif/9/00/78/9007817.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9007817
loop_
_publ_author_name
'Okuda, M.'
'Ishihara, M.'
'Yamanaka, M.'
'Ohba, S.'
'Saito, Y.'
_publ_section_title
;
 Structures of lead chlorite, magnesium chlorite hexahydrate
 and silver chlorite
 Sample: Compound (I)
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              1755
_journal_page_last               1759
_journal_paper_doi               10.1107/S010827019000066X
_journal_volume                  46
_journal_year                    1990
_chemical_formula_structural     Pb(ClO2)2
_chemical_formula_sum            'Cl2 O2 Pb'
_space_group_IT_number           68
_space_group_name_Hall           'C 2 2 -1ac'
_space_group_name_H-M_alt        'C c c e :1'
_symmetry_space_group_name_Hall  'C 2 2 -1ac'
_symmetry_space_group_name_H-M   'C c c e :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   6.004
_cell_length_b                   12.504
_cell_length_c                   6.010
_cell_formula_units_Z            8
_cell_volume                     451.195
_exptl_crystal_density_diffrn    9.130
_cod_original_sg_symbol_H-M      'C c c a'
_cod_original_formula_sum        'Pb Cl2 O2'
_cod_database_code               9007817
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
1/2+x,1/2+y,z
x,1/2-y,1/2+z
1/2+x,-y,1/2+z
-x,y,-z
1/2-x,1/2+y,-z
-x,1/2+y,1/2+z
1/2-x,+y,1/2+z
x,-y,-z
1/2+x,1/2-y,-z
x,1/2+y,1/2-z
1/2+x,+y,1/2-z
-x,-y,z
1/2-x,1/2-y,z
-x,1/2-y,1/2-z
1/2-x,-y,1/2-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Pb 0.00000 0.25000 0.25000 0.01646
Cl 0.00000 -0.07360 0.25000 0.02153
O -0.15510 -0.14370 0.40360 0.02406
_database_code_amcsd 0010179
