#------------------------------------------------------------------------------
#$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $
#$Revision: 201954 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/01/09/1010956.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_1010956
loop_
_publ_author_name
'Colby, M Y'
'LaCoste, L J B'
_publ_section_title              'The crystal structure of Cerussite'
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              299
_journal_page_last               309
_journal_volume                  84
_journal_year                    1933
_chemical_formula_structural     'Pb C O3'
_chemical_formula_sum            'C O3 Pb'
_chemical_name_mineral           Cerussite
_chemical_name_systematic        'Lead carbonate'
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n S2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.166
_cell_length_b                   8.468
_cell_length_c                   6.146
_cell_volume                     268.9
_cod_database_code               1010956
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,1/2-y,1/2+z
1/2+x,-y,1/2-z
1/2-x,1/2+y,-z
1/2-x,-y,1/2-z
1/2+x,1/2+y,-z
-x,y,z
x,1/2-y,1/2+z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
Pb1 Pb2+ 4 c 0. 0.417 0. 1. 0 d
C1 C4+ 4 c 0. 0.764 0.153 1. 0 d
O1 O2- 4 c 0. 0.909 0.153 1. 0 d
O2 O2- 8 d 0.199 0.691 0.153 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
Pb2+ 2.000
C4+ 4.000
O2- -2.000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 ChemSpider 11234
