#------------------------------------------------------------------------------
#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/2/00/22/2002296.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_2002296
loop_
_publ_author_name
'Ploetz, K B'
'Mueller-Buschbaum, Hk'
_publ_section_title
;
Synthese und Aufbau von Pb Al2 O4 und Pb Ga2 4
;
_journal_name_full
;
Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_page_first              38
_journal_page_last               44
_journal_paper_doi               10.1002/zaac.19824880104
_journal_volume                  488
_journal_year                    1982
_chemical_formula_structural     'Al2 Pb O4'
_chemical_formula_sum            'Al2 O4 Pb'
_chemical_name_systematic        'Dialuminium lead oxide'
_space_group_IT_number           1
_symmetry_cell_setting           triclinic
_symmetry_equiv_pos_as_xyz       x,y,z
_symmetry_Int_Tables_number      1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                90.(0)
_cell_angle_beta                 118.78
_cell_angle_gamma                90.(0)
_cell_formula_units_Z            2
_cell_length_a                   5.268
_cell_length_b                   8.458
_cell_length_c                   5.07
_cell_volume                     198.0
_refine_ls_R_factor_all          0.047
_cod_database_code               2002296
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+ 1 a 0.9401 0.75 0.9698 1. 0 d
Pb2 Pb2+ 1 a 0.0598 0.25 0.0296 1. 0 d
Al1 Al3+ 1 a 0.6547 0.9454 0.2949 1. 0 d
Al2 Al3+ 1 a 0.3417 0.0537 0.6382 1. 0 d
Al3 Al3+ 1 a 0.3425 0.4456 0.6391 1. 0 d
Al4 Al3+ 1 a 0.656 0.5538 0.2945 1. 0 d
O1 O2- 1 a 0.6183 0.9432 0.6215 1. 0 d
O2 O2- 1 a 0.6196 0.5554 0.6218 1. 0 d
O3 O2- 1 a 0.9988 0.0001 0.3581 1. 0 d
O4 O2- 1 a 0.9995 0.4988 0.3586 1. 0 d
O5 O2- 1 a 0.3812 0.0561 0.0031 1. 0 d
O6 O2- 1 a 0.3892 0.4425 0.0038 1. 0 d
O7 O2- 1 a 0.3705 0.2505 0.533 1. 0 d
O8 O2- 1 a 0.631 0.7502 0.1623 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
Pb2+ 2.000
Al3+ 3.000
O2- -2.000
