#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/63/1536398.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_1536398
loop_
_publ_author_name
'Kalman, S.'
_publ_section_title
;
 Az a-bayerit Al (O H)3 kristalyszerkezete
;
_journal_name_full               'Magyar Kemiai Folyoirat'
_journal_page_first              314
_journal_page_last               318
_journal_volume                  61
_journal_year                    1955
_chemical_formula_sum            'Al H3 O3'
_chemical_name_systematic        'Al (O H)3'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.01
_cell_length_b                   8.68
_cell_length_c                   4.76
_cell_volume                     206.997
_citation_journal_id_ASTM        MGKFA3
_cod_data_source_file            Kalman_MGKFA3_1955_594.cif
_cod_data_source_block           H3Al1O3
_cod_original_cell_volume        206.9972
_cod_original_formula_sum        'H3 Al1 O3'
_cod_database_code               1536398
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-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
Al1 Al+3 0 0.333 0 1 0.0
O1 O-2 0.333 0 -0.22 1 0.0
O2 O-2 0.1667 0.1667 0.22 1 0.0
