#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/63/9016332.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_9016332
loop_
_publ_author_name
'Andress, K.'
'Carpenter, C.'
_publ_section_title
;
 Kristallhydrate. II.Die Struktur von Chromchlorid- und
 Aluminiumchloridhexahydrat.
 _cod_database_code 1010199
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              446
_journal_page_last               463
_journal_volume                  87
_journal_year                    1934
_chemical_formula_sum            'Cl3 Cr O6'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-P 3* 2n'
_symmetry_space_group_name_H-M   'R -3 c :R'
_cell_angle_alpha                97.00
_cell_angle_beta                 97.00
_cell_angle_gamma                97.00
_cell_length_a                   7.95
_cell_length_b                   7.95
_cell_length_c                   7.95
_cell_formula_units_Z            2
_cell_volume                     490.207
_database_code_amcsd             0017135
_exptl_crystal_density_diffrn    1.723
_cod_duplicate_entry             1010199
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_original_formula_sum        'Cr Cl3 O6'
_cod_database_code               9016332
_amcsd_formula_title             'Cl3 Cr H12 O6'
loop_
_space_group_symop_operation_xyz
x,y,z
1/2-x,1/2-z,1/2-y
-z,-x,-y
1/2+y,1/2+x,1/2+z
y,z,x
1/2-z,1/2-y,1/2-x
-x,-y,-z
1/2+x,1/2+z,1/2+y
z,x,y
1/2-y,1/2-x,1/2-z
-y,-z,-x
1/2+z,1/2+y,1/2+x
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Cr1 0.00000 0.00000 0.00000
Cl1 0.51000 -0.01000 0.25000
O1 0.51000 0.41000 0.96000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0017135
