#------------------------------------------------------------------------------
#$Date: 2013-05-09 16:53:25 +0300 (Thu, 09 May 2013) $
#$Revision: 86000 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/63/9016394.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_9016394
loop_
_publ_author_name
'Bellanca, A.'
_publ_section_title
;
 La struttura della cloromanganocalite
;
_journal_name_full               'Periodico di Mineralogia'
_journal_page_first              73
_journal_page_last               88
_journal_volume                  16
_journal_year                    1947
_chemical_formula_sum            'Cl6 K4 Mn'
_chemical_name_mineral           Chlormanganokalite
_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                89.53
_cell_angle_beta                 89.53
_cell_angle_gamma                89.53
_cell_length_a                   8.468
_cell_length_b                   8.468
_cell_length_c                   8.468
_cell_volume                     607.154
_database_code_amcsd             0019234
_exptl_crystal_density_diffrn    2.320
_[local]_cod_cif_authors_sg_H-M  'R -3 c'
_[local]_cod_chemical_formula_sum_orig 'K4 Mn Cl6'
_cod_database_code               9016394
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
K1 0.00000 0.00000 0.00000
K2 0.50000 0.00000 0.00000
Mn 0.25000 0.25000 0.25000
Cl 0.25000 0.25000 0.55000