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#$Date: 2024-04-25 17:59:02 +0300 (Thu, 25 Apr 2024) $
#$Revision: 291351 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/25/9002583.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_9002583
loop_
_publ_author_name
'Witzke, T.'
'Zhen, S.'
'Seff, K.'
'Doering, T.'
'Nasdala, L.'
'Kolitsch, U.'
_publ_section_title
;
 Ronneburgite, K2MnV4O12, a new mineral from Ronneburg, Thuringia, Germany:
 Description and crystal structure
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1081
_journal_page_last               1086
_journal_volume                  86
_journal_year                    2001
_chemical_formula_sum            'K2 Mn O12 V4'
_chemical_name_mineral           Ronneburgite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 109.74
_cell_angle_gamma                90
_cell_length_a                   8.183
_cell_length_b                   9.247
_cell_length_c                   8.651
_cell_formula_units_Z            2
_cell_volume                     616.138
_database_code_amcsd             0002672
_exptl_crystal_density_diffrn    2.851
_cod_original_formula_sum        'Mn V4 K2 O12'
_cod_database_code               9002583
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2-y,1/2+z
1/2-x,1/2+y,1/2-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Mn 0.00000 0.00000 0.00000
V1 0.16696 0.21242 0.37929
V2 -0.19886 0.44235 0.26056
K -0.14200 0.19750 0.59250
O1 0.18290 0.09150 0.54400
O2 -0.02470 0.31580 0.34350
O3 0.15180 0.11690 0.21300
O4 0.33890 0.31680 0.41420
O5 -0.33510 0.42640 0.36500
O6 -0.12720 0.60590 0.27270
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0002672
