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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/31/02/2310262.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2310262
loop_
_publ_author_name
'Wang, F.E.'
'Gilfrich, J.V.'
_publ_section_title
;
 The crystal structures of Lu Mn5 and the R Mn12 compounds (where R= Gd,
 Tb, Dy, Ho, Er and Tm)
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              476
_journal_page_last               481
_journal_volume                  21
_journal_year                    1966
_chemical_formula_sum            'Lu Mn5'
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.186
_cell_length_b                   5.186
_cell_length_c                   8.566
_cell_volume                     199.514
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Wang_ACCRA9_1966_1023.cif
_cod_data_source_block           Lu1Mn5
_cod_original_cell_volume        199.5141
_cod_original_formula_sum        'Lu1 Mn5'
_cod_database_code               2310262
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
y,x,z+1/2
-x+y,y,z
-x,-x+y,z+1/2
-y,-x,z
x-y,-y,z+1/2
x,x-y,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
Mn2 Mn 0.3333 0.6667 0.642 1 0.0
Mn3 Mn 0.167 0.833 0.953 1 0.0
Mn1 Mn 0 0 0.185 1 0.0
Lu1 Lu 0.3333 0.6667 0.25 1 0.0
