#------------------------------------------------------------------------------
#$Date: 2016-02-14 15:26:36 +0100 (dom 14 de feb de 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/54/2105424.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_2105424
loop_
_publ_author_name
'Yvon, K.'
'Johnston, D.C.'
_publ_section_title
;
 Orthorhombic Lu Rh4 B4 -A new polytype of R T4 B4 stoichiometry
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              247
_journal_page_last               250
_journal_paper_doi               10.1107/S0567740882002490
_journal_volume                  38
_journal_year                    1982
_chemical_formula_sum            'B4 Lu Rh4'
_chemical_name_systematic        'Lu Rh4 B4'
_space_group_IT_number           68
_symmetry_space_group_name_Hall  '-C 2a 2ac'
_symmetry_space_group_name_H-M   'C c c a :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   7.41
_cell_length_b                   22.26
_cell_length_c                   7.44
_cell_volume                     1227.203
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            boron4-x_106.cif
_cod_data_source_block           B4Lu1Rh4
_cod_original_formula_sum        'B4 Lu1 Rh4'
_cod_database_code               2105424
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z
x+1/2,-y,-z+1/2
-x,y,-z+1/2
-x,-y,-z
x-1/2,y,-z
-x-1/2,y,z-1/2
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1,-y+1/2,z
x+1,-y+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x,y+1/2,-z
-x,y+1/2,z-1/2
x+1/2,-y+1/2,z-1/2
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
Rh3 Rh 0.3531 0.2065 0.1272 1 0.0
Rh1 Rh 0.118 0.0417 0.0955 1 0.0
B2 B 0.19 0.023 0.4 1 0.0
B3 B 0.36 0.318 0.09 1 0.0
Rh2 Rh 0.153 0.1245 0.367 1 0.0
Lu1 Lu 0 0.5824 0.25 1 0.0
B1 B 0.13 0.147 0.07 1 0.0
Lu2 Lu 0 0.25 0.25 1 0.0
