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#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/54/2105414.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_2105414
loop_
_publ_author_name
'Shoemaker, D.P.'
'Kripyakevich, P.I.'
'Kuz'ma, Yu.B.'
'Brink-Shoemaker, C.'
'Voroshilov, Yu.V.'
_publ_section_title
;
 The crystal structure of (Nb Co B)
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              257
_journal_page_last               261
_journal_paper_doi               10.1107/S0567740871002061
_journal_volume                  27
_journal_year                    1971
_chemical_formula_sum            'B Co Nb'
_chemical_name_systematic        'Nb Co B'
_space_group_IT_number           59
_symmetry_space_group_name_Hall  '-P 2ab 2a'
_symmetry_space_group_name_H-M   'P m m n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            10
_cell_length_a                   3.266
_cell_length_b                   17.177
_cell_length_c                   5.947
_cell_volume                     333.627
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            boron0-1_145.cif
_cod_data_source_block           B1Co1Nb1
_cod_original_cell_volume        333.6272
_cod_original_formula_sum        'B1 Co1 Nb1'
_cod_database_code               2105414
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y+1/2,z
x+1/2,-y,-z
-x,y+1/2,-z
-x,-y,-z
x-1/2,y-1/2,-z
-x-1/2,y,z
x,-y-1/2,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
Co3 Co 0.25 0.25 0.0085 1.01 0.0
Co2 Co 0.25 0.3224 0.6441 1.01 0.0
B1 B 0.25 0.451 0.77 1 0.0
B2 B 0.25 0.348 0.271 1 0.0
B3 B 0.25 0.75 0.23 1 0.0
Co1 Co 0.25 0.4761 0.1457 0.94 0.0
Nb2 Nb 0.25 0.6259 0.0245 1.02 0.0
Nb3 Nb 0.25 0.75 0.6456 0.98 0.0
Nb1 Nb 0.25 0.571 0.5288 0.99 0.0
