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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/1/53/95/1539506.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1539506
loop_
_publ_author_name
'Vlasse, M.'
'Viala, J.C.'
_publ_section_title
;
 The boron-silicon solid solution: a structural study of the Si B36
 composition
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              181
_journal_page_last               188
_journal_volume                  37
_journal_year                    1981
_chemical_formula_sum            'B305.51 Si8.443'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   11.01
_cell_length_b                   11.01
_cell_length_c                   23.9
_cell_volume                     2509.014
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Vlasse_JSSCBI_1981_1329.cif
_cod_data_source_block           B305.51Si8.443
_cod_original_cell_volume        2509.015
_cod_database_code               1539506
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+1/3
-x+2/3,-x+y+1/3,-z+1/3
x-y+2/3,-y+1/3,-z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+2/3
-x+1/3,-x+y+2/3,-z+2/3
x-y+1/3,-y+2/3,-z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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
B5 B 0.0544 0.1088 0.9441 1 0.0
B13 B 0.0585 0.117 0.5538 0.739 0.0
B4 B 0.2354 0.2514 0.3469 1 0.0
B12 B 0.0896 0.1792 0.3986 1 0.0
B10 B 0.1023 0.2046 0.6981 1 0.0
B3 B 0.2611 0.2171 0.4196 1 0.0
Si2 Si 0.1091 0.2182 0.1001 0.0484 0.0
B8 B 0.1697 0.3394 0.0279 1 0.0
B9 B 0.1299 0.2598 0.7658 1 0.0
B11 B 0.0567 0.1134 0.3269 1 0.0
Si1 Si 0 0 0.133 0.464 0.0
B2 B 0.3182 0.2954 0.1286 1 0.0
B1 B 0.1709 0.1757 0.1771 0.867 0.0
B14 B 0 0 0.3857 1 0.0
B7 B 0.1106 0.2212 0.8875 1 0.0
Si3 Si 0.1709 0.1757 0.1771 0.133 0.0
B15 B 0 0 0.5 1 0.0
B6 B 0.086 0.172 0.0135 1 0.0