#------------------------------------------------------------------------------
#$Date: 2016-02-14 05:40:26 +0100 (dom 14 de feb de 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/15/1511513.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_1511513
loop_
_publ_author_name
'Horng, H.E.'
'Bevolo, A.J.'
'Richardson, J.W.jr.'
'Hamaker, H.C.'
'Shelton, R.N.'
'Jacobson, R.A.'
'Bader, S.D.'
_publ_section_title
;
 Charge transfer and transition-metal cluster: Boron bonding in the bct
 superconducting Y (Rh1-x Rux)4 B4 system
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              6703
_journal_page_last               6712
_journal_paper_doi               10.1103/PhysRevB.27.6703
_journal_volume                  27
_journal_year                    1983
_chemical_formula_sum            'B4 Ru4 Y'
_chemical_name_systematic        'Ru4 Y B4'
_space_group_IT_number           142
_symmetry_space_group_name_Hall  'I 4bw 2aw -1bw'
_symmetry_space_group_name_H-M   'I 41/a c d :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   7.448
_cell_length_b                   7.448
_cell_length_c                   15
_cell_volume                     832.091
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            boron4-x_143.cif
_cod_data_source_block           B4Ru4Y1
_cod_original_cell_volume        832.0906
_cod_original_sg_symbol_Hall     '-I 4bd 2c (x+1/2,y+1/4,z-3/8)'
_cod_original_formula_sum        'B4 Ru4 Y1'
_cod_database_code               1511513
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x+1/2,z+1/4
-x+1/2,-y+1/2,z+1/2
y+1/2,-x,z+3/4
x,-y+1/2,-z+3/4
y+1/2,x+1/2,-z
-x+1/2,y,-z+1/4
-y,-x,-z+1/2
-x,-y+1/2,-z+1/4
y,-x,-z
x-1/2,y,-z-1/4
-y-1/2,x+1/2,-z-1/2
-x,y,z-1/2
-y-1/2,-x,z+1/4
x-1/2,-y+1/2,z
y,x+1/2,z-1/4
x+1/2,y+1/2,z+1/2
-y+1/2,x+1,z+3/4
-x+1,-y+1,z+1
y+1,-x+1/2,z+5/4
x+1/2,-y+1,-z+5/4
y+1,x+1,-z+1/2
-x+1,y+1/2,-z+3/4
-y+1/2,-x+1/2,-z+1
-x+1/2,-y+1,-z+3/4
y+1/2,-x+1/2,-z+1/2
x,y+1/2,-z+1/4
-y,x+1,-z
-x+1/2,y+1/2,z
-y,-x+1/2,z+3/4
x,-y+1,z+1/2
y+1/2,x+1,z+1/4
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
Y3 Y 0 0 0.25 1 0.0
B1 B 0.834 0.855 0.082 1 0.0
Ru1 Ru 0.1154 0.1483 0.5619 1 0.0
