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#$Date: 2010-01-30 13:59:17 +0000 (Sat, 30 Jan 2010) $
#$Revision: 966 $
#$URL: svn://www.crystallography.net/cod/cif/2/2010165.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_2010165
_journal_name_full 'Acta Crystallographica Section C'
_journal_year  1994
_journal_volume 50
_journal_page_first  1655
_journal_page_last  1657
_publ_section_title
;
l'Undecasulfure de Difer et d'Hexaytterbium, Fe~2~Yb~6~S~11~
;
loop_
_publ_author_name
  'Chaqour, S.M.'
  'Tomas, A.'
  'Lemoine, P.'
  'Palazzi, M.'
  'Guittard, M.'
_chemical_formula_sum  'Fe2 S11 Yb6'
_chemical_formula_weight  1502.594
_symmetry_cell_setting  orthorhombic
_symmetry_space_group_name_H-M  'C m c m'
_symmetry_space_group_name_Hall  '-C 2c 2'
_cell_length_a  3.7190(10)
_cell_length_b  12.395(2)
_cell_length_c  34.147(5)
_cell_angle_alpha  90
_cell_angle_beta  90
_cell_angle_gamma  90
_cell_volume  1574.5
_cell_formula_units_Z  4
_cell_measurement_temperature  293
_exptl_crystal_density_diffrn  6.34(3)
_exptl_crystal_density_meas  6.30(10)
_refine_ls_R_factor_obs  0.0534
_refine_ls_wR_factor_obs  0.0532
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
  Yb(1) .0 .24070(10)
  .43905(4)
  Yb(2) .5 .5046(2) .25
  Yb(3) .0 .4852(2) .36618(6)
  Yb(4) .5 .0 .5
  Yb(5) .5 .2491(2) .31736(7)
  S(1) .5 .0861(7) .0681(3)
  S(2) .5 .3400(7) .1127(3)
  S(3) .5 .3537(7) .0156(2)
  S(4) .0 .3940(7) .2023(2)
  S(5) .5 .1590(10)
  .25
  S(6) .0 .1126(7) .1624(3)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
  Yb(1) S(1) 2.681(7) yes
  Yb(1) S(3) 2.796(6) yes
  Yb(1) S(2) 2.845(7) yes
  Yb(1) S(3) 2.864(8) yes
  Yb(2) S(5) 2.670(10)
  yes
  Yb(2) S(4) 2.827(6) yes
  Yb(2) S(6) 3.280(10)
  yes
  Yb(3) S(1) 2.570(10)
  yes
  Yb(3) S(4) 2.598(9) yes
  Yb(3) S(6) 2.627(7) yes
  Yb(3) S(2) 2.686(7) yes
  Yb(4) S(1) 2.560(10)
  yes
  Yb(4) S(3) 2.651(6) yes
  Yb(5) S(5) 2.556(7) yes
  Yb(5) S(6) 2.608(7) yes
  Yb(5) S(2) 2.641(9) yes
  Yb(5) S(4) 2.671(6) yes
_cod_database_code 2010165