#------------------------------------------------------------------------------
#$Date: 2009-11-16 01:43:51 +0000 (Mon, 16 Nov 2009) $
#$Revision: 853 $
#$URL: svn://www.crystallography.net/cod/cif/2/2012968.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_2012968
_journal_name_full  'Acta Crystallographica, Section C'
_journal_year  2002
_journal_volume  58
_journal_page_first  i135
_journal_page_last  i137
_publ_section_title
;
In~1.08~Gd~0.92~Ge~2~O~7~: a new member of the thortveitite family
;
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_[local]_cod_cif_authors_sg_H-M  'C 2/m'
loop_
_publ_author_name
  'Juarez-Arellano, Erick-Adrian'
  'Rosales, Ivonne'
  'Bucio, Lauro'
  'Orozco, Eligio'
_chemical_name_common  '\g indium gadolinium digermanate'
_chemical_formula_sum  'Gd0.92 Ge2 In1.08 O7'
_chemical_formula_structural  'In1.08 Gd0.92 Ge2 O7'
_chemical_formula_iupac  'In1.08 Gd0.92 Ge2 O7'
_chemical_formula_weight  525.90
_symmetry_cell_setting  monoclinic
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
  1 x,y,z
  2 -x,y,-z
  3 -x,-y,-z
  4 x,-y,z
  5 x+1/2,y+1/2,z
  6 -x+1/2,y+1/2,-z
  7 -x+1/2,-y+1/2,-z
  8 x+1/2,-y+1/2,z
_cell_length_a  6.8713(4)
_cell_length_b  8.8805(5)
_cell_length_c  4.8976(3)
_cell_angle_alpha  90
_cell_angle_beta  101.525(2)
_cell_angle_gamma  90
_cell_volume  292.83(3)
_cell_formula_units_Z  2
_cell_measurement_temperature  295
_exptl_crystal_density_diffrn  5.964
_diffrn_ambient_temperature  295
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_occupancy
  In 0.00000 0.30330(10)
  0.00000 0.0057(6) 0.54(2)
  Gd 0.00000 0.30330(10)
  0.00000 0.0057(6) 0.46(2)
  Ge 0.2284(3) 0.00000 0.4143(4) 0.0130(10)
  1.0
  O1 0.00000 0.00000 0.50000 0.014(2) 1.0
  O2 0.3880(10)
  0.00000 0.727(2) 0.014(2) 1.0
  O3 0.2394(9) 0.1596(7) 0.2280(10)
  0.014(2) 1.0
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
_atom_site_aniso_type_symbol
  ? ? ? ? ? ? ? ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
  Gd O2 . 5_454 2.239(6) yes
  Gd O3 . 1_555 2.202(6) yes
  Gd O3 . 7_555 2.316(6) yes
  Ge O1 . 1_555 1.703(2) yes
  Ge O2 . 1_555 1.698(9) yes
  Ge O3 . 1_555 1.695(6) yes