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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/04/1530406.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_1530406
loop_
_publ_author_name
'Merinov, B.V.'
'Masimov, B.A.'
'Dem'yanets, D.N.'
'Belov, N.V.'
_publ_section_title
;
 Crystal structure of the rare-earth germanate Nd4 Ge O8
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              353
_journal_page_last               356
_journal_volume                  241
_journal_year                    1978
_chemical_formula_sum            'Ge Nd4 O8'
_chemical_name_systematic        'Nd4 Ge O8'
_space_group_IT_number           26
_symmetry_space_group_name_Hall  'P 2c -2'
_symmetry_space_group_name_H-M   'P m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.475
_cell_length_b                   5.727
_cell_length_c                   17.927
_cell_volume                     767.443
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Merinov_DANKAS_1978_490.cif
_cod_data_source_block           Ge1Nd4O8
_cod_original_cell_volume        767.4428
_cod_original_formula_sum        'Ge1 Nd4 O8'
_cod_database_code               1530406
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x,y,z
x,-y,z+1/2
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
O5 O-2 0.1864 0.6681 0.248 1 0.0
O12 O-2 0.258 0.4924 0.4973 1 0.0
O3 O-2 0 0.0409 0.1142 1 0.0
O4 O-2 0.5 0.5454 0.1435 1 0.0
Nd5 Nd+3 0.2416 0.7689 0.0902 1 0.0
Nd6 Nd+3 0.261 0.2741 0.3838 1 0.0
Nd3 Nd+3 0 0.2925 0.2057 1 0.0
Nd1 Nd+3 0 0.2651 0 1 0.0
O2 O-2 0.5 0.063 0.1008 1 0.0
O11 O-2 0.2153 0.0097 0.4867 1 0.0
Ge1 Ge+4 0.5 0.2581 0.1809 1 0.0
O8 O-2 0 0.5399 0.3663 1 0.0
O7 O-2 0 0.0555 0.3198 1 0.0
O1 O-2 0 0.5314 0.1045 1 0.0
O10 O-2 0.5 0.5124 0.3628 1 0.0
O6 O-2 0.3121 0.1924 0.2367 1 0.0
Ge2 Ge+4 0 0.7558 0.2986 1 0.0
Nd2 Nd+3 0.5 0.2314 0.9737 1 0.0
O9 O-2 0.5 0.0043 0.3709 1 0.0
Nd4 Nd+3 0.5 0.7874 0.2705 1 0.0
