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#$Date: 2015-09-29 06:26:54 +0100 (Tue, 29 Sep 2015) $
#$Revision: 158859 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/28/1532853.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_1532853
loop_
_publ_author_name
'Masuda, T.'
'Chakoumakos, B.C.'
'Nygren, C.L.'
'Imai, S.'
'Uchinokura, K.'
_publ_section_title
;
 A novel germanate, Cu2 Fe2 Ge4 O13, with a four tetrahedra oligomer
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              175
_journal_page_last               179
_journal_volume                  176
_journal_year                    2003
_chemical_formula_sum            'Cu2 Fe2 Ge4 O13'
_chemical_name_systematic        'Cu2 Fe2 (Ge4 O13)'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.145
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.105
_cell_length_b                   8.5073
_cell_length_c                   4.8736
_cell_volume                     499.004
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Masuda_JSSCBI_2003_226.cif
_cod_data_source_block           Cu2Fe2Ge4O13
_cod_original_cell_volume        499.0038
_cod_database_code               1532853
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
x,-y-1/2,z
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
Ge1 Ge+4 0.73996 0.75 0.99333 1 0.0
O2 O-2 0.4969 0.5828 0.7025 1 0.0
Cu1 Cu+2 0.62557 0.49662 0.54329 1 0.0
O8 O-2 0.6274 0.25 0.9338 1 0.0
O3 O-2 0.7578 0.4201 0.3655 1 0.0
O9 O-2 0.0642 0.25 0.2198 1 0.0
O4 O-2 0.9963 0.4253 0.7081 1 0.0
O6 O-2 0.3869 0.25 0.8547 1 0.0
O5 O-2 0.8315 0.75 0.2951 1 0.0
O1 O-2 0.7477 0.584 0.7848 1 0.0
Ge4 Ge+4 0.98773 0.25 0.89357 1 0.0
O7 O-2 0.8465 0.25 0.9275 1 0.0
Fe1 Fe+3 0.87587 0.56133 0.54825 1 0.0
Ge2 Ge+4 0.50508 0.25 0.09433 1 0.0
Ge3 Ge+4 0.75264 0.25 0.1624 1 0.0