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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/90/1529021.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_1529021
loop_
_publ_author_name
'Yamane, H.'
'Takahashi, J.'
'Tanimura, R.'
'Yamada, T.'
'Shimada, M.'
'Kajiwara, T.'
_publ_section_title
;
 Synthesis and crystal structures of Ca Y2 Ge3 O10 and Ca Y2 Ge4 O12
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              289
_journal_page_last               295
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Ca Ge4 O12 Y2'
_chemical_name_systematic        'Ca Y2 Ge4 O12'
_space_group_IT_number           125
_symmetry_space_group_name_Hall  '-P 4a 2b'
_symmetry_space_group_name_H-M   'P 4/n b m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.99282
_cell_length_b                   9.99282
_cell_length_c                   5.06701
_cell_volume                     505.974
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Yamane_JSSCBI_2006_1115.cif
_cod_data_source_block           Ca1Ge4O12Y2
_cod_original_cell_volume        505.9736
_cod_original_formula_sum        'Ca1 Ge4 O12 Y2'
_cod_database_code               1529021
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x,z
-x+1/2,-y+1/2,z
y,-x+1/2,z
x,-y+1/2,-z
y,x,-z
-x+1/2,y,-z
-y+1/2,-x+1/2,-z
-x,-y,-z
y-1/2,-x,-z
x-1/2,y-1/2,-z
-y,x-1/2,-z
-x,y-1/2,z
-y,-x,z
x-1/2,-y,z
y-1/2,x-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
Ca2 Ca+2 0 0 0.5 0.498 0.0
Y2 Y+3 0 0 0.5 0.502 0.0
Ca1 Ca+2 0.25 0.25 0.5 0.005 0.0
Ge1 Ge+4 0.52113 0.25 0 1 0.0
O2 O-2 0.1753 0.0622 0.262 1 0.0
Y1 Y+3 0.25 0.25 0.5 0.995 0.0
O1 O-2 -0.3731 0.3731 0.1511 1 0.0
