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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/1/52/46/1524665.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_1524665
loop_
_publ_author_name
'Keller, P.'
'Hess, H.'
'Dunn, P.J.'
_publ_section_title
;
 Die Ladungsbilanz fuer eine verfeinerte Kristallstruktur von Stranskiit,
 Zn2 Cu (As O4)2
;
_journal_name_full
;
TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-)
;
_journal_page_first              167
_journal_page_last               174
_journal_volume                  26
_journal_year                    1979
_chemical_formula_sum            'As2 Cu O8 Zn2'
_chemical_name_systematic        'Zn2 Cu (As O4)2'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                110.16
_cell_angle_beta                 112.09
_cell_angle_gamma                86.74
_cell_formula_units_Z            1
_cell_length_a                   5.092
_cell_length_b                   6.695
_cell_length_c                   5.304
_cell_volume                     156.729
_citation_journal_id_ASTM        TTMMDZ
_cod_data_source_file            Keller_TTMMDZ_1979_251.cif
_cod_data_source_block           As2Cu1O8Zn2
_cod_original_cell_volume        156.7295
_cod_original_formula_sum        'As2 Cu1 O8 Zn2'
_cod_database_code               1524665
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,-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
As1 As+5 0.8647 0.2761 0.138 1 0.0
Zn1 Zn+2 0.2303 0.1857 0.7357 1 0.0
Cu1 Cu+2 0.5 0.5 0.5 1 0.0
O3 O-2 0.6336 0.1554 0.7986 1 0.0
O1 O-2 0.1838 0.3332 0.129 1 0.0
O4 O-2 0.733 0.5045 0.2921 1 0.0
O2 O-2 0.9082 0.1212 0.3429 1 0.0
