#------------------------------------------------------------------------------
#$Date: 2016-02-16 02:10:39 +0100 (mar 16 de feb de 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/94/7209447.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_7209447
loop_
_publ_author_name
'Muenchau, S.'
'Bluhm, K.'
_publ_section_title
;
 Zur Synthese und Kristallstruktur von Kupfercadmiumpyroboratoxid: Cu2 Cd
 (B2 O5) O
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische
 Chemie (42,1987-)
;
_journal_page_first              1151
_journal_page_last               1154
_journal_volume                  50
_journal_year                    1995
_chemical_formula_sum            'B2 Cd Cu2 O6'
_chemical_name_systematic        'Cu2 Cd (B2 O5) O'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 93.185
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   3.399
_cell_length_b                   15.09
_cell_length_c                   9.269
_cell_volume                     474.681
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            boron_42.cif
_cod_data_source_block           B2Cd1Cu2O6
_cod_original_cell_volume        474.6811
_cod_original_formula_sum        'B2 Cd1 Cu2 O6'
_cod_database_code               7209447
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-z
x,-y-1/2,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
Cu2 Cu+2 0.3146 0.7464 0.8702 1 0.0
O4 O-2 0.712 0.377 0.061 1 0.0
O3 O-2 0.331 0.427 0.469 1 0.0
Cu1 Cu+2 0.3109 0.5402 0.3664 1 0.0
B1 B+3 0.169 0.347 0.425 1 0.0
O1 O-2 0.248 0.27 0.49 1 0.0
Cd1 Cd+2 0.2057 0.3683 0.8841 1 0.0
B2 B+3 0.887 0.411 0.186 1 0.0
O6 O-2 0.004 0.342 0.28 1 0.0
O2 O-2 0.319 0.851 0.765 1 0.0
O5 O-2 0.063 0.503 0.784 1 0.0
