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#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/12/1511239.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_1511239
loop_
_publ_author_name
'Attfield, J.P.'
'Chapman, J.P.'
_publ_section_title
;
 Chemistry and structure of borate-containing materials Ln Sr2 Cu(3-x)
 B(x) O(7-d)
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              351
_journal_page_last               352
_journal_volume                  235
_journal_year                    1994
_chemical_formula_sum            'B0.6 Cu2.4 O6.13 Sr2 Y'
_chemical_name_systematic        'Y Sr2 (Cu0.4 B0.6) Cu2 O6.13'
_space_group_IT_number           47
_symmetry_space_group_name_Hall  '-P 2 2'
_symmetry_space_group_name_H-M   'P m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.8203
_cell_length_b                   3.8381
_cell_length_c                   10.983
_cell_volume                     161.040
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            boron0-1_36.cif
_cod_data_source_block           B0.6Cu2.4O6.13Sr2Y1
_cod_original_cell_volume        161.0404
_cod_original_formula_sum        'B0.6 Cu2.4 O6.13 Sr2 Y1'
_cod_database_code               1511239
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x,-y,-z
-x,y,-z
-x,-y,-z
x,y,-z
-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
Cu3 Cu+1 0 0 0.169 0.5 0.0
O2 O-2 0 0.5 0.1287 1 0.0
Cu1 Cu+1 0 0 0.5 0.4 0.0
O4 O-2 0 0.5 0.5 0.13 0.0
Cu2 Cu+1 0 0 0.136 0.5 0.0
O3 O-2 0 0 0.335 1 0.0
B1 B+3 0 0 0.5 0.6 0.0
O1 O-2 0.5 0 0.1505 1 0.0
Y1 Y+3 0.5 0.5 0 1 0.0
Sr1 Sr+2 0.5 0.5 0.317 1 0.0
