#------------------------------------------------------------------------------
#$Date: 2016-02-14 15:26:36 +0100 (dom 14 de feb de 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/10/1511068.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_1511068
loop_
_publ_author_name
'Huang, Z.-X.'
'Zhang, H.'
'Cheng, W.-D.'
_publ_section_title
;
 Synthesis and crystal structure of borate oxide Co3 B O5
;
_journal_name_full               'Jiegon Huaxue'
_journal_page_first              97
_journal_page_last               99
_journal_volume                  20
_journal_year                    2001
_chemical_formula_sum            'B Co3 O5'
_chemical_name_systematic        'Co3 (B O3) O2'
_space_group_IT_number           55
_symmetry_space_group_name_Hall  '-P 2 2ab'
_symmetry_space_group_name_H-M   'P b a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.2963
_cell_length_b                   11.948
_cell_length_c                   2.9737
_cell_volume                     330.295
_citation_journal_id_ASTM        JHUADF
_cod_data_source_file            boron0-1_160.cif
_cod_data_source_block           B1Co3O5
_cod_original_cell_volume        330.2954
_cod_original_formula_sum        'B1 Co3 O5'
_cod_database_code               1511068
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z
-x,-y,-z
x,y,-z
-x-1/2,y-1/2,z
x-1/2,-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
O2 O-2 0.3421 -0.0398 0.5 1 0.0
O3 O-2 0.1244 0.0793 0 1 0.0
Co4 Co+2 0 0 0.5 1 0.0
O5 O-2 0.3859 0.1415 0 1 0.0
Co1 Co+3 0.25851 0.11244 0.5 1 0.0
Co3 Co+2 0.5 0 0 1 0.0
O4 O-2 0.1639 0.2604 0.5 1 0.0
O1 O-2 0.3823 0.3606 0.5 1 0.0
Co2 Co+2 0.50454 0.27648 0 1 0.0
B1 B+3 0.2372 0.361 0.5 1 0.0
