#------------------------------------------------------------------------------
#$Date: 2016-02-18 16:37:37 +0100 (Thu, 18 Feb 2016) $
#$Revision: 176729 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/51/09/1510932.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_1510932
loop_
_publ_author_name
'Miessen, M.'
'Hoppe, R.'
_publ_section_title
;
 Quaternaere Monoborate der Alkalimetalle: Na4 Li5 (B O3)3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              101
_journal_page_last               113
_journal_paper_doi               10.1002/zaac.19865360512
_journal_volume                  536
_journal_year                    1986
_chemical_formula_sum            'B3 Li5 Na4 O9'
_chemical_name_systematic        'Na4 Li5 (B O3)3'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 107.29
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.388
_cell_length_b                   7.296
_cell_length_c                   9.738
_cell_volume                     840.377
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            boron_460.cif
_cod_data_source_block           B3Li5Na4O9
_cod_original_cell_volume        840.3766
_cod_database_code               1510932
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-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
B1 B+3 0.1683 -0.0837 0.9041 1 0.0
O1 O-2 0.1461 -0.144 0.7633 1 0.0
Li2 Li+1 0 0.723 0.75 1 0.0
O3 O-2 0.2619 0.0133 0.9692 1 0.0
Li1 Li+1 0.0441 0.033 0.6377 1 0.0
Na1 Na+1 0.2766 0.0545 0.7122 1 0.0
Li3 Li+1 0.5934 0.1113 0.0141 1 0.0
Na2 Na+1 0.1224 0.2444 0.0171 1 0.0
O4 O-2 -0.0271 0.4937 0.8548 1 0.0
O5 O-2 0 0.2082 0.75 1 0.0
O2 O-2 0.0879 -0.1207 0.9754 1 0.0
B2 B+3 0 0.3956 0.75 1 0.0
