#------------------------------------------------------------------------------
#$Date: 2015-07-14 01:46:57 +0300 (Tue, 14 Jul 2015) $
#$Revision: 151403 $
#$URL: svn://www.crystallography.net/cod/cif/4/00/24/4002416.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_4002416
loop_
_publ_author_name
'Neiner, D.'
'Spinu, L.'
'Golub, V.'
'Wiley, J.B.'
_publ_section_title
;
 Ferromagnetism in topochemically pepared layered perovskite Li0.3 Ni0.85
 La2 Ti3 O10
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              518
_journal_page_last               524
_journal_volume                  18
_journal_year                    2006
_chemical_formula_sum            'La2 Li0.3 Ni0.85 O10 Ti3'
_chemical_name_systematic        'Li0.3 Ni0.85 La2 Ti3 O10'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.8244
_cell_length_b                   3.8244
_cell_length_c                   26.736
_cell_volume                     391.042
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Neiner_CMATEX_2006_809.cif
_cod_data_source_block           La2Li0.3Ni0.85O10Ti3
_cod_original_cell_volume        391.0417
_cod_database_code               4002416
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+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
La1 La+3 0 0 0.4193 1 0.0
Ti2 Ti+4 0 0 0.156 1 0.0
Ni1 Ni+1 0 0.5 0.25 0.425 0.0
Ti1 Ti+4 0 0 0 1 0.0
O3 O-2 0 0 0.2334 1 0.0
O2 O-2 0 0.5 0 1 0.0
O1 O-2 0 0 0.0744 1 0.0
O4 O-2 0 0.5 0.1446 1 0.0
