#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/02/1540226.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_1540226
loop_
_publ_author_name
'Lartigue, C.'
'Tasset, F.'
'Percheron-Guegan, A.'
'Achard, J.C.'
_publ_section_title
;
 Thermodynamic and structural properties of La Ni5-x Mnx compounds and
 their related hydrides
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              23
_journal_page_last               29
_journal_volume                  75
_journal_year                    1980
_chemical_formula_sum            'D6 La Mn2 Ni3'
_chemical_name_systematic        'La Mn2 Ni3 D6'
_space_group_IT_number           191
_symmetry_space_group_name_Hall  '-P 6 2'
_symmetry_space_group_name_H-M   'P 6/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   5.451
_cell_length_b                   5.451
_cell_length_c                   4.344
_cell_volume                     111.782
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Lartigue_JCOMAH_1980_423.cif
_cod_data_source_block           D6La1Mn2Ni3
_cod_original_cell_volume        111.7822
_cod_original_formula_sum        'D6 La1 Mn2 Ni3'
_cod_database_code               1540226
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z
-y,x-y,z
-x,-y,z
-x+y,-x,z
y,-x+y,z
-y,-x,-z
x-y,-y,-z
x,x-y,-z
y,x,-z
-x+y,y,-z
-x,-x+y,-z
-x,-y,-z
-x+y,-x,-z
y,-x+y,-z
x,y,-z
x-y,x,-z
-y,x-y,-z
y,x,z
-x+y,y,z
-x,-x+y,z
-y,-x,z
x-y,-y,z
x,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
La1 La 0 0 0 1 0.0
D3 D 0.445 0 0.118 0.14 0.0
Ni2 Ni 0.5 0 0.5 0.45 0.0
Mn2 Mn 0.5 0 0.5 0.55 0.0
Ni1 Ni 0.3333 0.6667 0 0.92 0.0
D2 D 0.127 0.254 0.5 0.34 0.0
Mn1 Mn 0.3333 0.6667 0 0.08 0.0
D1 D 0.5 0 0 0.35 0.0
