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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/61/1536107.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_1536107
loop_
_publ_author_name
'Noreus, D.'
'Olsson, L.G.'
'Werner, P.E.'
_publ_section_title
;
 The structure and dynamics of hydrogen in La Ni5 H6 studied by elastic
 and inelastic neutron scattering
;
_journal_name_full               'Journal of Physics F'
_journal_page_first              715
_journal_page_last               727
_journal_volume                  13
_journal_year                    1983
_chemical_formula_sum            'D5.5 La Ni5'
_chemical_name_systematic        'La Ni5 D5.5'
_space_group_IT_number           157
_symmetry_space_group_name_Hall  'P 3 -2'
_symmetry_space_group_name_H-M   'P 3 1 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   5.336
_cell_length_b                   5.336
_cell_length_c                   4.259
_cell_volume                     105.019
_citation_journal_id_ASTM        JPFMAT
_cod_data_source_file            Noreus_JPFMAT_1983_662.cif
_cod_data_source_block           D5.5La1Ni5
_cod_original_cell_volume        105.0195
_cod_original_formula_sum        'D5.5 La1 Ni5'
_cod_database_code               1536107
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,z
-x,-x+y,z
x-y,-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
Ni2 Ni 0.499 0 0.496 1 0.0
D1 D 0.47 0 0.092 1 0.0
D2 D 0.189 0.864 0.493 0.42 0.0
La1 La 0 0 0 1 0.0
Ni1 Ni 0.3333 0.6667 0.98 1 0.0
