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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/51/1535168.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_1535168
loop_
_publ_author_name
'Hayakawa, H.'
'Ono, S.'
'Suzuki, A.'
_publ_section_title
;
 The crystal structure of lanthanum silicon triarsenide (La Si As3)
;
_journal_name_full
'Nippon Kagaku Kaishi (= J.Chem.Soc.Japan) (1947-)'
_journal_page_first              697
_journal_page_last               701
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'As3 La Si'
_chemical_name_systematic        'La Si As3'
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.084
_cell_length_b                   5.986
_cell_length_c                   26.235
_cell_volume                     955.448
_citation_journal_id_ASTM        NKAKB8
_cod_data_source_file            Hayakawa_NKAKB8_1984_939.cif
_cod_data_source_block           As3La1Si1
_cod_original_cell_volume        955.4479
_cod_original_formula_sum        'As3 La1 Si1'
_cod_database_code               1535168
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+1/2,-z+1/2
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z
x,-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
La1 La 0.0003 0.0021 0.09189 1 0.0
As3 As 0.2531 0.245 0.00041 1 0.0
Si1 Si -0.0883 0.4192 0.20688 1 0.0
As2 As -0.0433 0.0262 0.21187 1 0.0
As1 As 0.0039 0.505 0.1239 1 0.0
