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#$Date: 2015-10-09 13:22:50 +0200 (vie 09 de oct de 2015) $
#$Revision: 161780 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/25/7222511.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_7222511
loop_
_publ_author_name
'Lukachuk, M.'
'Zaremba, V.I.'
'Hoffmann, R.D.'
'Poettgen, R.'
_publ_section_title
;
 Synthesis and structural relationship of the ternary indides Sc3
 Ni2.10(5) In3.60(5), Sc3 Ni2.14(2) In3.76(2), Sc3 Rh1.594(9) In4
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              182
_journal_page_last               189
_journal_volume                  59
_journal_year                    2004
_chemical_formula_sum            'In3.76 Ni2.14 Sc3'
_chemical_name_systematic        'Sc3 Ni2.14 In3.76'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   7.5363
_cell_length_b                   7.5363
_cell_length_c                   3.443
_cell_volume                     169.350
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Lukachuk_ZNBSEN_2004_1305.cif
_cod_data_source_block           In3.76Ni2.14Sc3
_cod_original_cell_volume        169.3495
_cod_database_code               7222511
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
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
Ni3 Ni 0.3333 0.6667 0.5 0.239 0.0
In2 In 0.74071 0.00086 0.5 1 0.0
In1 In 0.3333 0.6667 0.5 0.761 0.0
Ni2 Ni 0.6667 0.3333 0.5 1 0.0
Ni1 Ni 0 0 0 0.905 0.0
Sc1 Sc 0.41363 0.03157 0 1 0.0
