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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/1/53/92/1539297.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_1539297
loop_
_publ_author_name
'Schuster, J.C.'
'Bauer, J.'
_publ_section_title
;
 The ternary systems Sc - Al - N and Y - Al - N
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              345
_journal_page_last               350
_journal_volume                  109
_journal_year                    1985
_chemical_formula_sum            'N Sc'
_chemical_name_systematic        'Sc N'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.5
_cell_length_b                   4.5
_cell_length_c                   4.5
_cell_volume                     91.125
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Schuster_JCOMAH_1985_771.cif
_cod_data_source_block           N1Sc1
_cod_original_formula_sum        'N1 Sc1'
_cod_database_code               1539297
loop_
_symmetry_equiv_pos_as_xyz
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-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
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-x,y,-z
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z,x,y
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x,-z,y
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x,z,-y
-z,x,-y
-x,-z,-y
y,z,x
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z,y,-x
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z,x+1/2,y+1/2
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z+1/2,x,y+1/2
-x+1/2,z,y+1/2
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-z+1/2,-y+1/2,x
y+1/2,-z+1/2,x
z+1/2,y+1/2,x
y+1/2,z+1/2,-x
-z+1/2,y+1/2,-x
z+1/2,-y+1/2,-x
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
Sc1 Sc 0.5 0.5 0.5 1 0.0
N1 N 0 0 0 1 0.0
