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#$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176428 $
#$URL: svn://www.crystallography.net/cod/cif/2/31/03/2310341.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2310341
loop_
_publ_author_name
'Benz, R.'
'Zachariasen, W.H.'
_publ_section_title
;
 Th3 N4 crystal structure and comparison with that of Th2 N2 O
;
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              838
_journal_page_last               840
_journal_volume                  21
_journal_year                    1966
_chemical_formula_sum            'N4 Th3'
_chemical_name_systematic        'Th3 N4'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-P 3* 2'
_symmetry_space_group_name_H-M   'R -3 m :R'
_cell_angle_alpha                23.78
_cell_angle_beta                 23.78
_cell_angle_gamma                23.78
_cell_formula_units_Z            1
_cell_length_a                   9.398
_cell_length_b                   9.398
_cell_length_c                   9.398
_cell_volume                     118.555
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Benz_ACCRA9_1966_1077.cif
_cod_data_source_block           N4Th3
_cod_original_cell_volume        118.5551
_cod_original_sg_symbol_Hall     '-R 3 2" (-y+z,x+z,-x+y+z)'
_cod_database_code               2310341
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
z,x,y
y,z,x
-y,-x,-z
-z,-y,-x
-x,-z,-y
-x,-y,-z
-z,-x,-y
-y,-z,-x
y,x,z
z,y,x
x,z,y
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
Th2 Th+4 0.222 0.222 0.222 1 0.0
N1 N-3 0.137 0.137 0.137 1 0.0
Th1 Th+4 0 0 0 1 0.0
N2 N-3 0.389 0.389 0.389 1 0.0
