#------------------------------------------------------------------------------
#$Date: 2015-10-13 21:13:24 +0200 (mar 13 de oct de 2015) $
#$Revision: 167805 $
#$URL: svn://www.crystallography.net/cod/cif/4/12/46/4124681.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_4124681
loop_
_publ_author_name
'Rundle, R.E.'
'Baenziger, N.C.'
'McDonald, R.A.'
'Wilson, A.S.'
_publ_section_title
;
 The structures of the carbides, nitrides and oxides of uranium
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              99
_journal_page_last               105
_journal_volume                  70
_journal_year                    1948
_chemical_formula_sum            'N3 U2'
_chemical_name_systematic        'U2 N3'
_space_group_IT_number           206
_symmetry_space_group_name_Hall  '-I 2b 2c 3'
_symmetry_space_group_name_H-M   'I a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   10.699
_cell_length_b                   10.699
_cell_length_c                   10.699
_cell_volume                     1224.700
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            Rundle_JACSAT_1948_784.cif
_cod_data_source_block           N3U2
_cod_original_cell_volume        1224.7
_cod_database_code               4124681
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y+1/2,z
x,-y,-z+1/2
-x,y+1/2,-z+1/2
z,x,y
-z,-x+1/2,y
z,-x,-y+1/2
-z,x+1/2,-y+1/2
y,z,x
y,-z,-x+1/2
-y,z+1/2,-x+1/2
-y+1/2,-z,x+1/2
-x,-y,-z
x,y-1/2,-z
-x,y,z-1/2
x,-y-1/2,z-1/2
-z,-x,-y
z,x-1/2,-y
-z,x,y-1/2
z,-x-1/2,y-1/2
-y,-z,-x
-y,z,x-1/2
y,-z-1/2,x-1/2
y-1/2,z,-x-1/2
x+1/2,y+1/2,z+1/2
-x+1/2,-y+1,z+1/2
x+1/2,-y+1/2,-z+1
-x+1/2,y+1,-z+1
z+1/2,x+1/2,y+1/2
-z+1/2,-x+1,y+1/2
z+1/2,-x+1/2,-y+1
-z+1/2,x+1,-y+1
y+1/2,z+1/2,x+1/2
y+1/2,-z+1/2,-x+1
-y+1/2,z+1,-x+1
-y+1,-z+1/2,x+1
-x+1/2,-y+1/2,-z+1/2
x+1/2,y,-z+1/2
-x+1/2,y+1/2,z
x+1/2,-y,z
-z+1/2,-x+1/2,-y+1/2
z+1/2,x,-y+1/2
-z+1/2,x+1/2,y
z+1/2,-x,y
-y+1/2,-z+1/2,-x+1/2
-y+1/2,z+1/2,x
y+1/2,-z,x
y,z+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
N1 N 0.385 0.145 0.38 1 0.0
U2 U 0.982 0 0.25 1 0.0
U1 U 0.25 0.25 0.25 1 0.0
