#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (jue 27 de sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/86/1538614.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_1538614
loop_
_publ_author_name
'Juza, R.'
'Anschutz, E.'
'Puff, H.'
_publ_section_title
;
 Die Struktur von Li7 V N4 und Li7 Mn N4
;
_journal_name_full               'Angewandte Chemie (German Edition)'
_journal_page_first              161
_journal_page_last               161
_journal_volume                  71
_journal_year                    1959
_chemical_formula_sum            'Li7 N4 Ni'
_space_group_IT_number           218
_symmetry_space_group_name_Hall  'P -4n 2 3'
_symmetry_space_group_name_H-M   'P -4 3 n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.571
_cell_length_b                   9.571
_cell_length_c                   9.571
_cell_volume                     876.742
_citation_journal_id_ASTM        ANCEAD
_cod_data_source_file            Juza_ANCEAD_1959_491.cif
_cod_data_source_block           Li7N4Ni1
_cod_original_cell_volume        876.7423
_cod_original_formula_sum        'Li7 N4 Ni1'
_cod_database_code               1538614
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
y+1/2,-x+1/2,-z+1/2
-x,-y,z
-y+1/2,x+1/2,-z+1/2
x,-y,-z
-y+1/2,-x+1/2,z+1/2
-x,y,-z
y+1/2,x+1/2,z+1/2
z,x,y
x+1/2,-z+1/2,-y+1/2
-z,-x,y
-x+1/2,z+1/2,-y+1/2
z,-x,-y
-x+1/2,-z+1/2,y+1/2
-z,x,-y
x+1/2,z+1/2,y+1/2
y,z,x
y,-z,-x
-z+1/2,-y+1/2,x+1/2
-y,z,-x
z+1/2,y+1/2,x+1/2
-y,-z,x
-z+1/2,y+1/2,-x+1/2
z+1/2,-y+1/2,-x+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
Ni2 Ni 0.25 0.5 0 1 0.0
Li3 Li 0.25 0.25 0.25 1 0.0
Ni1 Ni 0 0 0 1 0.0
N2 N 0.375 0.375 0.125 1 0.0
Li1 Li 0 0.5 0.5 1 0.0
Li2 Li 0.25 0 0.5 1 0.0
Li4 Li 0.25 0 0 1 0.0
Li5 Li 0.25 0.25 0 1 0.0
N1 N 0.115 0.115 0.115 1 0.0
