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#$Date: 2015-10-10 08:17:13 +0300 (Sat, 10 Oct 2015) $
#$Revision: 165128 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/71/1537113.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_1537113
loop_
_publ_author_name
'Ronis, Ya.V.'
'Bondars, B.Ya.'
'Vitola, A.A.'
'Miller, T.N.'
_publ_section_title
;
 Crystal structure of sodium-phosphorus nitride Na3 P6 N11
;
_journal_name_full
'Latvijas PSR Zinatnu Akademijas Vestis, Khimijas Serija'
_journal_page_first              299
_journal_page_last               301
_journal_volume                  1990
_journal_year                    1990
_chemical_formula_sum            'N11 Na3 P6'
_chemical_name_systematic        'Na3 (P6 N11)'
_space_group_IT_number           198
_symmetry_space_group_name_Hall  'P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P 21 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.112
_cell_length_b                   10.112
_cell_length_c                   10.112
_cell_volume                     1033.978
_citation_journal_id_ASTM        LZAKAM
_cod_data_source_file            Ronis_LZAKAM_1990_1079.cif
_cod_data_source_block           N11Na3P6
_cod_database_code               1537113
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+1/2,-z+1/2
z,x,y
-z+1/2,-x,y+1/2
z+1/2,-x+1/2,-y
-z,x+1/2,-y+1/2
y,z,x
y+1/2,-z+1/2,-x
-y,z+1/2,-x+1/2
-y+1/2,-z,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
N5 N-3 0.0344 0.0344 0.0344 1 0.0
N2 N-3 0.0368 0.1121 0.7846 1 0.0
Na1 Na+1 0.5045 0.5045 0.5045 1 0.0
N1 N-3 0.2729 0.0392 0.3678 1 0.0
P2 P+5 0.3255 0.0607 0.5111 1 0.0
Na3 Na+1 0.2131 0.2131 0.2131 1 0.0
P1 P+5 0.1869 0.0729 0.7702 1 0.0
N4 N-3 0.7049 0.7049 0.7049 1 0.0
N3 N-3 0.2033 0.0331 0.6211 1 0.0
Na2 Na+1 0.8652 0.8652 0.8652 1 0.0
