#------------------------------------------------------------------------------
#$Date: 2015-07-12 19:37:11 +0200 (Sun, 12 Jul 2015) $
#$Revision: 147921 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/66/1526686.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_1526686
loop_
_publ_author_name
'Stegen, H.'
'Jacobs, H.'
_publ_section_title
;
 Alkalimetallnitrido-tecto-metallate(VI) mit Netzwerken von Sechsringen
 spitzenverknuepfter Tetraeder ((M N N3/2)6) mit M = Mo, W der
 unerwarteten Zusammensetzung A9+x (M6 N15) mit A = Rb, Cs und 0 < x < 1
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              639
_journal_page_last               644
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'N15 Rb9.15 W6'
_chemical_name_systematic        'Rb9.15 (W6 N15)'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   12.743
_cell_length_b                   12.743
_cell_length_c                   27.794
_cell_volume                     3908.634
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Stegen_ZAACAB_2000_792.cif
_cod_data_source_block           N15Rb9.15W6
_cod_original_cell_volume        3908.635
_cod_database_code               1526686
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z+1/2
-x,-x+y,-z+1/2
x-y,-y,-z+1/2
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z-1/2
x,x-y,z-1/2
-x+y,y,z-1/2
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+5/6
-x+2/3,-x+y+1/3,-z+5/6
x-y+2/3,-y+1/3,-z+5/6
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z-1/6
x+2/3,x-y+1/3,z-1/6
-x+y+2/3,y+1/3,z-1/6
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+7/6
-x+1/3,-x+y+2/3,-z+7/6
x-y+1/3,-y+2/3,-z+7/6
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+1/6
x+1/3,x-y+2/3,z+1/6
-x+y+1/3,y+2/3,z+1/6
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
Rb1 Rb+1 0.1666 0 0.25 1 0.0
Rb2 Rb+1 0.2194 0.0555 0.1064 1 0.0
N3 N-3 0.21 0.218 0.18 1 0.0
N1 N-3 0.395 0 0.25 1 0.0
N2 N-3 0.074 0.275 0.004 1 0.0
W1 W+5 0.23306 0.32133 0.01704 1 0.0
Rb3 Rb+1 0 0 0 0.15 0.0
