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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/72/1537252.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_1537252
loop_
_publ_author_name
'von Schnering, H.G.'
'Wittmann, M.'
'Sommer, D.'
_publ_section_title
;
 Eu3 P4, Sr3 P4 und Ba3 P4, Polyphosphide mit P4(6-)-Ketten in einer
 alpha-Th Si2-Defektstruktur
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              61
_journal_page_last               71
_journal_volume                  510
_journal_year                    1984
_chemical_formula_sum            'Ba3 P4'
_space_group_IT_number           43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   14.851
_cell_length_b                   18.236
_cell_length_c                   6.15
_cell_volume                     1665.560
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            vonSchnering_ZAACAB_1984_608.cif
_cod_data_source_block           Ba3P4
_cod_original_cell_volume        1665.56
_cod_database_code               1537252
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
-x+1/4,y+1/4,z+1/4
x+3/4,-y+3/4,z+1/4
x,y+1/2,z+1/2
-x,-y+1/2,z+1/2
-x+1/4,y+3/4,z+3/4
x+3/4,-y+5/4,z+3/4
x+1/2,y,z+1/2
-x+1/2,-y,z+1/2
-x+3/4,y+1/4,z+3/4
x+5/4,-y+3/4,z+3/4
x+1/2,y+1/2,z
-x+1/2,-y+1/2,z
-x+3/4,y+3/4,z+1/4
x+5/4,-y+5/4,z+1/4
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
P1 P-1 0.3467 0.9239 0.0214 1 0.0
P2 P-1 0.5782 0.0024 0.2465 1 0.0
Ba2 Ba+2 0.24532 0.08126 0.00578 1 0.0
Ba1 Ba+2 0 0 0.25 1 0.0
