#------------------------------------------------------------------------------
#$Date: 2024-05-23 11:45:01 +0200 (Thu 23 de May de 2024) $
#$Revision: 292002 $
#$URL: svn://www.crystallography.net/cod/cif/9/01/48/9014811.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9014811
loop_
_publ_author_name
'Burns, J.'
'Ellison, R.'
'Levy, H.'
_publ_section_title
;
 The crystal structure of the molecular addition compound xenon difluoride
 - xenon tetrafluoride
;
_journal_issue                   1
_journal_name_full               'Acta Crystallographica'
_journal_page_first              11
_journal_page_last               16
_journal_paper_doi               10.1107/S0365110X65000038
_journal_volume                  18
_journal_year                    1965
_chemical_formula_sum            'F6 Xe2'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 92.67
_cell_angle_gamma                90
_cell_length_a                   6.64
_cell_length_b                   7.33
_cell_length_c                   6.40
_cell_formula_units_Z            2
_cell_volume                     311.158
_database_code_amcsd             0016029
_exptl_crystal_density_diffrn    4.019
_cod_duplicate_entry             1008087
_cod_original_formula_sum        'Xe F3'
_cod_database_code               9014811
_amcsd_formula_title             'F6 Xe2'
loop_
_space_group_symop_operation_xyz
x,y,z
x,1/2-y,1/2+z
-x,1/2+y,1/2-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Xe1 0.00000 0.00000 0.00000
Xe2 0.50000 0.00000 0.50000
F1 0.16810 -0.18750 0.15240
F2 0.50530 0.07830 0.21140
F3 0.24000 0.10870 0.51630
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0016029
