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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/40/8104039.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_8104039
loop_
_publ_author_name
'Niewa, R.'
'Jacobs, H.'
_publ_section_title
;
 Crysta structure of hafnium(IV) chloride, Hf Cl4
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              687
_journal_page_last               687
_journal_volume                  210
_journal_year                    1995
_chemical_formula_sum            'Cl4 Hf'
_chemical_name_systematic        'Hf Cl4'
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2yc'
_symmetry_space_group_name_H-M   'P 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 109.05
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.327
_cell_length_b                   7.377
_cell_length_c                   6.2
_cell_volume                     273.532
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Niewa_ZEKRDZ_1995_1829.cif
_cod_data_source_block           Cl4Hf1
_cod_original_cell_volume        273.5323
_cod_original_formula_sum        'Cl4 Hf1'
_cod_database_code               8104039
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-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
Hf1 Hf+4 0.5 0.33737 0.25 1 0.0
Cl2 Cl-1 0.2742 0.6063 0.0029 1 0.0
Cl1 Cl-1 0.2443 0.1375 0.0233 1 0.0
