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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/74/2107433.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2107433
loop_
_publ_author_name
'Taylor, J.C.'
'Wilson, P.W.'
_publ_section_title
;
 The Structure of U O Cl2 by Neutron Diffraction
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              175
_journal_page_last               177
_journal_volume                  30
_journal_year                    1974
_chemical_formula_sum            'Cl2 O U'
_chemical_name_systematic        'U O Cl2'
_space_group_IT_number           55
_symmetry_space_group_name_Hall  '-P 2 2ab'
_symmetry_space_group_name_H-M   'P b a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   15.25
_cell_length_b                   17.8
_cell_length_c                   3.996
_cell_volume                     1084.714
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Taylor_ACBCAR_1974_481.cif
_cod_data_source_block           Cl2O1U1
_cod_original_formula_sum        'Cl2 O1 U1'
_cod_database_code               2107433
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z
-x,-y,-z
x,y,-z
-x-1/2,y-1/2,z
x-1/2,-y-1/2,z
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
O1 O-2 0.288 0.225 0 1 0.0
U1 U+4 0.336 0.255 0.5 1 0.0
Cl3 Cl-1 0.062 0.085 0.5 1 0.0
Cl5 Cl-1 0.327 0.404 0.5 1 0.0
Cl2 Cl-1 0.473 0.283 0 1 0.0
Cl1 Cl-1 0.121 0.453 0 1 0.0
Cl4 Cl-1 0.132 0.281 0.5 1 0.0
O2 O-2 0.23 0.056 0 1 0.0
U3 U+4 0.281 0.024 0.5 1 0.0
U2 U+4 0.162 0.168 0 1 0.0
O3 O-2 0.238 0.15 0.5 1 0.0
Cl6 Cl-1 0.432 0.118 0.5 1 0.0
