#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/65/2106561.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_2106561
loop_
_publ_author_name
'Milligan, W.O.'
'Mullica, D.F.'
'Hall, M.A.'
_publ_section_title
;
 Structural Refinement of Lutetium Hydroxide Oxide
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              3086
_journal_page_last               3088
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'H Lu O2'
_chemical_name_systematic        'Lu O (O H)'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 109.33
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.836
_cell_length_b                   3.552
_cell_length_c                   4.247
_cell_volume                     83.075
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Milligan_ACBCAR_1980_29.cif
_cod_data_source_block           H1Lu1O2
_cod_original_cell_volume        83.07517
_cod_original_formula_sum        'H1 Lu1 O2'
_cod_database_code               2106561
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
x,-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 0.095 0.75 0.777 1 0.0
Lu1 Lu+3 0.1879 0.75 0.3322 1 0.0
O2 O-2 0.567 0.75 0.776 1 0.0
