#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/03/15/4031557.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_4031557
loop_
_publ_author_name
'Baybarz, R.D.'
'Fahey, J.A.'
'Haire, R.G.'
_publ_section_title
;
 The preparation, crystal structures and some properties of californium
 oxysulfate and oxysulfide
;
_journal_name_full               'Journal of Inorganic and Nuclear Chemistry'
_journal_page_first              2023
_journal_page_last               2027
_journal_volume                  36
_journal_year                    1974
_chemical_formula_sum            'Cf2 O2 S'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   3.844
_cell_length_b                   3.844
_cell_length_c                   6.656
_cell_volume                     85.175
_citation_journal_id_ASTM        JINCAO
_cod_data_source_file            Baybarz_JINCAO_1974_1804.cif
_cod_data_source_block           Cf2O2S1
_cod_original_cell_volume        85.17472
_cod_original_formula_sum        'Cf2 O2 S1'
_cod_database_code               4031557
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,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
Cf1 Cf+3 0.3333 0.6667 0.28 1 0.0
O1 O-2 0.3333 0.6667 0.64 1 0.0
S1 S-2 0 0 0 1 0.0
