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#$Date: 2022-10-28 00:10:23 +0300 (Fri, 28 Oct 2022) $
#$Revision: 278833 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/78/1567866.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_1567866
loop_
_publ_author_name
'Gerasimenko, A. V.'
'Merkulov, E. B.'
'Tkachenko, I. A.'
'Kavun, V. Ya.'
'Goncharuk, V. K.'
'Sergienko, V. I.'
_publ_section_title
;
 Synthesis and Structure of Tin(II) Hexafluorozirconate
;
_journal_issue                   12
_journal_name_full               'Russian Journal of Coordination Chemistry'
_journal_page_first              839
_journal_page_last               842
_journal_paper_doi               10.1023/A:1021678111246
_journal_volume                  28
_journal_year                    2002
_chemical_formula_moiety         'F6 Sn Zr'
_chemical_formula_sum            'F6 Sn Zr'
_chemical_formula_weight         323.91
_chemical_name_systematic
;
Tin(II) hexafluorozirconate
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           13
_space_group_name_Hall           '-P 2yac'
_space_group_name_H-M_alt        'P 1 2/n 1'
_symmetry_Int_Tables_number      13
_symmetry_space_group_name_H-M   'P 1 2/n 1'
_audit_creation_method           'manually at INEOS RAS'
_cell_angle_alpha                90
_cell_angle_beta                 114.239(4)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.6119(5)
_cell_length_b                   5.2503(5)
_cell_length_c                   6.9929(6)
_cell_volume                     221.35(3)
_diffrn_ambient_temperature      295
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_exptl_crystal_density_diffrn    4.860
_exptl_crystal_F_000             288
_refine_ls_R_factor_gt           0.038
_refine_ls_wR_factor_ref         0.098
_cod_data_source_file            R41old.cif
_cod_data_source_block           compound_R41old
_cod_original_sg_symbol_H-M      'P 2/n'
_cod_database_code               1567866
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 1/2-x,y,1/2-z
3 -x,-y,-z
4 -1/2+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_U_iso_or_equiv
Sn Sn 0.75 0.03100(3) 0.25 0.01165(2)
Zr Zr 0.75 0.48265(3) 0.75 0.00613(3)
F(1) F 0.6795(1) 0.2050(2) 0.9173(1) 0.0141(2)
F(2) F 0.9184(1) 0.6849(2) 1.0332(1) 0.0131(2)
F(3) F 0.5101(1) 0.6842(2) 0.8082(1) 0.0172(2)
