#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/27/1522728.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_1522728
loop_
_publ_author_name
'Preiss, H.'
_publ_section_title
;
 Die Kristallstruktur der Verbindung Sb Cl2 F3
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              254
_journal_page_last               262
_journal_volume                  389
_journal_year                    1972
_chemical_formula_sum            'Cl2 F3 Sb'
_chemical_name_systematic        'Sb Cl2 F3'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 94.2
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   11.7
_cell_length_b                   10.4
_cell_length_c                   13.2
_cell_volume                     1601.863
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Preiss_ZAACAB_1972_112.cif
_cod_data_source_block           Cl2F3Sb1
_cod_original_cell_volume        1601.862
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Cl2 F3 Sb1'
_cod_database_code               1522728
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-z
x-1/2,-y-1/2,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
Cl4 Cl-1 0.4432 0.4538 0.2148 1 0.0
Cl3 Cl-1 0.2978 0.1556 0.3322 1 0.0
Sb2 Sb+5 0.1913 0.3825 0.8993 1 0.0
F7 F-1 0.3785 0.0204 0.9194 1 0.0
Cl6 Cl-1 0.3557 0.4335 0.5596 1 0.0
F1 F-1 0.0358 0.3689 0.9538 1 0.0
F6 F-1 0.1828 0.4089 0.389 1 0.0
Cl2 Cl-1 0.0642 0.1784 0.4872 1 0.0
F5 F-1 0.1721 0.1051 0.1234 1 0.0
Sb1 Sb+5 0.114 0.1471 0.3309 1 0.0
F3 F-1 0.3487 0.3602 0.8599 1 0.0
Cl1 Cl-1 0.0185 0.2812 0.2323 1 0.0
F8 F-1 0.3917 0.1573 0.0978 1 0.0
Cl5 Cl-1 0.1305 0.2925 0.7571 1 0.0
F2 F-1 0.3037 0.0557 0.6532 1 0.0
F4 F-1 0.2598 0.4289 0.0232 1 0.0
Sb3 Sb+5 0.2736 0.0488 0.0272 1 0.0
F9 F-1 0.2268 0.2003 0.9445 1 0.0
