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#$Date: 2025-08-18 16:20:24 +0200 (Mon, 18 Aug 2025) $
#$Revision: 301776 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/51/11/1511123.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_1511123
loop_
_publ_author_name
'Mueller, B.G.'
'Fitz, H.'
_publ_section_title
;
 In B F4, das erste komplexe Fluorid mit Indium(I)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              579
_journal_page_last               582
_journal_paper_doi               10.1002/zaac.19976230190
_journal_volume                  623
_journal_year                    1997
_chemical_formula_sum            'B F4 In'
_chemical_name_systematic        'In (B F4)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.173
_cell_length_b                   5.727
_cell_length_c                   7.349
_cell_volume                     386.071
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            boron0-1_221.cif
_cod_data_source_block           B1F4In1
_cod_original_cell_volume        386.0707
_cod_original_formula_sum        'B1 F4 In1'
_cod_database_code               1511123
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-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_occupancy
_atom_site_U_iso_or_equiv
F1 F-1 0.1728 0.25 0.5605 1 0.0
F3 F-1 0.0766 0.0521 0.7982 1 0.0
F2 F-1 -0.074 0.25 0.6066 1 0.0
In1 In+1 0.18569 0.25 0.16638 1 0.0
B1 B+3 0.0622 0.25 0.6883 1 0.0
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 139040902
