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#$Date: 2025-08-18 18:33:07 +0300 (Mon, 18 Aug 2025) $
#$Revision: 301779 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/54/11/1541116.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_1541116
loop_
_publ_author_name
'Pepe, G.'
'Gay, J.M.'
_publ_section_title
;
 Structure of alpha-C F4 at low temperature
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              5735
_journal_page_last               5737
_journal_volume                  90
_journal_year                    1989
_chemical_formula_sum            'C F4'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 120.7
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.435
_cell_length_b                   4.32
_cell_length_c                   8.48
_cell_volume                     265.698
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Pepe_JCPSA6_1989_922.cif
_cod_data_source_block           C1F4
_cod_original_cell_volume        265.6982
_cod_original_formula_sum        'C1 F4'
_cod_database_code               1541116
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-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
F2 F-1 0.105 0.002 0.394 1 0.0
C1 C+4 0 0.178 -0.25 1 0.0
F1 F-1 0.106 0.355 -0.286 1 0.0
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 6393
