/usr/share/avogadro/crystals/halides/AlCl3.cif is in avogadro-data 1.2.0-3.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 | #------------------------------------------------------------------------------
#$Date: 2010-01-30 13:59:17 +0000 (Sat, 30 Jan 2010) $
#$Revision: 966 $
#$URL: svn://cod.ibt.lt/cod/cif/1/1010563.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_1010563
_chemical_name_systematic 'Aluminium chloride'
_chemical_formula_structural 'Al Cl3'
_chemical_formula_sum 'Al Cl3'
_publ_section_title 'Zur Struktur Al Cl~3~'
loop_
_publ_author_name 'Laschkarew, W E'
_journal_name_full
;
Zeitschrift fuer Anorganische und Allgemeine Chemie
;
_journal_coden_ASTM ZAACAB
_journal_volume 193
_journal_year 1930
_journal_page_first 270
_journal_page_last 276
_cell_length_a 3.475(1)
_cell_length_b 3.475(1)
_cell_length_c 8.51
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 89.0
_cell_formula_units_Z 1
_exptl_crystal_density_meas 2.4
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
? ? ? ?
_cod_database_code 1010563
|