/usr/share/avogadro/crystals/elements/Pu-Plutonium-alpha.cif is in avogadro-data 1.2.0-3.
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# All data on this site have been placed in the public domain by the
# contributors.
#------------------------------------------------------------------------------
#$Date: 2010-06-10 15:11:07 +0000 (Thu, 10 Jun 2010) $
#$Revision: 1210 $
#$URL: svn://cod.ibt.lt/cod/cif/9/9008587.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9008587
loop_
_publ_author_name
'Wyckoff, R. W. G.'
_publ_section_title
;
Second edition. Interscience Publishers, New York, New York
Sample is stable room conditions to 110 C
;
_journal_name_full 'Crystal Structures'
_journal_page_first 7
_journal_page_last 83
_journal_volume 1
_journal_year 1963
_chemical_formula_sum Pu
_chemical_name_mineral Plutonium-alpha
_space_group_IT_number 11
_symmetry_space_group_name_Hall '-P 2yb'
_symmetry_space_group_name_H-M 'P 1 21/m 1'
_cell_angle_alpha 90
_cell_angle_beta 101.80
_cell_angle_gamma 90
_cell_length_a 6.1835
_cell_length_b 4.8244
_cell_length_c 10.973
_cell_volume 320.425
_exptl_crystal_density_diffrn 20.232
_cod_database_code 9008587
_amcsd_database_code AMCSD#0010918
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x,1/2-y,z
-x,1/2+y,-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Pu1 0.33200 0.25000 0.15500
Pu2 0.77400 0.25000 0.17500
Pu3 0.14400 0.25000 0.34100
Pu4 0.65800 0.25000 0.45700
Pu5 0.01600 0.25000 0.62100
Pu6 0.46500 0.25000 0.64400
Pu7 0.33700 0.25000 0.92600
Pu8 0.89200 0.25000 0.89700
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