###############################################################################
# Kohlhaas, R.;Duenner, P.;Schmitz-Pranghe, N. (1967)
# Zeitschrift fuer Angewandte Physik 23, 245-249
# Ueber die Temperaturabhaengigkeit der Gitterparameter von Eisen, Koba\
#lt und Nickel im Bereich hoher Temperaturen
# 
# CIF by ICSD-for-WWW,  Copyright 2003 FIZ-Karlsruhe & A.W.Hewat (hewat@ill.fr)
# NOT TO BE PUBLISHED IN ANY FORM. See http://icsd.ill.fr/icsd/conditions.html
###############################################################################

data_53451-ICSD
_database_code_ICSD                53451
_audit_creation_date               2003-04-01
_chemical_name_systematic
'Iron - alpha'
_chemical_formula_structural       
'Fe'
_chemical_formula_sum              
'Fe1'
_publ_section_title                
'Fe1'
loop_
_citation_id
_citation_journal_abbrev
_citation_year
_citation_journal_volume
_citation_page_first
_citation_page_last
_citation_journal_id_ASTM
primary 'Zeitschrift fuer Angewandte Physik' 1967 23 245 249 ZAPHAX
loop_
_publ_author_name
Kohlhaas, R.;Duenner, P.;Schmitz-Pranghe, N.
_cell_length_a                     2.8665
_cell_length_b                     2.8665
_cell_length_c                     2.8665
_cell_angle_alpha                  90.
_cell_angle_beta                   90.
_cell_angle_gamma                  90.
_cell_volume                       23.55
_cell_formula_units_Z              2
_symmetry_space_group_name_H-M     'I m -3 m'
_symmetry_Int_Tables_number        229
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
 1 'x,y,z'
 2 '1/2+x,1/2+y,1/2+z'
 3 'x,-y,-z'
 4 '1/2+x,1/2-y,1/2-z'
 5 'x,-y,z'
 6 '1/2+x,1/2-y,1/2+z'
 7 '-z,-y,x'
 8 '1/2-z,1/2-y,1/2+x'
 9 'z,-y,x'
 10 '1/2+z,1/2-y,1/2+x'
 11 '-y,x,-z'
 12 '1/2-y,1/2+x,1/2-z'
 13 '-y,x,z'
 14 '1/2-y,1/2+x,1/2+z'
 15 '-y,-z,x'
 16 '1/2-y,1/2-z,1/2+x'
 17 '-y,z,x'
 18 '1/2-y,1/2+z,1/2+x'
 19 'x,-z,-y'
 20 '1/2+x,1/2-z,1/2-y'
 21 'x,-z,y'
 22 '1/2+x,1/2-z,1/2+y'
 23 'x,z,-y'
 24 '1/2+x,1/2+z,1/2-y'
 25 'x,z,y'
 26 '1/2+x,1/2+z,1/2+y'
 27 '-z,x,-y'
 28 '1/2-z,1/2+x,1/2-y'
 29 '-z,x,y'
 30 '1/2-z,1/2+x,1/2+y'
 31 'z,x,-y'
 32 '1/2+z,1/2+x,1/2-y'
 33 'z,x,y'
 34 '1/2+z,1/2+x,1/2+y'
 35 'y,x,-z'
 36 '1/2+y,1/2+x,1/2-z'
 37 'y,x,z'
 38 '1/2+y,1/2+x,1/2+z'
 39 'y,-z,x'
 40 '1/2+y,1/2-z,1/2+x'
 41 'y,z,x'
 42 '1/2+y,1/2+z,1/2+x'
 43 'x,y,-z'
 44 '1/2+x,1/2+y,1/2-z'
 45 '-z,y,x'
 46 '1/2-z,1/2+y,1/2+x'
 47 'z,y,x'
 48 '1/2+z,1/2+y,1/2+x'
 49 '-x,-y,-z'
 50 '1/2-x,1/2-y,1/2-z'
 51 '-x,y,z'
 52 '1/2-x,1/2+y,1/2+z'
 53 '-x,y,-z'
 54 '1/2-x,1/2+y,1/2-z'
 55 'z,y,-x'
 56 '1/2+z,1/2+y,1/2-x'
 57 '-z,y,-x'
 58 '1/2-z,1/2+y,1/2-x'
 59 'y,-x,z'
 60 '1/2+y,1/2-x,1/2+z'
 61 'y,-x,-z'
 62 '1/2+y,1/2-x,1/2-z'
 63 'y,z,-x'
 64 '1/2+y,1/2+z,1/2-x'
 65 'y,-z,-x'
 66 '1/2+y,1/2-z,1/2-x'
 67 '-x,z,y'
 68 '1/2-x,1/2+z,1/2+y'
 69 '-x,z,-y'
 70 '1/2-x,1/2+z,1/2-y'
 71 '-x,-z,y'
 72 '1/2-x,1/2-z,1/2+y'
 73 '-x,-z,-y'
 74 '1/2-x,1/2-z,1/2-y'
 75 'z,-x,y'
 76 '1/2+z,1/2-x,1/2+y'
 77 'z,-x,-y'
 78 '1/2+z,1/2-x,1/2-y'
 79 '-z,-x,y'
 80 '1/2-z,1/2-x,1/2+y'
 81 '-z,-x,-y'
 82 '1/2-z,1/2-x,1/2-y'
 83 '-y,-x,z'
 84 '1/2-y,1/2-x,1/2+z'
 85 '-y,-x,-z'
 86 '1/2-y,1/2-x,1/2-z'
 87 '-y,z,-x'
 88 '1/2-y,1/2+z,1/2-x'
 89 '-y,-z,-x'
 90 '1/2-y,1/2-z,1/2-x'
 91 '-x,-y,z'
 92 '1/2-x,1/2-y,1/2+z'
 93 'z,-y,-x'
 94 '1/2+z,1/2-y,1/2-x'
 95 '-z,-y,-x'
 96 '1/2-z,1/2-y,1/2-x'
loop_
_atom_type_symbol
_atom_type_oxidation_number
Fe0+     0.
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_B_iso_or_equiv
_atom_site_occupancy
Fe1 Fe0+ 2 a 0 0 0 0. 1.
#End of data_53451-ICSD
