data_31170-ICSD
#©2008 by Fachinformationszentrum Karlsruhe, and the U.S. Secretary of 
#Commerce on behalf of the United States.  All rights reserved.
_database_code_ICSD                31170
_audit_creation_date               1980/01/01
_audit_update_record               2006/04/01
_chemical_name_systematic          Carbon
_chemical_formula_structural       C
_chemical_formula_sum              C1
_chemical_name_mineral             'Graphite 2H'
_publ_section_title
;
Ueber die Kristallstruktur des Graphits.
;
loop_
_citation_id
_citation_journal_abbrev
_citation_year
_citation_journal_volume
_citation_page_first
_citation_page_last
_citation_journal_id_ASTM
primary 'Zeitschrift fuer Physik' 1924 25 317 337 ZEPYAA
2 'Diss. Univ. Greifswald' 1925 1 1 60 UNGRW8
3 'Journal of Solid State Chemistry' 1999 148 278 285 JSSCBI
_publ_author_name                  'Hassel, O.'
_cell_length_a                     2.47
_cell_length_b                     2.47
_cell_length_c                     6.79
_cell_angle_alpha                  90.
_cell_angle_beta                   90.
_cell_angle_gamma                  120.
_cell_volume                       35.88
_cell_formula_units_Z              4
_symmetry_space_group_name_H-M     'P 63 m c'
_symmetry_Int_Tables_number        186
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
  1	'-x, -x+y, z+1/2'
  2	'x-y, -y, z+1/2'
  3	'y, x, z+1/2'
  4	'x-y, x, z+1/2'
  5	'y, -x+y, z+1/2'
  6	'-x, -y, z+1/2'
  7	'x, x-y, z'
  8	'-x+y, y, z'
  9	'-y, -x, z'
 10	'-x+y, -x, z'
 11	'-y, x-y, z'
 12	'x, y, z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
C0+	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_occupancy
_atom_site_attached_hydrogens
C1 C0+ 2 a 0 0 0 1. 0 
C2 C0+ 2 b 0.3333 0.6667 0.005(5) 1. 0 

#End of data_31170-ICSD


