#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/82/1538299.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_1538299
loop_
_publ_author_name
'Hubtgren, R.'
'Gingrich, N.S.'
'Warren, B.E.'
_publ_section_title
;
 The atomic distribution in red and black phosphorus and the crystal
 structure of black phosphorus
;
_journal_name_full               'Journal of Chemical Physics'
_journal_page_first              351
_journal_page_last               351
_journal_volume                  3
_journal_year                    1935
_chemical_formula_sum            P
_space_group_IT_number           64
_symmetry_space_group_name_Hall  '-C 2ac 2'
_symmetry_space_group_name_H-M   'C m c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   3.316
_cell_length_b                   10.52
_cell_length_c                   4.389
_cell_volume                     153.107
_citation_journal_id_ASTM        JCPSA6
_cod_data_source_file            Hubtgren_JCPSA6_1935_1250.cif
_cod_data_source_block           P1
_cod_original_cell_volume        153.1073
_cod_original_formula_sum        P1
_cod_database_code               1538299
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x,-y,-z
-x+1/2,y,-z+1/2
-x,-y,-z
x-1/2,y,-z-1/2
-x,y,z
x-1/2,-y,z-1/2
x+1/2,y+1/2,z
-x+1,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x+1,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x,y+1/2,-z-1/2
-x+1/2,y+1/2,z
x,-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
P1 P 0 0.098 0.09 1 0.0
