#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/8/10/42/8104253.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_8104253
loop_
_publ_author_name
'Mansmann, M.'
_publ_section_title
;
 Ueber Verbindungen vom Anti-La F3-Strukturtyp
;
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, 
Kristallchemie (-144,1977)
;
_journal_page_first              399
_journal_page_last               406
_journal_volume                  122
_journal_year                    1965
_chemical_formula_sum            'Cu3 P'
_space_group_IT_number           165
_symmetry_space_group_name_Hall  '-P 3 2"c'
_symmetry_space_group_name_H-M   'P -3 c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   6.992
_cell_length_b                   6.992
_cell_length_c                   7.17
_cell_volume                     303.566
_citation_journal_id_ASTM        ZEKGAX
_cod_data_source_file            Mansmann_ZEKGAX_1965_1526.cif
_cod_data_source_block           Cu3P1
_cod_original_cell_volume        303.5657
_cod_original_formula_sum        'Cu3 P1'
_cod_database_code               8104253
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z+1/2
-x,-x+y,-z+1/2
x-y,-y,-z+1/2
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z-1/2
x,x-y,z-1/2
-x+y,y,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
Cu3 Cu+1 0 0 0.25 1 0.0
Cu2 Cu+1 0.3333 0.6667 0.1825 1 0.0
P1 P-3 0.6587 0 0.25 1 0.0
Cu1 Cu+1 0.3758 0.0623 0.0813 1 0.0