#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/13/1531393.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_1531393
loop_
_publ_author_name
'Hellmann, A.'
'Mewis, A.'
_publ_section_title
;
 Neue Erdalkalimetall-Phosphide und -Arsenide des Cobalts
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1357
_journal_page_last               1364
_journal_volume                  627
_journal_year                    2001
_chemical_formula_sum            'Ca2 Co12 P7'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   9.073
_cell_length_b                   9.073
_cell_length_c                   3.585
_cell_volume                     255.577
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hellmann_ZAACAB_2001_5.cif
_cod_data_source_block           Ca2Co12P7
_cod_original_cell_volume        255.5769
_cod_database_code               1531393
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+y,-x,-z
-y,x-y,z
x,y,-z
-x+y,-x,z
-y,x-y,-z
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
P3 P 0 0 0 1 0.0
Ca1 Ca 0.3333 0.6667 0 1 0.0
P1 P 0.4051 0.2914 0 1 0.0
P2 P 0.1133 0.4059 0.5 1 0.0
Co2 Co 0.1509 0.2675 0 1 0.0
Co4 Co 0.2366 0.1036 0.5 1 0.0
Ca2 Ca 0.6667 0.3333 0.5 1 0.0
Co1 Co 0.4332 0.0564 0 1 0.0
Co3 Co 0.3819 0.4337 0.5 1 0.0
