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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/45/1524531.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_1524531
loop_
_publ_author_name
'Hayakawa, H.'
'Ono, S.'
'Sasaki, Y.'
'Kobayashi, A.'
_publ_section_title
;
 The crystal structure of cerium silicon triphosphide Ce Si P3
;
_journal_name_full
'Nippon Kagaku Kaishi (= J.Chem.Soc.Japan) (1947-)'
_journal_page_first              1214
_journal_page_last               1220
_journal_volume                  9
_journal_year                    1978
_chemical_formula_sum            'Ce P3 Si'
_chemical_name_systematic        'Ce Si P3'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P -2ac -2n'
_symmetry_space_group_name_H-M   'P n 21 a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   5.861
_cell_length_b                   5.712
_cell_length_c                   25.295
_cell_volume                     846.827
_citation_journal_id_ASTM        NKAKB8
_cod_data_source_file            Hayakawa_NKAKB8_1978_448.cif
_cod_data_source_block           Ce1P3Si1
_cod_original_cell_volume        846.8268
_cod_original_sg_symbol_Hall     'P 2c -2n (-x,z,y)'
_cod_original_formula_sum        'Ce1 P3 Si1'
_cod_database_code               1524531
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x+1/2,y+1/2,z+1/2
x+1/2,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
P2 P-2 0.0278 0.2544 0.12323 1 0.0
Ce1 Ce+3 0.0229 0.75 0.08869 1 0.0
P4 P-2 0.6877 0.5602 -0.00084 1 0.0
P6 P-2 0.9807 0.727 0.21112 1 0.0
P3 P-2 0.3153 0.4675 0.00344 1 0.0
Ce2 Ce+3 0.5241 0.2504 0.0978 1 0.0
Si1 Si+4 0.9449 0.3387 0.2053 1 0.0
Si2 Si+4 0.6153 0.8367 0.20863 1 0.0
P1 P-2 0.5159 0.7503 0.12701 1 0.0
P5 P-2 0.583 0.2252 0.21577 1 0.0
