#------------------------------------------------------------------------------
#$Date: 2016-03-02 09:51:31 +0200 (Wed, 02 Mar 2016) $
#$Revision: 177123 $
#$URL: svn://www.crystallography.net/cod/cif/5/91/01/5910165.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_5910165
loop_
_publ_author_name
'Wyckoff, R. W. G.'
_publ_section_title
;
Pages 91 & 92 from the Structure of Crystals, vol. 4 by Wyckoff R W G. 
published by Interscience Publishers, Inc. in 1951 
;
_journal_name_full               'The Structure of Crystals'
_journal_page_first              91
_journal_page_last               92
_journal_volume                  4
_journal_year                    1951
_chemical_formula_structural     Ni4C12O12P4O6
_chemical_formula_sum            'C12 Ni4 O18 P4'
_space_group_IT_number           215
_symmetry_cell_setting           cubic
_symmetry_Int_Tables_number      215
_symmetry_space_group_name_Hall  'P -4 2 3'
_symmetry_space_group_name_H-M   'P -4 3 m'
_audit_creation_date             2006-30-10
_audit_creation_method
;
Pages 91 & 92 from the Structure of Crystals, vol. 4 by Wyckoff R W G. 
published by Interscience Publishers, Inc. in 1951 
;
_audit_update_record
'created by Girish Upreti, Portland State University'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.811
_cell_length_b                   8.811
_cell_length_c                   8.811
_cell_volume                     684.031
_cod_original_formula_sum        'Ni4 C12 O12 P4 O6'
_cod_database_code               5910165
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,z,-y
-x,-z,y
-z,-y,x
z,-y,-x
y,-x,-z
-y,x,-z
z,x,y
y,z,x
-y,-z,x
z,-x,-y
-y,z,-x
-z,-x,y
-z,x,-y
y,-z,-x
x,-y,-z
-x,y,-z
-x,-y,z
-y,-x,z
y,x,z
-z,y,-x
z,y,x
x,-z,-y
x,z,y
loop_
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_label
0.25700 0.25700 0.25700 Ni1
0.25700 -0.25700 -0.25700 Ni2
-0.25700 -0.25700 0.25700 Ni3
-0.25700 0.25700 -0.25700 Ni4
0.11600 0.11600 0.11600 P1
0.11600 -0.11600 -0.11600 P2
-0.11600 -0.11600 0.11600 P3
-0.11600 0.11600 -0.11600 P4
0.20400 0.00000 0.00000 O1
0.00000 0.20400 0.00000 O2
0.00000 0.00000 0.20400 O3
-0.20400 0.00000 0.00000 O4
0.00000 -0.20400 0.00000 O5
0.00000 0.00000 -0.20400 O6
0.19000 0.19000 0.57900 O7
0.57900 0.19000 0.19000 O8
0.19000 0.57900 0.19000 O9
-0.19000 0.19000 -0.57900 O10
-0.57900 0.19000 -0.19000 O11
-0.19000 0.57900 -0.19000 O12
0.19000 -0.19000 -0.57900 O13
0.57900 -0.19000 -0.19000 O14
0.19000 -0.57900 -0.19000 O15
-0.19000 -0.19000 0.57900 O16
-0.57900 -0.19000 0.19000 O17
-0.19000 -0.57900 0.19000 O18
0.21600 0.21600 0.45500 O19
0.45500 0.21600 0.21600 O20
0.21600 0.45500 0.21600 O21
-0.21600 0.21600 -0.45500 O22
-0.45500 0.21600 -0.21600 O23
-0.21600 0.45500 -0.21600 O24
0.21600 -0.21600 -0.45500 O25
0.45500 -0.21600 -0.21600 O26
