#------------------------------------------------------------------------------
#$Date: 2013-05-09 16:53:25 +0300 (Thu, 09 May 2013) $
#$Revision: 86000 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/47/9014799.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9014799
loop_
_publ_author_name
'Rowe, R.'
'Grice, J. D.'
'Poirier, G.'
'Stanley, C. J.'
'Horvath, L.'
_publ_section_title
;
 Nisnite, Ni3Sn, a new nickel mineral species from the Jeffrey mine, Asbestos, Quebec
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              651
_journal_page_last               656
_journal_volume                  49
_journal_year                    2011
_chemical_compound_source        'Jeffrey mine, Asbestos, Quebec, Canada'
_chemical_formula_sum            'Ni3 Sn'
_chemical_name_mineral           Nisnite
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.7349
_cell_length_b                   3.7349
_cell_length_c                   3.7349
_cell_volume                     52.100
_database_code_amcsd             0018385
_exptl_crystal_density_diffrn    9.395
_[local]_cod_cif_authors_sg_H-M  'P 4/m -3 2/m'
_cod_database_code               9014799
loop_
_space_group_symop_operation_xyz
x,y,z
z,-x,y
-y,z,-x
x,-y,z
-z,x,-y
y,-z,x
-x,y,-z
x,-z,-y
-z,y,x
y,-x,-z
-x,z,y
z,-y,-x
-y,x,z
x,z,y
-z,-y,-x
y,x,z
-x,-z,-y
z,y,x
-y,-x,-z
z,x,-y
-y,-z,x
x,y,-z
-z,-x,y
y,z,-x
-x,-y,z
-z,x,y
y,-z,-x
-x,y,z
z,-x,-y
-y,z,x
x,-y,-z
-x,z,-y
z,-y,x
-y,x,-z
x,-z,y
-z,y,-x
y,-x,z
-x,-z,y
z,y,-x
-y,-x,z
x,z,-y
-z,-y,x
y,x,-z
-z,-x,-y
y,z,x
-x,-y,-z
z,x,y
-y,-z,-x
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Ni 0.00980 0.00890 0.00890 0.00000 0.00000 0.00000
Sn 0.00820 0.00820 0.00820 0.00000 0.00000 0.00000
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Ni 0.00000 0.50000 0.50000 0.09200
Sn 0.00000 0.00000 0.00000 0.00800