#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/37/4343767.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_4343767
loop_
_publ_author_name
'Donohue, P.C.'
_publ_section_title
;
 The synthesis, structure, and superconducting properties of new
 high-pressure forms of tin phosphide
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              335
_journal_page_last               337
_journal_volume                  9
_journal_year                    1970
_chemical_formula_sum            'P Sn'
_chemical_name_systematic        'Sn P'
_space_group_IT_number           107
_symmetry_space_group_name_Hall  'I 4 -2'
_symmetry_space_group_name_H-M   'I 4 m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.831
_cell_length_b                   3.831
_cell_length_c                   5.963
_cell_volume                     87.516
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Donohue_INOCAJ_1970_1822.cif
_cod_data_source_block           P1Sn1
_cod_original_cell_volume        87.51633
_cod_original_formula_sum        'P1 Sn1'
_cod_database_code               4343767
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+1/2,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
Sn1 Sn 0 0 0 1 0.0
P1 P 0 0 0.428 1 0.0
