#------------------------------------------------------------------------------
#$Date: 2015-10-07 23:23:32 +0300 (Wed, 07 Oct 2015) $
#$Revision: 160935 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/43/1534346.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_1534346
loop_
_publ_author_name
'Calvo, C.'
_publ_section_title
;
 The crystal structure of alpha-Zn3 (P O4)2
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              436
_journal_page_last               445
_journal_volume                  43
_journal_year                    1965
_chemical_formula_sum            'O8 P2 Zn3'
_chemical_name_systematic        'Zn3 (P O4)2'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 105.13
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.14
_cell_length_b                   5.63
_cell_length_c                   15.04
_cell_volume                     665.364
_citation_journal_id_ASTM        CJCHAG
_cod_data_source_file            Calvo_CJCHAG_1965_1946.cif
_cod_data_source_block           O8P2Zn3
_cod_original_cell_volume        665.3639
_cod_database_code               1534346
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-y+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
O3 O-2 0.2129 0.9021 0.0625 1 0.0
Zn1 Zn+2 0 0.7448 0.25 1 0.0
O1 O-2 0.2929 0.0607 0.2211 1 0.0
P1 P+5 0.1592 0.0634 0.1286 1 0.0
O2 O-2 0.1197 0.3092 0.077 1 0.0
O4 O-2 0.9935 0.9676 0.1429 1 0.0
Zn2 Zn+2 0.2678 0.5548 0.0675 1 0.0
