#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/42/1534251.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_1534251
loop_
_publ_author_name
'Belokoneva, E.L.'
'Ruchkina, E.A.'
'Dimitrova, O.V.'
_publ_section_title
;
 Synthesis and crystal structure of the new lead borophosphate Pb2 (B P2
 O8 (OH))
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              204
_journal_page_last               207
_journal_volume                  48
_journal_year                    2003
_chemical_formula_sum            'B H O9 P2 Pb2'
_chemical_name_systematic        'Pb2 (B P2 O8 (O H))'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 94.77
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.695
_cell_length_b                   16.05
_cell_length_c                   8.064
_cell_volume                     734.535
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Belokoneva_ZNOKAQ_2003_433.cif
_cod_data_source_block           H1B1O9P2Pb2
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'H1 B1 O9 P2 Pb2'
_cod_database_code               1534251
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-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 0.605 0.1465 0.87 1 0.0
O7 O-2 0.427 0.2253 0.667 1 0.0
Pb2 Pb+2 0.75962 0.94213 0.31476 1 0.0
O5 O-2 0.023 0.1056 0.421 1 0.0
O2 O-2 0.74 0.2106 0.322 1 0.0
P2 P+5 0.794 0.1446 0.4544 1 0.0
O6 O-2 0.809 0.0191 0.798 1 0.0
O1 O-2 0.69 0.0508 0.096 1 0.0
O4 O-2 0.581 0.0824 0.452 1 0.0
O8 O-2 0.83 0.1897 0.625 1 0.0
O9 O-2 0.036 0.1336 0.951 1 0.0
P1 P+5 0.7946 0.085 0.9336 1 0.0
B1 B+3 0.648 0.2129 0.742 1 0.0
Pb1 Pb+2 0.33009 0.12268 0.19242 1 0.0
