data_global
_amcsd_formula_title 'Ba O6 P2'
loop_
_publ_author_name
'Grenier J'
'Martin C'
'Durif A'
'Tranqui D'
'Guitel J'
_journal_name_full 'Bulletin de la Societe Francaise de Mineralogie et de Cristallographie'
_journal_volume 90 
_journal_year 1967
_journal_page_first 24
_journal_page_last 31
_publ_section_title
;
 Une nouvelle forme du metaphosphate de baryum Ba (P O3)2
 _cod_database_code 1007050
;
_database_code_amcsd 0012121
_chemical_formula_sum 'Ba P2 O6'
_cell_length_a 4.510
_cell_length_b 13.44
_cell_length_c 8.36
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 506.736
_exptl_crystal_density_diffrn      3.870
_symmetry_space_group_name_H-M 'P 21 21 21'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,1/2+y,1/2-z'
  '1/2+x,1/2-y,-z'
  '1/2-x,-y,1/2+z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba1   0.25500   0.12600   0.19800
P1   0.71500   0.35300   0.22600
P2   0.21500   0.40200   0.42900
O1   0.38500   0.33200   0.29500
O2   0.88500   0.37000   0.38600
O3   0.71500   0.44800   0.12700
O4   0.78500   0.26000   0.13600
O5   0.76000   0.01100   0.12600
O6   0.81500   0.13600   0.42100