data_global
_amcsd_formula_title 'O10 P2 Pb V2'
loop_
_publ_author_name
'Grandin A'
'Chardon J'
'Borel M'
'Leclaire A'
'Raveau B'
_journal_name_full 'Acta Crystallographica, Section C'
_journal_volume 48 
_journal_year 1992
_journal_page_first 1913
_journal_page_last 1915
_publ_section_title
;
 Structure of PbV2P2O10
 _cod_database_code 1001534
;
_database_code_amcsd 0010277
_chemical_formula_sum 'Pb V2 P2 O10'
_cell_length_a 5.2306
_cell_length_b 8.5805
_cell_length_c 16.790
_cell_angle_alpha 90
_cell_angle_beta 91.01
_cell_angle_gamma 90
_cell_volume 753.438
_exptl_crystal_density_diffrn      4.681
_symmetry_space_group_name_H-M 'P 1 21/c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,1/2-y,1/2+z'
  '-x,1/2+y,1/2-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Pb1   0.06382   0.19558   0.18163
V1   0.13970   0.84540   0.06649
V2   0.45870   0.03730   0.34912
P1   0.36170   0.27560   0.01960
P2   0.37210   0.41710   0.32170
O1   0.17300   0.67980   0.11020
O2  -0.11800   0.82890  -0.02320
O3  -0.14400   0.94980   0.12600
O4   0.39900   0.82350  -0.01350
O5   0.37200   0.96890   0.13920
O6   0.21200  -0.05180   0.31430
O7   0.38100   0.24420   0.29980
O8   0.68000   0.01170   0.25440
O9   0.64000  -0.14300   0.39780
O10   0.33900   0.10710   0.45200
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
Pb1 0.00717 0.00318 0.00082 -0.00130 0.00057 -0.00071
V1 0.00280 0.00270 0.00028 0.00090 -0.00020 -0.00040
V2 0.00440 0.00170 0.00026 -0.00010 0.00000 0.00000
P1 0.00340 0.00220 0.00017 -0.00080 0.00010 -0.00020
P2 0.00240 0.00130 0.00021 0.00010 -0.00020 -0.00010
O1 0.00500 0.00370 0.00090 -0.00500 0.00000 0.00070
O2 0.00300 0.00490 0.00030 -0.00400 -0.00020 0.00040
O3 0.00500 0.00360 0.00080 0.00200 0.00100 -0.00140
O4 0.00600 0.00390 0.00070 0.00300 0.00090 0.00020
O5 0.00500 0.00260 0.00080 -0.00200 -0.00090 0.00020
O6 0.00600 0.00370 0.00130 -0.00400 -0.00100 -0.00130
O7 0.00900 0.00230 0.00030 0.00100 -0.00170 -0.00010
O8 0.00500 0.00360 0.00030 -0.00200 -0.00080 -0.00140
O9 0.00900 0.00320 0.00030 0.00700 0.00160 -0.00020
O10 0.00900 0.00300 0.00050 -0.00300 0.00040 -0.00150