data_global _chemical_name_mineral 'Airdite' loop_ _publ_author_name 'Kang H Y' 'Lee W C' 'Wang S L' _journal_name_full 'Inorganic Chemistry' _journal_volume 31 _journal_year 1992 _journal_page_first 4743 _journal_page_last 4748 _publ_section_title ; Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) ; _database_code_amcsd 0012706 _chemical_compound_source 'Synthetic' _chemical_formula_sum 'Sr V2 P2 O14 H8' _cell_length_a 9.026 _cell_length_b 9.010 _cell_length_c 12.841 _cell_angle_alpha 90 _cell_angle_beta 100.19 _cell_angle_gamma 90 _cell_volume 1027.813 _exptl_crystal_density_diffrn 3.125 _symmetry_space_group_name_H-M 'C 1 c 1' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,z' 'x,-y,1/2+z' '1/2+x,1/2-y,1/2+z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Sr 0.73479 0.19090 0.27927 0.01360 V1 0.85760 0.10680 0.98340 0.00740 V2 0.88260 0.61110 0.07220 0.00720 P1 0.62140 0.35630 0.02590 0.00740 P2 0.62160 0.85660 0.02780 0.00670 O1 0.87500 0.11310 0.10930 0.01400 O2 0.70000 0.26620 0.94700 0.01400 O3 0.99800 -0.05440 0.95480 0.01500 O4 0.69660 -0.04970 0.95090 0.01000 O5 0.01100 0.25450 0.95450 0.01200 O6 0.84700 0.62250 0.94770 0.01700 O7 0.73500 0.45630 0.09630 0.01500 O8 0.73800 0.76740 0.10450 0.01300 O9 0.04400 0.45560 0.09990 0.01400 O10 0.55700 0.25420 0.10230 0.01100 O11b 0.83240 0.08740 0.79120 0.01500 H11A 0.77370 0.13400 0.71960 0.05000 H11B 0.92410 0.06670 0.76260 0.05000 O12b 0.94500 0.60170 0.26030 0.01500 H12A 0.96260 0.64420 0.32580 0.05000 H12B 0.84570 0.55660 0.23840 0.05000 O13b 0.62400 0.45970 0.27800 0.01600 H13A 0.63300 0.54360 0.32340 0.05000 H13B 0.58660 0.49780 0.20650 0.05000 O14b 0.99000 0.30700 0.27770 0.01900 H14A 0.05290 0.28480 0.23740 0.05000 H14B 0.98690 0.40990 0.28240 0.05000 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 Sr 0.01400 0.01580 0.01060 -0.00030 0.00120 0.00340 V1 0.00610 0.00810 0.00820 -0.00020 0.00160 -0.00010 V2 0.00630 0.00620 0.00930 0.00000 0.00170 0.00120 P1 0.00760 0.00720 0.00790 -0.00020 0.00300 -0.00060 P2 0.00630 0.00760 0.00640 0.00030 0.00170 0.00110 O1 0.01290 0.02210 0.00600 -0.00570 -0.00200 -0.00620 O2 0.01550 0.01170 0.01320 0.00240 0.00190 -0.00150 O3 0.01630 0.01060 0.01590 0.00310 -0.00090 0.00030 O4 0.01550 0.00970 0.00670 -0.00470 0.00430 -0.00530 O5 0.00930 0.01250 0.01370 -0.00190 0.00040 0.00530 O6 0.01330 0.01380 0.02540 -0.00590 0.00840 -0.00550 O7 0.01910 0.02040 0.00860 -0.00650 0.01140 -0.00620 O8 0.02150 0.01200 0.00660 0.00460 0.00100 0.00260 O9 0.01370 0.01910 0.00960 0.00640 0.00130 0.00080 O10 0.01690 0.01170 0.00160 -0.00110 -0.00350 0.00190 O11b 0.01210 0.01610 0.01580 0.00080 -0.00330 0.00130 O12b 0.01860 0.01460 0.02370 -0.00920 0.00470 -0.00530 O13b 0.01720 0.02170 0.00900 0.00060 0.00420 -0.00570 O14b 0.01860 0.01460 0.02370 -0.00930 0.00470 -0.00530