data_global _amcsd_formula_title 'H24 N2 O26 P6 Zn2' loop_ _publ_author_name 'Averbuch-Pouchot M' 'Durif A' _journal_name_full 'European Journal of Solid State and Inorganic Chemistry' _journal_volume 30 _journal_year 1993 _journal_page_first 573 _journal_page_last 581 _publ_section_title ; Elaboration and crystal structure of zinc-ammonium cyclohexaphosphate octahydrate: Zn2(NH4)2P6O18 . 8H2O _cod_database_code 1007214 ; _database_code_amcsd 0015899 _chemical_formula_sum 'Zn N P3 O13 H12' _cell_length_a 8.717 _cell_length_b 10.297 _cell_length_c 7.409 _cell_angle_alpha 104.82 _cell_angle_beta 111.03 _cell_angle_gamma 70.96 _cell_volume 579.472 _exptl_crystal_density_diffrn 2.249 _symmetry_space_group_name_H-M 'P -1' loop_ _space_group_symop_operation_xyz 'x,y,z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Zn1 0.00000 0.00000 0.00000 Zn2 0.50000 0.50000 0.50000 N1 0.78720 0.42000 0.12040 P1 0.77714 0.06832 0.29860 P2 0.12168 0.22418 0.87480 P3 0.47250 0.24384 0.07760 O1 0.79640 0.12330 0.50780 O2 0.87660 0.10570 0.20230 O3 0.18970 0.09610 0.72450 O4 0.58040 0.10670 0.17440 O5 0.06240 0.34920 0.78020 O6 0.00440 0.19040 0.94990 O7 0.28700 0.23410 0.05590 O8 0.50700 0.36870 0.22100 O9 0.49420 0.22770 0.88390 O10 0.23540 -0.00550 0.22690 O11 0.24760 0.51170 0.45840 O12 0.58490 0.33770 0.65310 O13 0.13890 0.29120 0.40730 H1 0.67600 0.06100 0.82000 H2 0.76900 0.03900 0.67600 H3 0.22500 0.42000 0.43000 H4 0.83300 0.44400 0.64000 H5 0.64500 0.26100 0.60000 H6 0.52300 0.30400 0.70000 H7 0.14600 0.27500 0.51000 H8 0.15000 0.20000 0.31000 H9 0.86000 0.34500 0.19000 H10 0.74000 0.40400 0.98000 H11 0.16600 0.50700 0.84000 H12 0.68000 0.41100 0.14000 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 Zn1 0.01470 0.01420 0.01750 -0.00470 0.00830 0.00170 Zn2 0.01680 0.01550 0.02470 -0.00300 0.00830 0.00590 N1 0.03700 0.02500 0.05700 -0.01400 0.02700 -0.00400 P1 0.01320 0.01300 0.01400 -0.00330 0.00620 0.00140 P2 0.01100 0.01200 0.01630 -0.00290 0.00470 0.00360 P3 0.01230 0.01510 0.01610 -0.00430 0.00490 0.00300 O1 0.02700 0.02000 0.01500 -0.00260 0.01010 0.00020 O2 0.02260 0.01550 0.02500 -0.00680 0.01450 0.00080 O3 0.02040 0.01210 0.02080 -0.00120 0.01100 0.00440 O4 0.01520 0.01960 0.03100 -0.00540 0.00240 0.01030 O5 0.02110 0.01420 0.02600 -0.00300 0.00780 0.00820 O6 0.01450 0.01600 0.02350 -0.00390 0.00900 0.00340 O7 0.01220 0.03100 0.01890 -0.00700 0.00410 0.00530 O8 0.02900 0.02000 0.03200 -0.01180 0.01230 -0.00330 O9 0.02630 0.03900 0.02200 -0.01180 0.01080 0.00770 O10 0.01910 0.02500 0.02300 -0.00450 0.00610 0.00870 O11 0.01880 0.02500 0.03700 -0.00710 0.00530 0.01010 O12 0.04500 0.01800 0.05000 0.00680 0.03410 0.01400 O13 0.08000 0.04000 0.03600 -0.03500 0.02600 -0.00200