data_global _amcsd_formula_title 'H16.48 Li6 O26.24 P6' loop_ _publ_author_name 'Rzaigui M' 'Bagieu M' _journal_name_full 'Journal of Solid State Chemistry' _journal_volume 108 _journal_year 1994 _journal_page_first 11 _journal_page_last 17 _publ_section_title ; Synthesis and crystal structure of the lithium cyclohexaphosphate hydrate Li6P6O18 . 9H2O _cod_database_code 1008663 ; _database_code_amcsd 0016551 _chemical_formula_sum 'P6 O26.238 Li6 H8' _cell_length_a 15.429 _cell_length_b 11.794 _cell_length_c 14.369 _cell_angle_alpha 90 _cell_angle_beta 115.95 _cell_angle_gamma 90 _cell_volume 2351.095 _exptl_crystal_density_diffrn 1.851 _symmetry_space_group_name_H-M 'C 1 2/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' '-x,y,1/2-z' '1/2-x,1/2+y,1/2-z' '-x,-y,-z' '1/2-x,1/2-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy P1 0.09453 0.20127 0.58642 1.00000 P2 0.11657 -0.21049 0.48456 1.00000 P3 0.20707 0.00746 0.57128 1.00000 O1 0.14280 0.27190 0.53770 1.00000 O2 0.10690 0.22930 0.69170 1.00000 O3 0.01690 0.19770 -0.00870 1.00000 O4 0.12290 0.07210 0.58460 1.00000 O5 0.09870 -0.26040 0.38270 1.00000 O6 0.18450 -0.26830 0.58000 1.00000 O7 0.14770 -0.08220 0.48360 1.00000 O8 0.25460 0.08530 0.52700 1.00000 O9 0.23290 0.44670 0.83120 1.00000 O10 0.15520 0.48280 0.13050 1.00000 O11 0.46360 -0.00330 0.60310 1.00000 O12 0.00000 0.96420 0.25000 1.00000 O13 0.00000 0.15130 0.25000 0.69200 O14 0.91980 0.21400 0.23900 0.61000 O15 0.14700 0.18400 0.30100 0.28000 O16 0.00000 0.33900 0.25000 0.24400 O17 0.04400 0.04200 0.25600 0.26100 Li1 0.69120 0.21140 0.32380 1.00000 Li2 0.14330 0.42960 0.51110 1.00000 Li3 0.00000 0.80600 0.25000 1.00000 Li4 0.25000 0.25000 0.50000 1.00000 H1 0.31600 0.98600 0.31300 1.00000 H2 0.83200 0.41600 0.38200 1.00000 H3 0.02100 0.48800 0.12800 1.00000 H4 0.05900 0.51200 0.46200 1.00000