data_global _amcsd_formula_title 'Cs8.35 H2 Mo13 O63 P10' loop_ _publ_author_name 'Hoareau T' 'Leclaire A' 'Borel M' 'Grandin A' 'Raveau B' _journal_name_full 'European Journal of Solid State and Inorganic Chemistry' _journal_volume 31 _journal_year 1994 _journal_page_first 727 _journal_page_last 737 _publ_section_title ; A zeolitic mixed valence molybdenum monophosphate with a tunnel structure: Cs8+x (Mo O4) Mo12 O18 (P O4)10 .(H2 O) _cod_database_code 1001630 ; _database_code_amcsd 0012591 _chemical_formula_sum 'Cs8.351 Mo13 P10 O63' _cell_length_a 16.67799 _cell_length_b 16.67799 _cell_length_c 12.717 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 3063.393 _exptl_crystal_density_diffrn 3.984 _symmetry_space_group_name_H-M 'P 63/m' loop_ _space_group_symop_operation_xyz 'x,y,z' '-x+y,-x,1/2-z' 'x-y,x,1/2+z' 'y,-x+y,-z' '-y,x-y,z' 'x,y,1/2-z' '-x,-y,1/2+z' 'x-y,x,-z' '-x+y,-x,z' '-y,x-y,1/2-z' 'y,-x+y,1/2+z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Cs1 0.13674 0.52219 0.05170 1.00000 Cs2 0.00000 0.00000 0.50000 0.79700 Cs3 0.04190 0.18290 0.25000 0.21400 Cs4 0.04680 0.18620 0.34800 0.15200 Mo1 0.29419 0.23782 0.35480 1.00000 Mo2 0.42730 0.12310 0.25000 1.00000 Mo3 0.26910 0.43840 0.25000 1.00000 Mo4 0.66667 0.33333 0.29450 0.50000 P1 0.38270 0.13080 0.49870 1.00000 P2 0.45740 0.42410 0.25000 1.00000 P3 0.33333 0.66667 0.21800 0.50000 O1 0.19070 0.14390 0.36400 1.00000 O2 0.35300 0.19400 0.25000 1.00000 O3 0.26000 0.30900 0.25000 1.00000 O4 0.26540 0.30060 0.47800 1.00000 O5 0.35110 0.19870 0.47500 1.00000 O6 0.42730 0.36280 0.34800 1.00000 O7 0.32700 0.02300 0.25000 1.00000 O8 0.44100 0.12800 0.40800 1.00000 O9 0.51500 0.07600 0.25000 1.00000 O10 0.55300 0.25900 0.25000 1.00000 O11 0.15500 0.39200 0.25000 1.00000 O12 0.28370 0.45010 0.40800 1.00000 O13 0.30500 0.57000 0.25000 1.00000 O14 0.41300 0.48700 0.25000 1.00000 O15 0.66667 0.33333 0.42100 0.50000 O16 0.33333 0.66667 0.40100 0.50000 O17 0.00000 0.00000 0.26800 0.50000