data_global _amcsd_formula_title 'Na6Cs2[Co6P6O24](OH)2*1.4H2O' loop_ _publ_author_name 'Bieniok A' 'Brendel U' 'Paulus E F' 'Amthauer G' _journal_name_full 'European Journal of Mineralogy' _journal_volume 17 _journal_year 2005 _journal_page_first 813 _journal_page_last 818 _publ_section_title ; Microporous cobalto- and zincophosphates with the framework-type of cancrinite Sample: CoPO4-CAN ; _database_code_amcsd 0007134 _chemical_compound_source 'Synthetic' _chemical_formula_sum 'Na3 Cs Co3 P3 O13.226 H1.226' _cell_length_a 12.8514 _cell_length_b 12.8514 _cell_length_c 5.0468 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 721.851 _exptl_crystal_density_diffrn 3.149 _symmetry_space_group_name_H-M 'P 63' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x-y,x,1/2+z' '-y,x-y,z' '-x,-y,1/2+z' '-x+y,-x,z' 'y,-x+y,1/2+z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Na 0.72990 0.86960 0.60450 1.00000 0.03070 Cs 0.66670 0.33330 0.12490 1.00000 0.03170 Co 0.64770 0.57930 0.62620 1.00000 0.01510 P 0.90350 0.58460 0.62560 1.00000 0.01310 O1 0.59160 0.14000 0.67560 1.00000 0.02630 O2 0.35680 0.02310 0.26570 1.00000 0.02240 O3 0.80820 0.61190 0.72880 1.00000 0.01920 O4 0.61310 0.69060 0.82650 1.00000 0.02480 O-H5a 0.00000 0.00000 0.83900 0.15500 0.00800 O-H5b 0.00000 0.00000 0.04900 0.08400 0.00800 O-H6a 0.10200 0.99500 0.85900 0.13300 0.00800 O-H6b 0.94500 0.06500 0.49500 0.19600 0.00800