data_global _amcsd_formula_title 'Cs K Mo2 O11 P2' loop_ _publ_author_name 'Guesdon A' 'Leclaire A' 'Borel M' 'Raveau B' _journal_name_full 'European Journal of Solid State and Inorganic Chemistry' _journal_volume 33 _journal_year 1996 _journal_page_first 385 _journal_page_last 396 _publ_section_title ; Highly ordered distribution of the interpolated univalent cations in monophosphates with the alpha-(K2 Mo2 O3 (P O4)2) structure _cod_database_code 1001727 ; _database_code_amcsd 0012602 _chemical_formula_sum 'Mo4 P4 K2 Cs2 O22' _cell_length_a 10.121 _cell_length_b 10.154 _cell_length_c 9.820 _cell_angle_alpha 90 _cell_angle_beta 100.59 _cell_angle_gamma 90 _cell_volume 991.999 _exptl_crystal_density_diffrn 4.030 _symmetry_space_group_name_H-M 'P 1 21/c 1' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x,1/2-y,1/2+z' '-x,1/2+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 Mo1 0.34300 0.07295 0.13259 1.00000 Mo2 0.08681 0.31723 0.13985 1.00000 P1 0.40470 0.35870 0.32560 1.00000 P2 0.12440 0.06040 0.34840 1.00000 K1 0.00000 0.00000 0.00000 1.00000 Cs1 0.75072 0.19316 0.25759 1.00000 K2 0.50010 0.03010 0.49770 0.50000 O1 0.27630 -0.06120 0.04480 1.00000 O2 0.44080 0.14760 -0.01450 1.00000 O3 0.26240 0.02610 0.31140 1.00000 O4 0.51370 -0.02920 0.22630 1.00000 O5 0.19980 0.18950 0.08720 1.00000 O6 0.44330 0.22630 0.26690 1.00000 O7 -0.06040 0.26200 0.04660 1.00000 O8 -0.01690 0.46420 0.22710 1.00000 O9 0.14000 0.45400 0.00660 1.00000 O10 0.07620 0.20140 0.30790 1.00000 O11 0.25760 0.39170 0.27790 1.00000