data_global _amcsd_formula_title 'Zn3V4(PO4)6' loop_ _publ_author_name 'Boudin S' 'Grandin A' 'Leclaire A' 'Borel M' 'Raveau B' _journal_name_full 'Journal of Solid State Chemistry' _journal_volume 115 _journal_year 1995 _journal_page_first 140 _journal_page_last 145 _publ_section_title ; The original structure of Zn3V4(PO4)6 involving bioctahedral V2O10 units and ZnO5 trigonal bipyramids _cod_database_code 1001646 ; _database_code_amcsd 0013841 _chemical_formula_sum 'Zn3 V4 P6 O24' _cell_length_a 6.349 _cell_length_b 7.869 _cell_length_c 9.324 _cell_angle_alpha 105.32 _cell_angle_beta 108.66 _cell_angle_gamma 101.23 _cell_volume 405.291 _exptl_crystal_density_diffrn 3.973 _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 0.28550 0.81462 0.29056 V1 0.38900 0.46100 0.11579 V2 0.95480 0.28460 0.47813 P1 0.91280 0.40950 0.16630 P2 0.39540 0.23120 0.36830 P3 0.22620 0.14230 0.76880 O1 0.69090 0.45810 0.08200 O2 0.54390 0.73720 0.22720 O3 0.12380 0.54040 0.16240 O4 0.45140 0.36860 0.28770 O5 0.22570 0.19620 -0.05830 O6 0.01590 0.18110 0.65790 O7 0.24640 0.27860 0.46230 O8 0.93760 0.45660 0.34550 O9 0.62970 0.23200 0.49240 O10 0.78680 0.05750 0.29240 O11 0.89480 0.21270 0.08570 O12 0.27070 0.03710 0.23360