#------------------------------------------------------------------------------ #$Date: 2015-09-28 16:57:22 +0300 (Mon, 28 Sep 2015) $ #$Revision: 158818 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/28/1532828.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1532828 loop_ _publ_author_name 'Xiao Dongrong' 'Wang Enbo' 'Wang Shutao' 'Hou Yuhou' 'Li Yangguang' 'Hu Changwen' 'Xu Lin' _publ_section_title ; Hydrothermal synthesis and crystal structure of a three-dimensional vanadium tellurite V4 Te4 O18 ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 159 _journal_page_last 164 _journal_volume 176 _journal_year 2003 _chemical_formula_sum 'O18 Te4 V4' _chemical_name_systematic 'V4 Te4 O18' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90 _cell_angle_beta 94.45 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 7.2475 _cell_length_b 9.4901 _cell_length_c 10.073 _cell_volume 690.727 _citation_journal_id_ASTM JSSCBI _cod_data_source_file XiaoDongrong_JSSCBI_2003_223.cif _cod_data_source_block O18Te4V4 _cod_original_cell_volume 690.7274 _cod_database_code 1532828 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y+1/2,-z+1/2 -x,-y,-z x,-y-1/2,z-1/2 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv V2 V+5 0.0012 0.2499 0.5376 1 0.0 Te2 Te+4 0.457 0.2794 0.5643 1 0.0 O1 O-2 -0.0585 0.1429 0.6968 1 0.0 V1 V+5 0.7118 0.0423 0.7419 1 0.0 O3 O-2 -0.09 -0.0591 0.8314 1 0.0 O4 O-2 0.2494 0.1947 0.629 1 0.0 O5 O-2 0.5982 0.2093 0.7254 1 0.0 Te1 Te+4 0.1382 0.0244 0.7857 1 0.0 O8 O-2 0.446 0.4611 0.6398 1 0.0 O2 O-2 0.1784 0.1537 0.9283 1 0.0 O9 O-2 0.6535 -0.0352 0.6058 1 0.0 O6 O-2 0.8058 0.3526 0.5372 1 0.0 O7 O-2 -0.0587 0.1301 0.4309 1 0.0