#------------------------------------------------------------------------------ #$Date: 2024-12-07 18:21:01 +0200 (Sat, 07 Dec 2024) $ #$Revision: 296743 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/31/27/2312728.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2312728 _cell_angle_alpha 90.000 _cell_angle_beta 90.000 _cell_angle_gamma 90.000 _cell_length_a 6.0208 _cell_length_b 11.4884 _cell_length_c 8.3262 _exptl_crystal_F_000 776.00 _reflns_d_resolution_high 0.5887 _cod_data_source_file dk5132Ni3V2O8_2sup4.hkl _cod_data_source_block Ni3V2O8_2 _shelx_title InN-In2O3 _shelx_refln_list_code 6 _shelx_f_calc_maximum 160.95 loop_ _space_group_symop_operation_xyz '+x, +y, +z' '1/2+x, 1/2-y, -z' '1/2-x, +y, 1/2-z' '-x, 1/2-y, 1/2+z' '-x, -y, -z' '1/2-x, 1/2+y, +z' '1/2+x, -y, 1/2+z' '+x, 1/2+y, 1/2-z' '1/2+x, 1/2+y, +z' '1+x, 1-y, -z' '1-x, 1/2+y, 1/2-z' '1/2-x, 1-y, 1/2+z' '1/2-x, 1/2-y, -z' '1-x, 1+y, +z' '1+x, 1/2-y, 1/2+z' '1/2+x, 1+y, 1/2-z' loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_sigma _refln_F_calc _refln_phase_calc 1 1 1 0.00 41.68 0.50 180.0 1 3 1 30.79 43.17 160.95 0.0 1 5 1 19.77 48.38 137.96 0.0 1 7 1 0.05 73.90 2.04 0.0 1 1 3 36.31 41.68 121.17 0.0 1 3 3 22.06 43.17 12.32 0.0 1 5 3 12.78 48.38 10.91 0.0 1 7 3 4.56 73.90 79.84 0.0 1 1 5 30.50 43.17 114.62 0.0 1 3 5 7.65 45.25 7.52 -0.0 1 5 5 0.06 48.38 1.66 -0.0 1 7 5 0.97 128.00 83.07 0.0 1 1 7 0.07 43.17 0.93 0.0 1 3 7 24.81 45.25 60.71 0.0 1 5 7 14.72 52.26 58.73 0.0 1 1 9 7.05 45.25 7.24 180.0 1 3 9 19.17 48.38 66.42 0.0 1 5 9 7.13 64.00 61.38 0.0 1 1 11 14.09 52.26 25.78 0.0 1 3 11 0.06 57.24 0.72 180.0 1 1 13 6.84 64.00 37.93 0.0 1 3 13 0.78 90.51 6.47 180.0