#------------------------------------------------------------------------------ #$Date: 2016-04-06 13:31:37 +0300 (Wed, 06 Apr 2016) $ #$Revision: 181859 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/7/22/46/7224684.hkl $ #------------------------------------------------------------------------------ # # 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_7224684 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 12.058912(96) _cell_length_b 12.058912(96) _cell_length_c 12.058912(96) _cod_data_source_file Y2.94Ce0.06MgAl3SiO12.fcf _cod_data_source_block a #BEGIN Tags that were not found in dictionaries: _shelx_f_squared_multiplier 1 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz '-x, -y, -z' '-x, -y+1/2, z' '-x, y, z+1/2' '-x, y+1/2, -z+1/2' '-x+1/4, -z+1/4, -y+1/4' '-x+1/4, -z-1/4, y-1/4' '-x+1/4, z+1/4, -y-1/4' '-x+1/4, z-1/4, y+1/4' '-x+1/2, -y, z+1/2' '-x+1/2, -y+1/2, -z+1/2' '-x+1/2, y, -z' '-x+1/2, y+1/2, z' '-x-1/4, -z+1/4, y+1/4' '-x-1/4, -z-1/4, -y-1/4' '-x-1/4, z+1/4, y-1/4' '-x-1/4, z-1/4, -y+1/4' '-y, -z, -x' '-y, -z+1/2, x' '-y, z, x+1/2' '-y, z+1/2, -x+1/2' '-y+1/4, -x+1/4, -z+1/4' '-y+1/4, -x-1/4, z-1/4' '-y+1/4, x+1/4, -z-1/4' '-y+1/4, x-1/4, z+1/4' '-y+1/2, -z, x+1/2' '-y+1/2, -z+1/2, -x+1/2' '-y+1/2, z, -x' '-y+1/2, z+1/2, x' '-y-1/4, -x+1/4, z+1/4' '-y-1/4, -x-1/4, -z-1/4' '-y-1/4, x+1/4, z-1/4' '-y-1/4, x-1/4, -z+1/4' '-z, -x, -y' '-z, -x+1/2, y' '-z, x, y+1/2' '-z, x+1/2, -y+1/2' '-z+1/4, -y+1/4, -x+1/4' '-z+1/4, -y-1/4, x-1/4' '-z+1/4, y+1/4, -x-1/4' '-z+1/4, y-1/4, x+1/4' '-z+1/2, -x, y+1/2' '-z+1/2, -x+1/2, -y+1/2' '-z+1/2, x, -y' '-z+1/2, x+1/2, y' '-z-1/4, -y+1/4, x+1/4' '-z-1/4, -y-1/4, -x-1/4' '-z-1/4, y+1/4, x-1/4' '-z-1/4, y-1/4, -x+1/4' 'z, -x, -y+1/2' 'z, -x+1/2, y+1/2' 'z, x, y' 'z, x+1/2, -y' 'z+1/4, -y+1/4, x-1/4' 'z+1/4, -y-1/4, -x+1/4' 'z+1/4, y+1/4, x+1/4' 'z+1/4, y-1/4, -x-1/4' 'z+1/2, -x, y' 'z+1/2, -x+1/2, -y' 'z+1/2, x, -y+1/2' 'z+1/2, x+1/2, y+1/2' 'z-1/4, -y+1/4, -x-1/4' 'z-1/4, -y-1/4, x+1/4' 'z-1/4, y+1/4, -x+1/4' 'z-1/4, y-1/4, x-1/4' 'y, -z, -x+1/2' 'y, -z+1/2, x+1/2' 'y, z, x' 'y, z+1/2, -x' 'y+1/4, -x+1/4, z-1/4' 'y+1/4, -x-1/4, -z+1/4' 'y+1/4, x+1/4, z+1/4' 'y+1/4, x-1/4, -z-1/4' 'y+1/2, -z, x' 'y+1/2, -z+1/2, -x' 'y+1/2, z, -x+1/2' 'y+1/2, z+1/2, x+1/2' 'y-1/4, -x+1/4, -z-1/4' 'y-1/4, -x-1/4, z+1/4' 'y-1/4, x+1/4, -z+1/4' 'y-1/4, x-1/4, z-1/4' 'x, -y, -z+1/2' 'x, -y+1/2, z+1/2' 'x, y, z' 'x, y+1/2, -z' 'x+1/4, -z+1/4, y-1/4' 'x+1/4, -z-1/4, -y+1/4' 'x+1/4, z+1/4, y+1/4' 'x+1/4, z-1/4, -y-1/4' 'x+1/2, -y, z' 'x+1/2, -y+1/2, -z' 'x+1/2, y, -z+1/2' 'x+1/2, y+1/2, z+1/2' 'x-1/4, -z+1/4, -y-1/4' 'x-1/4, -z-1/4, y+1/4' 'x-1/4, z+1/4, -y+1/4' 'x-1/4, z-1/4, y-1/4' loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc 2 1 1 11.03 11.01 180.00000 0 2 2 5.44 5.48 180.00000 3 2 1 16.96 16.88 0.00000 0 0 4 27.89 26.96 0.00000 0 4 2 147.29 146.93 180.00000 3 3 2 0.09 0.08 0.00000 4 2 2 37.64 38.07 0.00000 4 3 1 11.61 10.18 0.00000 5 2 1 51.79 49.54 180.00000 0 4 4 12.04 11.77 180.00000 5 3 2 43.70 42.43 0.00000 6 1 1 35.21 34.18 0.00000 0 6 2 1.04 1.07 180.00000 5 4 1 0.48 0.42 0.00000 6 3 1 9.30 9.34 0.00000 4 4 4 72.46 71.88 180.00000 5 4 3 0.36 0.34 180.00000 0 6 4 148.56 145.23 0.00000 5 5 2 14.14 13.74 180.00000 6 3 3 8.76 8.51 180.00000 7 2 1 14.97 14.55 0.00000 6 4 2 142.64 143.08 0.00000 6 5 1 14.87 14.72 0.00000 7 3 2 5.20 5.15 0.00000 0 0 8 59.47 58.85 0.00000 7 4 1 3.05 3.20 0.00000 0 8 2 1.29 1.21 0.00000 6 5 3 3.77 3.54 180.00000 8 2 2 3.47 3.33 180.00000 0 6 6 4.57 4.38 180.00000 7 4 3 1.27 1.27 180.00000 8 3 1 0.20 0.20 180.00000 7 5 2 4.87 4.96 180.00000 0 8 4 50.18 47.89 0.00000 8 4 2 156.70 153.10 180.00000 6 5 5 9.53 9.59 0.00000 7 6 1 1.69 1.70 180.00000 9 2 1 10.66 10.73 180.00000 6 6 4 42.43 40.93 0.00000 7 5 4 4.22 4.38 0.00000 8 5 1 3.31 3.43 0.00000 7 6 3 11.14 10.50 180.00000 9 3 2 15.26 14.38 0.00000 8 4 4 2.75 2.56 180.00000 8 5 3 6.41 6.92 180.00000 9 4 1 4.90 5.29 0.00000 0 8 6 0.07 0.06 180.00000 7 7 2 8.14 7.67 0.00000 10 1 1 1.11 1.05 180.00000 8 6 2 17.11 16.76 180.00000 0 10 2 19.14 18.75 180.00000 9 4 3 2.03 2.05 180.00000 7 6 5 19.86 18.73 180.00000 9 5 2 8.72 8.23 180.00000 10 3 1 9.19 8.67 180.00000 8 7 1 0.35 0.30 180.00000 8 6 4 118.39 115.01 0.00000 0 10 4 74.79 72.65 0.00000 9 6 1 11.60 10.85 0.00000 10 3 3 7.52 7.04 0.00000 10 4 2 75.34 74.55 0.00000 8 7 3 0.73 0.75 0.00000 9 5 4 0.06 0.06 180.00000 9 6 3 10.73 10.55 0.00000 10 5 1 13.43 13.21 180.00000 11 2 1 11.91 11.70 0.00000 0 8 8 95.69 88.49 0.00000 7 7 6 1.60 1.59 180.00000 10 5 3 10.09 10.01 0.00000 9 7 2 4.72 4.69 0.00000 11 3 2 8.12 8.05 0.00000 8 6 6 6.17 6.24 180.00000 0 10 6 9.59 9.70 180.00000 8 7 5 0.26 0.27 0.00000 11 4 1 1.37 1.42 180.00000 10 6 2 1.42 1.40 180.00000 9 6 5 9.83 9.78 0.00000 8 8 4 27.91 26.35 0.00000 0 0 12 4.39 4.15 0.00000 9 7 4 0.37 0.36 180.00000 9 8 1 1.97 1.91 0.00000 11 4 3 0.35 0.34 180.00000 0 12 2 55.62 52.78 180.00000 10 5 5 3.23 3.09 180.00000 10 7 1 13.97 13.37 180.00000 11 5 2 5.79 5.54 180.00000 10 6 4 48.55 47.73 0.00000 12 2 2 39.58 38.91 0.00000 9 8 3 0.20 0.20 180.00000 12 3 1 1.21 1.19 0.00000 10 7 3 9.04 8.96 0.00000 11 6 1 6.38 6.33 180.00000 0 12 4 2.37 2.15 180.00000 11 5 4 0.00 0.00 180.00000 0 10 8 0.10 0.09 180.00000 12 4 2 0.01 0.01 0.00000 9 7 6 16.10 16.08 180.00000 9 9 2 7.04 7.03 180.00000 11 6 3 18.88 18.87 180.00000 10 8 2 6.04 5.91 180.00000 9 8 5 0.71 0.69 180.00000 12 5 1 0.03 0.03 0.00000 10 7 5 4.69 5.05 180.00000 11 7 2 9.84 10.59 0.00000 13 2 1 2.52 2.71 180.00000 12 4 4 65.93 64.13 180.00000 12 5 3 0.96 0.94 0.00000 10 8 4 102.80 102.41 180.00000 0 12 6 37.51 37.37 180.00000 11 6 5 7.84 7.60 180.00000 10 9 1 7.59 7.36 180.00000 13 3 2 9.52 9.22 0.00000 12 6 2 32.62 31.91 0.00000