#------------------------------------------------------------------------------ #$Date: 2016-04-06 13:31:37 +0300 (Wed, 06 Apr 2016) $ #$Revision: 181859 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/7/22/19/7221945.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_7221945 _cell_angle_alpha 90 _cell_angle_beta 109.7436(19) _cell_angle_gamma 90 _cell_length_a 7.65407(21) _cell_length_b 11.41403(28) _cell_length_c 11.39088(33) _cod_data_source_file Gd2WO43_Er0p03_Yb0p1.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, -z+1/2' '-x+1/2, -y+1/2, -z' '-x+1/2, y+1/2, -z+1/2' 'x, -y, z+1/2' 'x, y, z' 'x+1/2, -y+1/2, z+1/2' 'x+1/2, y+1/2, z' loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc 1 -1 -1 2.84 2.92 180.00000 1 1 0 1.08 1.10 0.00000 0 2 0 0.94 0.88 0.00000 0 0 2 8.10 8.05 0.00000 0 2 1 2.59 2.63 0.00000 1 -1 -2 11.44 11.67 180.00000 1 1 1 9.51 9.13 180.00000 0 2 2 2.42 2.08 0.00000 2 0 -2 0.95 0.87 0.00000 2 0 0 1.78 1.65 180.00000 1 -1 -3 16.93 17.22 0.00000 1 1 2 15.58 15.81 180.00000 1 -3 -1 0.09 0.09 180.00000 1 3 0 4.06 3.96 180.00000 2 -2 -1 160.18 160.50 180.00000 1 -3 -2 5.25 5.23 0.00000 1 3 1 13.37 13.60 180.00000 2 -2 -2 0.84 0.75 0.00000 2 2 0 0.64 0.57 180.00000 0 2 3 130.05 130.68 0.00000 0 4 0 55.99 57.26 180.00000 1 -1 -4 0.86 0.91 180.00000 1 1 3 0.01 0.01 180.00000 0 4 1 1.51 1.57 0.00000 2 -2 -3 9.34 8.89 180.00000 2 2 1 7.46 7.18 0.00000 0 0 4 1.09 1.01 0.00000 1 -3 -3 12.04 11.34 0.00000 1 3 2 10.89 10.10 0.00000 2 0 -4 39.98 39.87 0.00000 2 0 2 40.41 41.82 180.00000 0 4 2 5.55 5.84 180.00000 3 -1 -2 0.27 0.29 180.00000 3 -1 -1 0.71 0.75 180.00000 0 2 4 0.33 0.36 0.00000 2 -2 -4 0.07 0.07 0.00000 2 2 2 1.47 1.48 180.00000 3 -1 -3 11.73 8.86 0.00000 3 1 0 4.38 2.94 0.00000 2 -4 -1 0.08 0.08 0.00000 1 -3 -4 0.72 0.68 180.00000 1 3 3 3.30 3.27 180.00000 2 -4 -2 1.94 1.88 180.00000 2 4 0 3.44 3.29 0.00000 1 -1 -5 0.14 0.13 0.00000 0 4 3 13.03 12.26 0.00000 1 1 4 4.38 4.13 0.00000 1 -5 -1 6.06 5.65 0.00000 1 5 0 0.12 0.11 180.00000 3 -1 -4 10.00 10.47 0.00000 3 1 1 7.79 8.02 180.00000 3 -3 -2 4.18 4.33 0.00000 3 -3 -1 0.31 0.32 180.00000 2 -4 -3 5.12 5.29 180.00000 2 4 1 3.13 3.22 0.00000 1 -5 -2 4.77 5.16 0.00000 1 5 1 0.36 0.39 0.00000 2 -2 -5 1.16 1.28 180.00000 2 2 3 0.61 0.68 0.00000 3 -3 -3 3.05 2.96 0.00000 3 3 0 4.68 4.46 180.00000 0 2 5 12.27 10.82 0.00000 0 4 4 1.42 1.43 180.00000 1 -3 -5 2.92 2.93 180.00000 1 3 4 0.13 0.13 0.00000 1 -5 -3 9.84 9.92 180.00000 1 5 2 8.10 8.22 0.00000 3 -1 -5 0.05 0.05 0.00000 3 1 2 0.53 0.53 0.00000 2 -4 -4 103.09 101.70 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180.00000 2 6 0 2.65 2.74 0.00000 0 6 3 67.95 69.95 180.00000 3 -5 -3 1.66 1.64 180.00000 3 5 0 9.39 9.57 180.00000 2 -6 -3 5.37 5.56 0.00000 2 6 1 3.73 3.91 180.00000 4 -2 -5 82.83 85.14 180.00000 4 2 1 81.05 80.00 180.00000 1 -5 -5 0.82 0.75 0.00000 1 5 4 3.92 3.63 180.00000 1 -1 -7 0.73 0.71 180.00000 1 1 6 3.57 3.58 0.00000 1 -7 -1 0.29 0.28 180.00000 1 7 0 7.28 7.13 0.00000 4 -4 -2 86.46 86.77 0.00000 3 -3 -6 0.18 0.19 0.00000 3 3 3 1.11 1.16 0.00000 3 -5 -4 5.98 6.26 180.00000 3 5 1 9.86 10.62 0.00000 4 -4 -3 1.00 1.04 180.00000 4 -4 -1 1.59 1.65 0.00000 2 -4 -6 7.62 7.79 180.00000 2 4 4 7.95 8.17 0.00000 4 0 -6 1.83 1.80 180.00000 2 -2 -7 40.29 39.70 0.00000 1 -7 -2 0.17 0.16 0.00000 2 2 5 53.78 50.75 180.00000 1 7 1 4.45 4.18 0.00000 4 0 2 0.17 0.16 180.00000 0 6 4 0.06 0.06 0.00000 2 -6 -4 4.34 4.02 180.00000 2 6 2 5.04 4.65 0.00000 3 -1 -7 23.98 21.81 0.00000 3 1 4 24.45 22.04 0.00000 4 -4 -4 6.24 5.73 0.00000 4 4 0 3.31 3.09 0.00000 0 4 6 38.30 38.36 0.00000 5 -1 -3 1.04 1.04 0.00000 5 -1 -2 0.36 0.36 180.00000 4 -2 -6 0.00 0.00 0.00000 4 2 2 0.03 0.04 0.00000 1 -7 -3 7.13 7.41 180.00000 1 7 2 9.25 9.55 180.00000 3 -5 -5 3.22 3.10 0.00000 3 5 2 5.78 5.77 180.00000 1 -3 -7 4.48 4.47 180.00000 5 -1 -4 9.15 9.01 0.00000 1 3 6 0.00 0.00 0.00000 5 -1 -1 3.57 3.35 180.00000 0 2 7 9.93 9.52 0.00000 1 -5 -6 32.57 30.67 0.00000 1 5 5 15.24 13.81 0.00000 4 -4 -5 3.89 3.52 180.00000 4 4 1 4.18 3.77 180.00000 2 -6 -5 1.64 1.72 0.00000 2 6 3 0.89 0.92 180.00000 3 -3 -7 28.51 28.89 0.00000 3 3 4 23.22 22.15 180.00000 5 -1 -5 11.99 10.95 180.00000 5 1 0 7.17 6.25 0.00000 0 8 0 29.56 23.70 0.00000 0 6 5 4.43 3.86 180.00000 2 0 -8 3.29 2.88 0.00000 2 0 6 4.83 4.58 180.00000 5 -3 -3 0.08 0.08 180.00000 5 -3 -2 1.88 1.83 0.00000 1 -7 -4 6.75 6.25 0.00000 1 7 3 6.70 6.14 0.00000 0 8 1 3.26 2.98 180.00000 2 -4 -7 0.02 0.02 0.00000 2 4 5 0.06 0.06 180.00000 1 -1 -8 0.55 0.55 180.00000 1 1 7 0.53 0.53 0.00000 5 -3 -4 1.91 1.95 180.00000 5 -3 -1 10.32 11.08 180.00000 4 -2 -7 9.02 8.85 180.00000 3 -5 -6 3.50 3.35 0.00000 4 2 3 8.02 7.01 180.00000 3 5 3 1.16 1.01 180.00000 2 -2 -8 0.00 0.00 180.00000 2 2 6 0.00 0.00 180.00000 0 8 2 2.53 2.36 0.00000 3 -1 -8 2.60 2.66 180.00000 3 1 5 0.79 0.80 0.00000 3 -7 -2 5.76 5.96 180.00000 3 -7 -1 0.06 0.07 180.00000 4 -4 -6 1.30 1.25 0.00000 4 4 2 0.84 0.82 0.00000 5 -1 -6 0.75 0.75 0.00000 5 1 1 0.01 0.01 180.00000 0 4 7 0.54 0.53 0.00000 3 -7 -3 6.13 6.03 180.00000 4 -6 -2 4.49 4.35 0.00000 3 7 0 0.70 0.68 0.00000 5 -3 -5 7.69 7.45 180.00000 5 3 0 5.79 5.72 180.00000 0 0 8 2.09 2.14 180.00000 4 -6 -3 0.28 0.28 0.00000 4 -6 -1 1.00 1.01 180.00000 2 -8 -1 12.05 12.69 0.00000 2 -6 -6 8.89 9.69 180.00000 2 6 4 8.16 9.00 0.00000 2 -8 -2 0.34 0.33 0.00000 2 8 0 0.60 0.56 180.00000 1 -7 -5 2.47 2.26 0.00000 0 8 3 2.68 2.44 180.00000 1 7 4 0.17 0.16 0.00000 1 -3 -8 0.51 0.50 180.00000 1 3 7 0.52 0.51 180.00000 1 -5 -7 0.47 0.46 180.00000 1 5 6 5.88 5.91 180.00000 3 -7 -4 7.52 7.19 0.00000 4 -6 -4 8.63 8.22 0.00000 3 7 1 6.43 6.07 0.00000 4 6 0 8.40 7.92 0.00000 4 0 -8 19.85 18.71 0.00000 4 0 4 23.34 21.99 0.00000 0 2 8 1.04 0.98 180.00000 3 -3 -8 0.01 0.01 180.00000 0 6 6 0.62 0.60 0.00000 3 3 5 3.65 3.73 0.00000 2 -8 -3 13.37 13.70 0.00000 2 8 1 13.42 13.92 180.00000 5 -3 -6 0.37 0.40 0.00000 5 3 1 3.31 3.65 0.00000 3 -5 -7 15.80 15.49 180.00000 3 5 4 21.51 21.42 180.00000 5 -1 -7 0.33 0.33 0.00000 5 1 2 3.11 3.16 180.00000 4 -4 -7 5.19 5.29 180.00000 4 4 3 6.19 6.55 180.00000 4 -2 -8 0.66 0.71 0.00000 2 -4 -8 6.51 6.85 180.00000 2 4 6 3.99 4.19 0.00000 4 2 4 0.03 0.03 180.00000 5 -5 -3 3.33 3.48 180.00000 5 -5 -2 0.24 0.25 0.00000 6 0 -4 0.20 0.21 180.00000 6 0 -2 1.07 1.10 0.00000 4 -6 -5 43.20 44.95 0.00000 4 6 1 52.86 59.05 0.00000 0 8 4 0.25 0.27 0.00000 3 -7 -5 5.33 5.00 180.00000 3 7 2 4.67 4.15 180.00000 2 -8 -4 59.28 51.39 0.00000 5 -5 -4 3.45 2.98 180.00000 2 8 2 58.76 50.86 180.00000 5 -5 -1 0.42 0.37 0.00000 1 -9 -1 10.11 9.38 180.00000 1 9 0 0.40 0.37 180.00000 6 -2 -3 72.86 75.09 0.00000 3 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0.45 0.43 0.00000 0 10 5 0.60 0.57 0.00000 2 -8 -8 2.42 2.28 0.00000 2 8 6 1.36 1.33 180.00000 5 3 5 0.23 0.23 0.00000 5 5 4 3.95 3.98 0.00000 0 4 10 5.54 5.47 0.00000 1 -5 -10 1.89 1.87 180.00000 1 5 9 0.72 0.72 0.00000