data_I loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_meas _refln_F_sigma _refln_F_calc _refln_observed_status 1 0 1 7.46 0.19 7.28 o 0 1 1 68.68 0.83 68.88 o 0 0 2 66.08 0.80 66.18 o 1 1 1 156.13 1.88 153.91 o 1 0 2 163.89 1.97 158.71 o 2 0 0 152.46 1.84 147.80 o 1 1 2 20.44 0.28 19.87 o 2 0 1 51.01 0.62 48.33 o 0 2 0 163.93 1.98 166.92 o 2 1 0 50.16 0.62 49.48 o 1 0 3 40.06 0.49 38.23 o 2 1 1 97.81 1.18 98.88 o 0 1 3 165.09 1.99 164.56 o 2 0 2 97.91 1.18 97.18 o 1 2 1 24.93 0.32 24.26 o 1 1 3 9.52 0.21 7.41 o 0 2 2 110.00 1.33 108.02 o 2 1 2 7.97 0.20 8.03 o 0 0 4 92.92 1.13 92.71 o 1 2 2 169.34 2.04 166.85 o 2 0 3 10.56 0.24 10.41 o 1 0 4 165.07 1.99 163.28 o 2 2 0 160.55 1.93 165.09 o 3 0 1 14.52 0.24 14.48 o 2 2 1 19.28 0.27 19.39 o 2 1 3 158.91 1.91 158.41 o 1 1 4 20.80 0.29 20.51 o 3 1 1 146.14 1.76 145.07 o 1 2 3 26.55 0.35 26.03 o 3 0 2 148.00 1.78 145.11 o 2 2 2 65.56 0.80 65.91 o 2 0 4 77.07 0.93 76.90 o 3 1 2 19.22 0.28 19.37 o 0 3 1 69.49 0.85 70.92 o 0 2 4 66.18 0.82 66.07 o 1 3 1 114.08 1.37 116.17 o 2 1 4 4.63 0.29 4.50 o 1 0 5 19.87 0.30 19.16 o 0 1 5 52.63 0.66 52.17 o 1 2 4 115.46 1.39 115.26 o 3 2 1 12.46 0.26 12.01 o 3 1 3 3.35 0.52 1.06 o 1 3 2 21.60 0.30 21.35 o 1 1 5 119.08 1.44 120.06 o 2 3 0 21.64 0.34 21.99 o 4 0 0 108.74 1.32 109.71 o 3 2 2 87.01 1.05 89.21 o 2 3 1 70.36 0.85 71.56 o 0 3 3 128.71 1.56 130.39 o 4 0 1 40.85 0.51 40.22 o 2 0 5 6.65 0.24 6.20 o 3 0 4 81.56 0.99 81.31 o 4 1 0 7.60 0.26 7.10 o 2 2 4 75.33 0.91 76.28 o 4 1 1 76.17 0.92 76.05 o 2 3 2 10.97 0.26 11.72 o 2 1 5 68.93 0.84 68.26 o 4 0 2 70.97 0.86 70.26 o 0 0 6 127.93 1.55 129.06 o 3 1 4 18.27 0.29 18.09 o 1 2 5 14.85 0.28 15.16 o 1 0 6 6.87 0.25 6.33 o 4 1 2 13.93 0.26 13.67 o 2 3 3 124.69 1.50 130.53 o 1 1 6 4.97 0.31 4.88 o 4 0 3 19.82 0.30 20.29 o 1 3 4 5.53 0.28 5.71 o 0 4 0 164.34 2.00 165.62 o 4 2 0 125.18 1.52 126.88 o 3 3 1 119.60 1.44 122.19 o 3 0 5 11.80 0.29 11.44 o 4 2 1 4.88 0.30 3.96 o 4 1 3 129.94 1.57 129.77 o 2 2 5 19.16 0.30 19.60 o 2 0 6 126.93 1.53 128.38 o 3 2 4 116.73 1.41 117.82 o 1 4 1 5.07 0.28 4.22 o 3 3 2 15.92 0.29 16.13 o 3 1 5 114.86 1.39 115.93 o 0 4 2 50.53 0.64 49.28 o 4 2 2 50.75 0.63 50.93 o 0 2 6 156.85 1.90 157.47 o 2 1 6 22.47 0.34 22.45 o 4 0 4 60.67 0.74 61.63 o 1 4 2 105.14 1.27 104.24 o 1 2 6 5.37 0.34 1.98 o 0 3 5 40.60 0.54 39.80 o 2 4 0 106.17 1.29 105.97 o 4 1 4 12.73 0.29 12.99 o 3 3 3 8.47 0.23 8.51 o 5 0 1 23.22 0.33 23.40 o 1 3 5 106.27 1.29 106.25 o 2 4 1 18.20 0.30 17.87 o 1 0 7 6.76 0.27 7.36 o 4 2 3 23.69 0.34 24.32 o 0 1 7 59.56 0.75 61.43 o 1 4 3 14.60 0.30 15.08 o 5 1 1 98.65 1.19 99.12 o 3 2 5 12.65 0.29 12.39 o 5 0 2 96.10 1.16 96.00 o 1 1 7 91.59 1.11 91.94 o 2 4 2 63.03 0.77 63.05 o 3 0 6 4.35 0.48 4.09 o 2 2 6 102.94 1.25 103.25 o 4 3 0 14.20 0.38 14.21 o 5 1 2 15.05 0.28 15.16 o 4 3 1 59.51 0.73 60.37 o 2 3 5 61.04 0.75 60.65 o 4 0 5 9.23 0.23 9.12 o 2 0 7 15.63 0.31 15.83 o 3 3 4 14.19 0.30 14.66 o 0 4 4 62.69 0.79 61.50 o 4 2 4 61.84 0.76 62.72 o 5 0 3 15.85 0.29 15.76 o 2 4 3 9.13 0.24 9.24 o 4 3 2 8.64 0.24 8.30 o 4 1 5 59.14 0.73 59.14 o 2 1 7 62.37 0.77 63.26 o 1 4 4 110.14 1.33 108.07 o 3 4 1 10.89 0.28 10.99 o 5 2 1 34.92 0.45 34.79 o 5 1 3 3.04 0.63 2.61 o 1 3 6 6.57 0.27 6.58 o 3 4 2 99.97 1.21 100.85 o 5 2 2 98.72 1.20 100.38 o 0 0 8 66.59 0.84 66.49 o 4 3 3 106.50 1.29 112.54 o 3 2 6 15.74 0.32 15.92 o 5 0 4 96.28 1.17 96.83 o 2 4 4 57.71 0.71 56.99 o 1 0 8 103.49 1.25 104.93 o 3 3 5 93.53 1.14 94.36 o 0 5 1 39.19 0.53 38.26 o 3 0 7 9.77 0.25 9.97 o 4 2 5 25.18 0.36 25.63 o 2 2 7 13.60 0.32 13.33 o 2 3 6 24.60 0.36 24.51 o 4 0 6 104.78 1.27 106.16 o 5 1 4 12.17 0.28 12.03 o 1 5 1 90.13 1.10 90.51 o 1 1 8 10.05 0.25 10.43 o 1 4 5 7.87 0.26 7.84 o 5 2 3 12.86 0.31 12.56 o 3 1 7 98.20 1.19 98.78 o 4 1 6 10.52 0.27 10.51 o 4 3 4 12.17 0.31 13.00 o 6 0 0 128.07 1.56 127.94 o 1 5 2 3.80 0.57 3.41 o 2 0 8 41.15 0.53 40.80 o 6 0 1 10.31 0.46 16.05 o 0 3 7 46.73 0.62 46.81 o 2 5 0 27.19 0.43 27.35 o 4 4 0 83.96 1.04 87.23 o 6 1 0 22.24 0.39 22.91 o 5 3 1 85.27 1.04 85.79 o 2 5 1 59.50 0.74 59.44 o 0 5 3 102.20 1.25 103.32 o 5 0 5 32.23 0.43 31.96 o 4 4 1 24.67 0.36 25.18 o 0 2 8 36.92 0.52 36.55 o 1 3 7 82.06 1.00 81.32 o 2 1 8 8.07 0.27 8.41 o 6 1 1 41.01 0.52 41.33 o 6 0 2 38.62 0.50 38.77 o 3 4 4 69.69 0.86 68.79 o 5 2 4 79.52 0.97 79.60 o 1 5 3 6.76 0.30 6.67 o 1 2 8 89.76 1.09 90.89 o 5 3 2 9.15 0.25 9.39 o 5 1 5 87.68 1.07 87.87 o 3 2 7 9.21 0.25 9.51 o 4 4 2 52.31 0.65 52.37 o 6 1 2 10.96 0.27 10.63 o 0 4 6 102.60 1.26 100.14 o 4 2 6 84.54 1.03 85.49 o 1 4 6 3.97 0.59 4.29 o 4 3 5 52.89 0.66 53.98 o 6 0 3 28.71 0.40 28.52 o 2 3 7 58.55 0.73 58.78 o 6 2 0 93.33 1.15 94.04 o 3 0 8 74.45 0.91 74.99 o 2 5 3 95.81 1.16 97.60 o 2 2 8 49.48 0.62 49.43 o 4 4 3 14.73 0.33 14.90 o 6 2 1 12.35 0.30 12.41 o 6 1 3 95.37 1.16 94.88 o 1 0 9 9.00 0.26 8.81 o 4 1 7 53.87 0.67 54.10 o 1 5 4 13.40 0.32 14.05 o 0 1 9 94.77 1.17 94.71 o 3 5 1 86.02 1.05 86.27 o 3 1 8 12.35 0.32 11.47 o 3 4 5 9.01 0.26 9.24 o 5 2 5 11.87 0.29 12.30 o 5 0 6 5.80 0.34 5.24 o 1 1 9 7.82 0.28 6.72 o 6 2 2 51.70 0.65 51.62 o 2 4 6 98.41 1.20 97.50 o 3 5 2 11.68 0.30 11.54 o 6 0 4 49.05 0.62 49.19 o 5 1 6 3.81 0.57 3.62 o 5 3 4 15.66 0.33 16.34 o 2 5 4 3.64 0.68 3.23 o 4 4 4 47.47 0.60 48.53 o 1 3 8 6.51 0.32 6.66 o 6 1 4 11.80 0.31 11.23 o 3 3 7 86.56 1.06 86.96 o 0 5 5 39.68 0.56 39.95 o 6 2 3 27.57 0.39 27.38 o 4 2 7 21.98 0.36 22.08 o 4 3 6 6.12 0.33 5.38 o 2 1 9 94.06 1.15 93.88 o 3 5 3 6.65 0.41 5.03 o 5 4 1 18.01 0.34 18.24 o 3 2 8 83.78 1.02 83.52 o 1 5 5 74.66 0.92 78.29 o 1 4 7 3.65 0.69 4.45 o 1 2 9 9.12 0.27 9.46 o 0 6 0 95.02 1.20 92.75 o 6 3 0 21.10 0.43 21.24 o 5 4 2 75.10 0.92 75.86 o 3 4 6 6.39 0.33 3.99 o 4 0 8 33.02 0.45 32.22 o 6 3 1 41.89 0.54 41.74 o 6 0 5 12.70 0.31 13.00 o 1 6 1 5.85 0.37 4.94 o 6 2 4 40.32 0.52 40.41 o 7 0 1 24.71 0.37 24.66 o 5 3 5 76.76 0.94 80.07 o 4 5 1 52.65 0.66 52.77 o 0 6 2 51.01 0.68 49.26 o 2 5 5 42.18 0.55 43.83 o 4 1 8 6.42 0.35 6.63 o 5 0 7 25.24 0.38 25.22 o 4 4 5 8.71 0.27 8.15 o 6 3 2 9.39 0.26 9.24 o 2 4 7 10.37 0.25 9.91 o 6 1 5 34.29 0.46 33.56 o 3 5 4 11.37 0.30 11.85 o 2 2 9 8.63 0.46 11.41 o 0 0 10 47.32 0.64 47.62 o 1 6 2 87.59 1.07 85.27 o 5 4 3 9.65 0.26 9.80 o 7 1 1 70.38 0.87 69.49 o 7 0 2 73.77 0.91 73.66 o 4 5 2 12.41 0.32 12.69 o 5 1 7 72.22 0.89 71.45 o 3 1 9 6.47 0.34 6.15 o 2 6 0 91.47 1.13 89.06 o 1 0 10 70.93 0.88 69.73 o 2 6 1 5.14 0.54 5.42 o 7 1 2 24.77 0.38 24.29 o 6 3 3 82.96 1.02 84.10 o 4 3 7 51.49 0.65 51.30 o 0 3 9 87.60 1.09 88.19 o 1 1 10 5.15 0.43 4.90 o 1 6 3 8.36 0.30 7.99 o 3 3 8 10.60 0.27 10.10 o 0 4 8 50.74 0.68 49.58 o 7 0 3 8.26 0.27 7.76 o 4 5 3 85.30 1.04 87.08 o 2 6 2 42.27 0.55 40.77 o 4 2 8 42.53 0.56 41.38 o 1 3 9 6.67 0.35 8.04 o 6 2 5 14.29 0.34 13.79 o 6 0 6 83.11 1.02 82.33 o 5 4 4 72.71 0.90 75.78 o 1 4 8 83.53 1.02 82.45 o 2 0 10 49.72 0.63 49.37 o 3 5 5 76.93 0.95 82.38 o 7 2 1 15.98 0.35 16.09 o 7 1 3 5.02 0.41 3.30 o 3 4 7 8.14 0.30 8.15 o 5 2 7 22.58 0.37 22.33 o 5 3 6 5.07 0.41 4.99 o 2 5 6 10.14 0.28 10.24 o 3 2 9 3.22 0.67 1.60 o 4 4 6 83.87 1.03 83.86 o 6 1 6 19.54 0.36 19.56 o 0 6 4 40.86 0.59 39.57 o 0 2 10 42.35 0.60 42.61 o 6 3 4 10.09 0.27 10.22 o 2 6 3 4.59 0.60 4.61 o 7 2 2 80.82 0.99 79.62 o 1 6 4 72.00 0.89 69.65 o 2 3 9 82.75 1.02 82.78 o 1 2 10 77.49 0.95 77.11 o 4 0 9 19.26 0.37 19.42 o 7 0 4 80.13 0.98 78.36 o 3 6 1 8.12 0.31 7.97 o 4 5 4 8.36 0.30 8.54 o 6 4 0 97.96 1.21 99.55 o 5 0 8 76.43 0.94 77.32 o 2 4 8 35.31 0.48 33.63 o 6 4 1 12.73 0.32 12.47 o 0 5 7 44.40 0.62 47.58 o 4 1 9 84.19 1.03 83.97 o 7 1 4 24.10 0.38 23.13 o 5 5 1 70.67 0.87 70.45 o 3 6 2 61.97 0.78 60.51 o 5 1 8 10.53 0.28 10.27 o 5 4 5 23.48 0.38 23.83 o 7 2 3 8.30 0.28 8.08 o 1 5 7 62.65 0.78 65.33 o 6 4 2 33.50 0.47 31.71 o 6 2 6 96.56 1.18 96.44 o 3 0 10 74.79 0.92 74.53 o 2 6 4 45.78 0.60 45.59 o 2 2 10 47.81 0.62 47.95 o 5 5 2 14.61 0.36 14.84 o 4 3 8 9.64 0.28 9.55 o 6 3 5 26.65 0.40 27.49 o 6 0 7 9.44 0.28 8.99 o 3 1 10 10.45 0.27 10.40 o 1 6 5 7.98 0.33 6.93 o 7 3 1 62.76 0.78 61.61 o 7 0 5 15.00 0.36 14.62 o 5 3 7 63.82 0.80 64.48 o 4 5 5 38.32 0.52 39.68 o 6 4 3 22.46 0.38 22.70 o 2 5 7 41.39 0.55 42.80 o 3 3 9 3.52 0.79 1.97 o 4 4 7 3.99 0.67 2.68 o 6 1 7 39.65 0.53 39.49 o 1 0 11 12.27 0.33 11.92 o 4 2 9 10.16 0.29 9.55 o 7 2 4 63.90 0.80 63.27 o 3 4 8 61.21 0.77 61.39 o 0 1 11 26.95 0.48 25.84 o 5 5 3 4.96 0.56 3.59 o 5 2 8 69.27 0.86 69.27 o 7 3 2 24.85 0.39 24.54 o 7 1 5 65.54 0.82 64.51 o 1 4 9 7.29 0.34 6.36 o 1 3 10 8.14 0.31 8.12 o 1 1 11 72.22 0.89 72.16 o 4 6 0 79.86 1.01 77.22 o 8 0 0 70.41 0.90 69.45 o 4 6 1 5.54 0.44 5.45 o 2 6 5 8.05 0.34 8.14 o 5 4 6 4.53 0.51 3.98 o 3 6 4 68.78 0.86 70.65 o 3 2 10 52.76 0.67 51.82 o 2 0 11 7.37 0.34 6.79 o 6 4 4 38.30 0.52 39.37 o 0 7 1 42.03 0.61 40.70 o 8 1 0 35.32 0.53 34.97 o 4 6 2 35.13 0.49 34.24 o 0 6 6 95.72 1.19 92.85 o 8 1 1 39.68 0.53 39.24 o 5 0 9 5.36 0.58 6.15 o 8 0 2 40.81 0.54 40.04 o 6 2 7 11.02 0.29 10.63 o 6 3 6 16.39 0.37 17.34 o 5 5 4 6.26 0.39 5.97 o 1 7 1 65.26 0.82 62.36 o 1 5 8 9.20 0.31 8.83 o 2 1 11 36.91 0.50 35.98 o 4 0 10 44.17 0.58 44.07 o 3 5 7 66.66 0.83 70.37 o 7 2 5 24.71 0.40 24.53 o 7 0 6 4.76 0.48 3.14 o 4 5 6 10.48 0.30 11.23 o 5 1 9 4.15 0.67 3.54 o 8 1 2 12.17 0.31 11.69 o 1 2 11 3.88 0.73 4.03 o 1 7 2 11.84 0.29 11.29 o 4 1 10 8.91 0.31 8.99 o 4 6 3 14.00 0.35 13.65 o