data_I loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_sigma _refln_F_squared_calc _refln_observed_status 1 0 0 11808.80 633.37 12863.01 o 0 0 -4 5499.03 280.16 5372.36 o 0 1 1 222.40 20.77 215.57 o 1 0 -2 4365.99 224.94 4281.22 o 0 1 -2 23049.15 1064.44 20142.03 o 1 0 2 25896.85 1422.77 29397.74 o 0 1 3 786.88 51.74 816.62 o 1 0 -4 1900.66 98.46 1636.47 o 1 1 0 21557.90 1086.50 21503.81 o 1 1 -1 4677.63 232.13 4283.85 o 0 1 4 1123.79 65.05 988.65 o 1 1 1 2267.78 121.17 2101.57 o 1 1 -2 5724.00 281.04 5219.52 o 1 0 4 788.34 63.27 1012.68 o 0 0 -6 2758.74 146.67 2544.08 o 1 1 2 13399.62 637.10 12043.30 o 1 1 -3 724.82 48.77 633.87 o 0 1 5 3043.06 161.51 2902.79 o 1 1 3 70.01 11.18 50.83 o 1 1 -4 107.58 12.32 61.17 o 1 0 -6 21857.96 1018.13 19157.74 o 1 1 4 62.94 12.32 105.25 o 0 1 6 19203.46 914.97 17368.58 o 1 1 -5 374.96 39.75 359.84 o 1 0 6 14245.06 826.30 17032.64 o 1 1 5 3122.68 183.88 3375.79 o 2 0 0 78952.59 3974.21 79228.66 o 2 0 -2 11878.79 601.90 11557.55 o 1 1 -6 7171.47 351.69 6435.65 o 0 2 0 58898.31 2786.48 53545.31 o 0 2 -1 10274.28 504.73 9394.38 o 0 0 -8 31586.37 1479.50 27996.52 o 0 1 7 731.59 53.22 596.36 o 0 2 2 21869.51 1032.61 19430.78 o 2 0 2 6279.88 323.33 5970.26 o 2 0 -4 160.75 15.85 177.64 o 0 2 3 9835.54 481.98 8899.21 o 1 1 6 43.09 11.29 5.76 o 1 0 -8 3133.13 165.40 2768.97 o 1 1 -7 -25.11 26.22 7.60 o 2 1 -1 851.74 60.15 835.38 o 2 1 0 8012.46 422.83 8176.32 o 2 1 -2 5721.42 302.56 5681.27 o 1 2 0 15941.49 790.95 15125.23 o 1 2 -1 7186.79 370.31 6890.30 o 0 2 4 4210.22 222.63 3937.17 o 2 1 1 9974.54 491.04 9198.88 o 1 2 1 6977.65 336.02 5894.50 o 0 1 8 791.59 64.85 878.87 o 1 2 -2 1319.29 87.71 1191.22 o 2 1 -3 1179.51 83.91 1290.47 o 2 0 4 5471.12 306.16 5733.19 o 1 2 2 8747.86 451.38 8450.71 o 2 1 2 52.03 12.65 32.81 o 1 2 -3 482.03 46.79 519.96 o 1 1 7 613.20 52.49 554.13 o 1 0 8 1824.76 118.08 1811.43 o 2 1 -4 9087.89 476.62 9158.81 o 2 0 -6 2688.67 147.16 2396.81 o 0 2 5 70.59 13.77 60.71 o 1 1 -8 66.69 12.20 65.50 o 1 2 3 333.52 30.83 288.22 o 2 1 3 16086.96 798.21 15314.36 o 1 2 -4 133.26 16.00 187.32 o 2 1 -5 738.89 58.94 664.19 o 0 1 9 877.97 67.75 831.63 o 1 2 4 3199.28 182.91 3217.57 o 0 2 6 2205.08 124.24 1911.85 o 1 2 -5 266.88 27.87 250.99 o 2 1 4 3053.89 187.43 3409.47 o 0 0 -10 2847.68 159.67 2600.12 o 1 1 8 54.88 12.41 29.76 o 2 1 -6 410.62 36.31 499.37 o 1 1 -9 107.11 14.35 96.28 o 2 0 6 31.65 24.74 34.77 o 1 2 5 30.64 12.04 7.55 o 1 0 -10 14914.72 708.65 13056.23 o 1 2 -6 2189.11 128.49 2079.22 o 2 1 5 318.36 31.75 351.67 o 0 2 7 773.76 59.95 666.08 o 2 0 -8 13303.51 639.20 11794.24 o 2 1 -7 33.85 25.39 0.95 o 0 1 -10 11826.77 566.58 10322.14 o 1 2 6 6203.13 336.91 6292.33 o 1 1 9 2182.39 142.09 2282.75 o 1 2 -7 304.63 30.66 247.75 o 2 1 6 2937.96 187.86 3402.50 o 2 2 -1 1083.97 81.25 1173.36 o 1 1 -10 17834.16 861.44 16159.27 o 2 2 0 1387.42 93.96 1466.08 o 1 0 10 6128.08 377.62 7252.73 o 2 2 -2 3719.65 227.66 4287.30 o 2 2 1 545.59 52.62 441.36 o 0 2 8 5854.44 307.35 5528.15 o 2 1 -8 5018.73 280.33 5164.65 o 2 2 -3 95.34 13.32 93.16 o 2 2 2 4515.08 255.84 4625.63 o 1 2 7 2074.00 130.97 2025.21 o 2 2 -4 631.26 55.55 705.24 o 1 2 -8 430.42 49.03 489.57 o 3 0 -2 4392.98 243.75 4239.99 o 3 0 0 130.29 16.55 192.28 o 0 1 11 1967.75 130.85 1906.81 o 2 1 7 10.76 25.78 0.47 o 2 2 3 2210.34 130.36 1990.91 o 2 0 8 4050.30 264.37 4929.12 o 1 1 10 946.41 79.18 869.59 o 2 2 -5 92.21 14.28 123.55 o 0 3 1 894.07 71.58 764.87 o 2 1 -9 562.71 53.19 541.04 o 3 0 -4 37.31 29.21 28.52 o 1 1 -11 27.17 21.08 13.42 o 0 2 9 403.50 35.30 361.76 o 0 0 -12 15683.05 766.75 14238.29 o 0 3 2 4343.22 244.36 4196.46 o 2 0 -10 30807.28 1423.02 26439.51 o 3 0 2 3064.66 168.11 2763.06 o 2 2 4 2703.06 158.27 2607.46 o 1 2 8 571.04 56.12 549.89 o 2 2 -6 880.29 71.06 911.54 o 0 3 3 1613.81 107.11 1403.61 o 1 0 -12 11618.14 567.79 10336.96 o 3 1 -1 1726.46 112.99 1744.91 o 1 2 -9 711.61 65.79 675.71 o 3 1 -2 386.89 37.73 512.71 o 3 1 0 2244.80 146.18 2552.83 o 2 1 8 1445.25 109.55 1679.42 o 3 1 -3 918.13 79.02 1013.91 o 1 3 0 8472.99 447.20 8259.87 o 3 1 1 1254.21 86.05 1202.48 o 1 3 -1 5057.45 276.68 4798.81 o 2 2 5 528.23 53.01 514.16 o 0 3 4 20.88 35.52 51.43 o 1 3 1 110.96 17.93 99.16 o 1 3 -2 4223.26 242.16 4219.15 o 3 0 -6 493.34 51.38 491.61 o 3 1 -4 7.74 31.56 58.24 o 0 1 12 1054.69 83.97 1109.30 o 2 1 -10 5827.11 302.72 5237.24 o 1 1 11 452.13 45.26 506.58 o 2 2 -7 468.15 50.15 418.06 o 3 1 2 27726.39 1373.82 26551.73 o 1 3 2 4446.51 241.76 4010.70 o 1 3 -3 156.45 18.50 129.80 o 3 0 4 1719.29 121.84 1881.24 o 0 2 10 44.33 13.75 25.46 o 3 1 -5 574.34 52.84 505.04 o 1 1 -12 3684.77 204.42 3394.74 o 0 3 5 1139.95 85.86 977.57 o 1 2 9 1450.42 100.23 1364.03 o 1 3 3 582.76 57.60 445.52 o 1 3 -4 615.20 66.81 754.27 o 3 1 3 5.80 35.51 0.60 o 2 2 6 2526.63 157.98 2595.28 o 1 0 12 5727.98 330.60 5782.67 o 1 2 -10 9340.22 484.30 8860.08 o 2 1 9 30.14 31.00 11.06 o 3 1 -6 3629.27 217.50 3842.18 o 2 2 -8 1105.53 77.35 880.99 o 1 3 4 3705.81 219.70 3800.54 o 0 3 6 1939.91 130.70 2043.96 o 1 3 -5 116.69 17.25 107.07 o 2 0 10 -24.16 31.14 8.69 o 3 1 4 1646.24 107.51 1500.24 o 2 1 -11 3064.43 170.65 2630.60 o 3 0 -8 1031.10 83.52 1163.04 o 0 2 11 430.76 38.31 371.61 o 2 2 7 131.04 16.87 106.19 o 3 1 -7 302.81 27.48 283.52 o 1 1 12 452.54 39.86 298.13 o 0 1 13 436.29 42.49 390.95 o 1 3 5 468.65 43.51 491.87 o 2 0 -12 655.81 64.20 644.29 o 1 2 10 13298.65 679.67 12720.08 o 1 3 -6 4743.82 262.19 4495.63 o 3 0 6 3546.94 222.99 3814.01 o 1 1 -13 239.45 25.44 195.36 o 3 1 5 267.03 27.80 276.92 o 0 3 7 768.50 66.95 647.05 o 2 2 -9 179.76 20.91 214.23 o 1 2 -11 3015.99 172.20 2616.72 o 2 1 10 6112.04 371.43 6885.43 o 0 0 14 913.48 80.80 915.76 o 1 3 6 1217.96 95.80 1232.58 o 3 1 -8 122.68 16.96 101.69 o 3 2 -1 898.08 75.89 898.50 o 3 2 -2 37.45 32.50 49.56 o 1 3 -7 -45.59 35.38 0.42 o 3 2 0 4551.65 260.61 4693.62 o 1 0 -14 3408.56 189.94 2934.87 o 2 2 8 5433.29 317.09 5757.99 o 2 3 -1 661.35 64.39 527.21 o 3 2 -3 813.08 68.20 714.95 o 2 1 -12 24683.25 1230.75 23527.09 o 2 3 0 4022.10 241.58 4263.04 o 2 3 -2 49.47 33.34 47.10 o 3 2 1 315.65 29.86 320.07 o 3 1 6 2852.30 194.34 3495.40 o 2 3 1 1495.60 110.47 1466.73 o 0 3 8 99.25 18.44 112.80 o 3 2 -4 4911.81 290.86 5378.18 o 2 3 -3 -25.64 32.59 0.81 o 0 2 12 9185.69 481.55 8818.23 o 2 2 -10 8620.60 469.98 8727.82 o 1 2 11 37.97 37.04 60.69 o 3 2 2 467.48 44.17 507.01 o 2 3 2 6725.30 360.11 6302.57 o 1 1 13 0.46 35.57 0.10 o 1 3 7 28.83 20.77 27.30 o 2 3 -4 6484.75 378.70 7154.21 o 3 1 -9 89.13 17.13 83.03 o 0 1 14 4469.37 261.86 4507.09 o 3 2 -5 109.63 18.10 122.46 o 1 2 -12 214.18 23.90 254.88 o 3 0 -10 1565.38 108.87 1443.70 o 1 3 -8 2463.83 155.82 2532.11 o 2 3 3 47.98 38.25 36.48 o 2 1 11 558.15 56.13 678.88 o 3 2 3 417.26 40.94 413.57 o 1 1 -14 11323.95 575.36 10548.31 o 2 3 -5 465.53 42.43 406.68 o 3 1 7 146.47 19.67 147.18 o 2 2 9 98.35 18.25 117.57 o 3 0 8 1315.17 102.06 1305.00 o 3 2 -6 16.57 30.01 2.99 o 0 3 9 252.53 24.88 249.09 o 1 0 14 40.87 17.30 23.05 o 2 3 4 5629.43 316.34 5538.79 o 2 0 12 5863.62 376.98 6989.78 o 2 1 -13 31.57 35.31 1.11 o 3 2 4 5942.76 318.91 5585.43 o 1 3 8 5360.42 302.76 5346.55 o 2 2 -11 1802.31 117.17 1531.16 o 2 3 -6 147.72 20.33 182.73 o 3 1 -10 17140.98 860.29 16148.79 o 1 3 -9 1152.98 88.22 1032.70 o 3 2 -7 775.22 75.38 774.16 o 1 2 12 141.49 20.46 149.71 o 0 2 13 3822.71 209.11 3189.55 o 2 0 -14 10519.85 528.88 9479.55 o 2 3 5 21.40 38.57 20.49 o 3 1 8 1409.03 114.77 1606.97 o 3 2 5 468.61 43.60 453.01 o 1 2 -13 668.02 66.85 542.25 o 1 1 14 127.87 20.63 141.32 o 2 3 -7 -8.87 36.58 3.51 o 2 2 10 647.38 72.40 727.95 o 2 1 12 99.35 19.35 146.42 o 4 0 -2 862.90 84.96 1104.41 o 0 3 10 3468.50 207.96 3412.71 o 0 1 15 2.68 38.94 41.53 o 4 0 0 42.99 30.87 28.58 o 3 2 -8 4269.21 265.23 4797.36 o 1 1 -15 150.36 20.94 143.79 o 1 3 9 1140.19 95.54 1085.61 o 4 0 -4 1149.27 91.28 1088.74 o 3 1 -11 724.35 74.53 691.11 o 2 3 6 3912.08 239.80 4172.01 o 1 3 -10 1687.33 118.53 1710.24 o 2 2 -12 165.15 19.62 138.86 o 3 2 6 2621.19 169.50 2703.22 o 0 4 0 14465.02 756.13 14200.92 o 2 1 -14 221.57 23.46 239.01 o 0 4 1 1217.21 103.55 941.83 o 3 0 -12 1733.61 121.71 1718.96 o 2 3 -8 4527.66 271.46 4854.93 o 4 0 2 8065.66 400.32 6899.41 o 0 4 2 494.63 53.65 501.47 o 3 1 9 16.66 33.15 21.43 o 4 1 -2 992.65 87.22 961.37 o 0 0 -16 11808.55 594.94 10626.61 o 4 1 -1 838.70 82.05 931.67 o 1 2 13 2732.20 163.64 2279.03 o 4 1 -3 89.51 17.21 59.13 o 3 2 -9 801.90 74.19 744.69 o 4 1 0 5223.45 314.34 5838.83 o 1 0 -16 8833.30 467.51 8437.71 o 0 2 14 1481.78 102.19 1135.24 o 0 4 3 2840.20 180.64 2552.64 o 4 0 -6 3287.37 205.07 3392.05 o 3 0 10 3712.38 238.69 3983.53 o 4 1 -4 8086.08 453.82 8466.61 o 0 3 11 599.40 53.20 547.03 o 2 3 7 -16.66 40.45 23.83 o 2 2 11 -50.62 38.16 14.95 o 1 2 -14 873.13 74.14 810.70 o 4 1 1 5899.39 332.29 6024.57 o 1 3 10 -5.91 36.04 1.52 o 1 4 0 4174.88 250.68 4167.77 o 3 2 7 51.94 15.50 25.62 o 1 4 -1 3465.72 205.71 3135.49 o 0 4 4 1825.87 140.88 2011.81 o 2 1 13 533.06 53.91 612.13 o 1 4 1 8235.41 457.66 8238.31 o 3 1 -12 1144.70 92.21 960.07 o 4 1 -5 834.23 84.60 861.78 o 1 4 -2 3460.51 226.12 3775.86 o 2 3 -9 182.15 20.66 136.63 o 1 3 -11 -31.68 37.81 4.05 o 1 1 15 1239.46 105.14 1215.63 o 4 1 2 5685.60 281.83 4481.68 o 1 4 2 14823.95 792.57 15010.79 o 2 2 -13 552.95 54.93 437.52 o 1 4 -3 684.97 55.42 564.61 o 4 0 4 -18.54 34.30 0.43 o 0 1 16 5660.82 324.38 5563.43 o 1 1 -16 1696.65 124.77 1591.62 o 0 4 5 170.23 23.00 168.77 o 3 2 -10 968.66 94.12 1114.43 o 4 1 -6 779.02 77.90 829.15 o 3 3 -1 41.53 36.61 43.75 o 3 3 -2 3905.45 247.23 4404.38 o 1 4 3 470.89 48.42 430.94 o 3 1 10 4131.41 268.13 4665.38 o 2 1 -15 114.24 19.30 58.95 o 3 3 0 866.19 78.67 807.62 o 4 1 3 2421.58 152.22 2088.63 o 1 4 -4 856.60 93.72 1105.02 o 2 3 8 1132.38 99.34 1203.46 o 3 3 -3 50.76 37.56 59.02 o 2 0 14 350.78 37.18 406.65 o 3 3 1 252.08 26.97 192.70 o 4 0 -8 3186.10 190.96 2913.13 o 3 2 8 2842.04 189.57 3056.84 o 3 3 -4 316.56 32.25 321.97 o 1 4 4 428.10 42.30 457.54 o 1 0 16 -3.09 32.50 0.99 o 0 3 12 54.69 44.09 63.68 o 4 1 -7 54.28 41.15 62.23 o 1 2 14 1153.32 108.95 1556.47 o 2 3 -10 1311.98 107.67 1380.66 o 0 4 6 353.57 38.62 369.70 o 1 3 11 970.88 93.60 940.25 o 3 3 2 11092.90 578.28 10549.65 o 1 4 -5 60.25 44.39 78.79 o 2 2 12 10617.29 604.04 11458.67 o 4 1 4 14167.62 734.36 13770.06 o 0 2 15 80.77 19.05 57.34 o 3 1 -13 1341.23 98.99 1218.23 o 3 3 -5 1255.18 100.78 1245.50 o 1 3 -12 2328.99 158.89 2373.90 o 1 2 -15 1048.21 87.22 890.47 o 2 0 -16 551.72 49.16 493.99 o 3 2 -11 2144.56 142.61 1987.29 o 3 3 3 3249.76 194.43 2768.19 o 1 4 5 47.57 34.99 65.17 o 2 1 14 285.92 34.68 466.94 o 1 4 -6 4193.94 255.93 4253.12 o 4 1 -8 4427.89 266.38 4606.99 o 2 2 -14 1210.64 101.54 1305.83 o 2 3 9 929.32 84.42 879.80 o 4 0 6 6923.76 411.23 7449.73 o 3 0 -14 622.84 53.11 587.92 o 3 3 -6 7147.25 407.99 7510.25 o 0 4 7 333.03 34.54 340.51 o 4 1 5 759.37 77.80 733.05 o 1 1 16 4931.54 295.01 4876.92 o 3 1 11 150.65 21.77 134.42 o 3 2 9 451.94 44.86 418.71 o 4 2 -2 2111.20 153.21 2473.68 o 3 3 4 3364.32 199.99 3000.86 o 4 2 -1 923.89 80.91 845.58 o 2 3 -11 -53.29 41.48 2.37 o 4 2 -3 32.42 36.45 1.94 o 0 1 17 -30.30 49.83 5.76 o 4 2 0 44.53 33.88 1.61 o 1 4 6 7537.86 430.16 7835.52 o 1 1 -17 -38.21 40.51 10.59 o 2 1 -16 13448.02 697.18 12830.22 o 1 4 -7 591.13 55.27 595.35 o 4 2 -4 997.10 83.69 954.40 o 3 3 -7 144.98 20.25 122.88 o 4 2 1 687.50 58.14 637.91 o 0 3 13 -20.46 40.34 1.45 o 1 3 12 4551.60 277.96 4675.48 o 2 4 -1 1212.69 98.08 1009.54 o 3 0 12 1658.33 136.93 1861.13 o 2 4 0 1680.26 128.01 1746.10 o 4 0 -10 6182.61 347.32 6062.67 o 4 1 -9 -28.26 34.75 8.42 o 2 4 -2 338.72 37.87 425.68 o 2 4 1 1810.64 139.75 1726.24 o 2 2 13 364.51 36.69 317.97 o 0 4 8 3792.64 229.43 3629.98 o 3 2 -12 451.19 50.70 576.91 o 4 1 6 162.77 22.74 187.66 o 4 2 -5 24.65 36.20 4.08 o 3 3 5 -64.26 48.39 0.26 o 1 3 -13 38.10 34.28 23.48 o 3 1 -14 540.56 57.49 764.49 o 2 4 -3 297.11 31.17 272.91 o 1 2 15 1647.09 129.92 1610.33 o 4 2 2 11336.13 606.95 11355.96 o 2 3 10 5393.92 313.82 5318.75 o 2 4 2 3053.00 191.33 2750.86 o 0 2 16 8193.84 455.68 8172.52 o 1 4 7 47.98 34.60 17.17 o 2 4 -4 1136.88 111.88 1442.80 o 1 2 -16 3351.25 198.69 3030.45 o 3 3 -8 341.12 34.23 330.55 o 4 2 -6 4512.41 274.12 4794.81 o 1 4 -8 869.95 84.30 879.07 o 3 2 10 3907.05 249.25 4110.65 o 4 2 3 44.90 37.60 16.48 o 2 2 -15 200.86 23.69 149.80 o 0 0 18 2080.20 150.10 1969.00 o 2 4 3 199.85 26.03 191.10 o 1 0 -18 186.24 24.43 156.18 o 3 1 12 342.92 39.13 456.97 o 2 1 15 153.47 22.80 150.81 o 2 3 -12 4625.75 291.33 5051.41 o 4 1 -10 405.18 43.07 356.98 o 2 4 -5 37.83 39.31 56.69 o 3 3 6 4692.85 280.50 4787.56 o 4 1 7 50.80 18.28 30.78 o 0 4 9 33.90 47.38 62.54 o 4 2 -7 31.06 38.52 9.37 o 4 0 8 182.60 22.73 153.62 o 2 4 4 3294.89 219.27 3369.58 o 1 1 17 390.47 42.62 498.04 o 4 2 4 1263.78 99.36 1009.03 o 1 3 13 1065.54 97.56 1069.32 o 1 4 8 46.75 45.69 77.95 o 3 3 -9 762.78 76.95 678.00 o 0 3 14 3688.89 233.04 3854.74 o 2 4 -6 1945.62 153.24 2255.98 o 3 2 -13 1184.09 106.53 1236.08 o 2 1 -17 352.60 36.88 332.53 o 1 4 -9 469.35 52.38 469.13 o 0 1 18 3188.80 197.11 2878.12 o 2 3 11 51.85 50.02 49.94 o 1 1 -18 5200.15 302.10 4957.91 o 1 3 -14 2608.21 188.27 2897.01 o 3 1 -15 476.03 46.36 439.02 o 2 2 14 247.29 26.87 294.32 o 2 0 16 6718.08 411.45 7304.21 o 3 3 7 1350.53 105.83 1274.53 o 4 2 -8 1318.61 106.12 1360.68 o 2 4 5 116.16 22.43 82.99 o 4 1 -11 1365.22 113.80 1303.37 o 4 2 5 113.92 22.65 131.69 o 1 2 16 195.72 24.92 159.08 o 3 2 11 459.37 51.05 453.38 o 2 4 -7 -100.49 47.99 3.31 o 4 0 -12 176.21 20.67 153.94 o 4 1 8 6085.61 395.06 7308.97 o 2 3 -13 925.72 86.26 864.30 o 0 4 10 1100.30 100.87 1042.14 o 0 2 17 114.30 21.39 95.11 o 3 1 13 641.35 58.19 659.19 o 3 3 -10 6814.87 399.52 7200.77 o 1 2 -17 36.23 19.56 28.76 o 1 4 9 265.77 30.08 274.82 o 2 2 -16 53.97 19.13 46.61 o 1 0 18 2919.99 203.45 3076.45 o 3 0 -16 4132.52 243.44 3898.21 o 2 0 -18 6422.34 356.55 6068.65 o 2 4 6 385.68 41.32 423.32 o 1 4 -10 3892.31 242.35 3915.77 o 4 2 -9 254.42 28.18 256.21 o 2 1 16 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