#======================================================================= data_(I) #======================================================================= # 11. STRUCTURE-FACT R LIST loop_ _refln_index_h _refln_index_k _refln_index_l _refln_intensity_meas _refln_intensity_calc _refln_intensity_sigma 4 0 0 482.0 448.0 26.9 6 0 0 605.0 632.7 33.8 8 0 0 1840.0 1928.7 95.1 10 0 0 1047.0 1062.7 57.2 12 0 0 303.0 350.7 30.1 1 1 0 464.0 241.6 24.5 2 1 0 1921.0 1309.7 97.2 3 1 0 1258.0 994.2 64.0 4 1 0 1634.0 1396.6 83.1 5 1 0 1243.0 1154.8 63.9 7 1 0 580.0 560.2 31.4 9 1 0 437.0 461.5 24.0 10 1 0 782.0 787.1 41.5 12 1 0 957.0 931.5 51.1 0 2 0 1535.0 984.2 77.8 1 2 0 771.0 512.9 39.8 2 2 0 2828.0 2224.9 143.4 3 2 0 933.0 773.3 48.4 4 2 0 216.0 201.8 14.1 5 2 0 576.0 552.8 30.8 6 2 0 1061.0 1108.6 55.4 7 2 0 1658.0 1739.6 84.8 8 2 0 432.0 440.6 23.4 9 2 0 831.0 870.2 44.5 10 2 0 751.0 807.3 40.4 1 3 0 310.0 233.4 16.6 2 3 0 206.0 166.7 13.0 3 3 0 1952.0 1687.7 100.0 4 3 0 215.0 225.3 16.1 5 3 0 2369.0 2388.2 120.3 6 3 0 800.0 813.7 42.1 7 3 0 821.0 841.5 43.4 8 3 0 613.0 680.1 32.2 10 3 0 307.0 331.3 21.5 11 3 0 346.0 344.2 22.9 0 4 0 1348.0 1136.8 68.8 1 4 0 632.0 545.7 33.1 2 4 0 587.0 493.5 31.0 4 4 0 2313.0 2226.2 118.5 5 4 0 850.0 857.5 45.4 6 4 0 884.0 942.7 47.0 7 4 0 1385.0 1492.0 71.8 9 4 0 787.0 802.7 42.1 10 4 0 721.0 747.5 39.0 1 5 0 1839.0 1701.3 93.5 2 5 0 1814.0 1682.6 92.5 3 5 0 1202.0 1147.4 62.2 4 5 0 660.0 706.9 35.5 5 5 0 889.0 868.8 48.0 6 5 0 495.0 502.9 28.0 7 5 0 711.0 778.1 38.2 8 5 0 735.0 806.7 39.3 9 5 0 330.0 350.3 21.6 10 5 0 487.0 483.7 27.1 12 5 0 537.0 511.7 29.4 0 6 0 2083.0 2108.2 105.9 1 6 0 933.0 905.4 49.7 2 6 0 699.0 666.2 37.0 3 6 0 1049.0 1028.8 55.5 5 6 0 697.0 709.4 37.6 8 6 0 666.0 699.8 35.7 9 6 0 430.0 433.6 25.1 10 6 0 432.0 454.9 25.7 11 6 0 620.0 623.6 33.6 1 7 0 1748.0 1789.4 89.4 2 7 0 506.0 474.6 27.6 3 7 0 313.0 309.7 19.1 4 7 0 614.0 610.8 33.0 5 7 0 582.0 587.9 31.5 8 7 0 595.0 604.4 33.3 10 7 0 409.0 396.1 26.0 12 7 0 440.0 408.4 27.2 1 8 0 754.0 751.1 40.2 2 8 0 964.0 946.8 50.8 3 8 0 1120.0 1231.8 58.8 4 8 0 1053.0 1051.0 56.0 6 8 0 1095.0 1079.2 58.6 7 8 0 498.0 501.2 29.1 2 9 0 669.0 686.8 37.1 5 9 0 481.0 479.5 26.9 6 9 0 1123.0 1112.3 59.6 8 9 0 1030.0 940.2 54.2 0 10 0 239.0 249.0 25.0 1 10 0 275.0 269.1 24.3 2 10 0 289.0 270.9 23.1 4 10 0 1258.0 1302.1 66.0 6 10 0 816.0 778.3 43.5 10 10 0 547.0 455.1 34.5 1 11 0 1151.0 1098.7 61.3 2 11 0 328.0 330.0 24.4 3 11 0 374.0 386.5 24.6 6 11 0 616.0 577.2 33.8 8 11 0 528.0 505.2 32.0 9 11 0 489.0 428.7 31.6 1 12 0 453.0 450.4 27.7 1 13 0 1014.0 929.1 54.1 -12 0 1 478.0 496.7 29.3 -10 0 1 587.0 613.3 33.4 -8 0 1 1866.0 1971.8 96.6 -6 0 1 2660.0 2552.0 135.3 -2 0 1 552.0 364.8 30.1 0 0 1 1211.0 462.7 63.5 2 0 1 2434.0 1760.0 123.3 4 0 1 638.0 602.4 34.8 6 0 1 1457.0 1442.4 75.8 8 0 1 1214.0 1276.8 65.3 -12 1 1 399.0 430.8 24.4 -11 1 1 701.0 712.5 37.7 -10 1 1 882.0 923.1 47.3 -8 1 1 332.0 340.6 19.4 -6 1 1 1157.0 1157.6 59.8 -5 1 1 307.0 278.5 16.9 -4 1 1 1667.0 1461.0 84.7 -3 1 1 2152.0 1638.3 108.9 -2 1 1 596.0 392.8 31.4 -1 1 1 434.0 241.7 22.8 2 1 1 1742.0 1294.9 88.4 3 1 1 475.0 389.5 25.4 4 1 1 2922.0 2733.9 147.9 5 1 1 457.0 426.1 24.2 6 1 1 1838.0 1892.8 93.6 7 1 1 437.0 484.1 24.0 8 1 1 359.0 394.6 20.5 11 1 1 523.0 519.2 28.4 12 1 1 494.0 506.2 27.5 -12 2 1 248.0 242.6 24.4 -11 2 1 325.0 323.7 22.1 -9 2 1 624.0 659.2 33.1 -8 2 1 1079.0 1135.8 56.9 -6 2 1 756.0 773.0 39.7 -5 2 1 1003.0 969.5 52.1 -4 2 1 1274.0 1109.4 65.2 -3 2 1 143.0 97.7 12.3 -2 2 1 240.0 156.6 13.4 -1 2 1 2420.0 1660.7 122.3 0 2 1 864.0 555.1 43.9 1 2 1 2528.0 1864.1 128.0 2 2 1 549.0 434.9 29.2 4 2 1 364.0 343.9 19.9 5 2 1 355.0 346.1 19.5 6 2 1 652.0 636.2 34.7 7 2 1 838.0 898.0 44.2 8 2 1 527.0 557.4 28.2 9 2 1 1366.0 1469.0 71.2 10 2 1 341.0 350.6 22.1 11 2 1 591.0 602.7 31.5 -13 3 1 723.0 704.9 38.8 -11 3 1 859.0 875.7 45.8 -9 3 1 357.0 380.3 21.0 -7 3 1 255.0 234.8 17.5 -6 3 1 379.0 380.8 20.6 -5 3 1 1541.0 1494.4 78.7 -3 3 1 2560.0 2270.5 129.9 -2 3 1 689.0 553.9 36.8 -1 3 1 1957.0 1563.1 99.1 0 3 1 1705.0 1339.4 86.2 1 3 1 334.0 277.0 17.7 2 3 1 763.0 666.5 40.0 3 3 1 304.0 260.1 20.7 5 3 1 529.0 513.4 27.9 6 3 1 459.0 462.4 24.7 7 3 1 759.0 830.8 40.8 8 3 1 708.0 784.0 38.1 9 3 1 311.0 350.9 20.9 10 3 1 598.0 656.6 32.2 11 3 1 704.0 730.2 37.9 13 3 1 423.0 451.8 25.9 -13 4 1 344.0 356.8 24.9 -12 4 1 343.0 303.5 23.5 -9 4 1 314.0 332.9 20.4 -8 4 1 1239.0 1346.4 64.8 -7 4 1 243.0 273.5 18.5 -6 4 1 477.0 486.3 25.9 -5 4 1 283.0 270.1 18.6 -4 4 1 388.0 388.0 21.8 -3 4 1 610.0 548.8 32.4 -2 4 1 1982.0 1739.7 100.5 -1 4 1 2399.0 2164.0 121.4 0 4 1 956.0 825.0 48.8 1 4 1 1563.0 1413.6 79.6 2 4 1 1155.0 1015.9 59.7 3 4 1 1158.0 1144.3 60.3 4 4 1 949.0 938.5 50.4 5 4 1 520.0 502.5 28.2 6 4 1 918.0 926.9 48.3 7 4 1 1237.0 1342.8 65.0 8 4 1 207.0 255.2 20.8 9 4 1 1058.0 1145.2 56.2 10 4 1 405.0 408.4 24.1 11 4 1 553.0 579.5 30.1 12 4 1 644.0 639.0 34.4 -11 5 1 412.0 405.5 24.9 -10 5 1 821.0 837.0 44.4 -9 5 1 752.0 773.1 40.1 -7 5 1 1205.0 1273.4 62.6 -6 5 1 1008.0 1006.4 54.2 -5 5 1 1168.0 1163.2 61.7 -4 5 1 1294.0 1343.8 67.2 -3 5 1 1197.0 1119.8 62.2 -2 5 1 788.0 727.0 41.2 -1 5 1 1042.0 971.8 53.9 0 5 1 1041.0 989.6 53.4 1 5 1 970.0 942.3 50.8 2 5 1 170.0 144.3 16.4 3 5 1 427.0 395.3 23.2 4 5 1 1578.0 1621.2 81.4 6 5 1 804.0 794.8 43.6 7 5 1 399.0 398.5 23.3 8 5 1 544.0 575.6 29.0 10 5 1 438.0 460.3 25.5 -11 6 1 467.0 454.3 26.7 -10 6 1 538.0 541.4 29.9 -9 6 1 613.0 651.3 32.9 -8 6 1 927.0 942.5 49.7 -6 6 1 1811.0 1744.1 94.5 -5 6 1 808.0 809.2 43.1 -3 6 1 1160.0 1145.2 60.7 -2 6 1 303.0 253.1 18.2 -1 6 1 332.0 305.0 18.9 0 6 1 211.0 214.7 16.0 1 6 1 684.0 700.2 35.9 2 6 1 2015.0 1984.0 102.7 3 6 1 1169.0 1197.4 61.2 4 6 1 422.0 437.2 22.9 5 6 1 2000.0 2032.4 102.8 7 6 1 593.0 557.5 33.2 8 6 1 562.0 611.6 30.6 10 6 1 286.0 326.6 24.6 -9 7 1 770.0 744.7 41.0 -8 7 1 239.0 236.7 32.3 -7 7 1 1509.0 1379.8 79.5 -6 7 1 431.0 464.5 25.2 -5 7 1 608.0 600.3 32.7 -4 7 1 468.0 453.0 25.4 -3 7 1 501.0 493.1 27.0 -2 7 1 734.0 711.1 39.6 0 7 1 539.0 549.9 28.1 1 7 1 1118.0 1177.8 58.7 2 7 1 968.0 1027.1 51.0 3 7 1 1119.0 1183.6 59.1 4 7 1 890.0 922.2 47.3 5 7 1 553.0 569.2 29.4 6 7 1 864.0 829.4 45.7 7 7 1 711.0 720.0 38.2 8 7 1 547.0 508.6 31.7 9 7 1 355.0 360.5 26.0 -9 8 1 604.0 584.6 34.2 -8 8 1 711.0 599.0 39.8 -6 8 1 573.0 561.7 31.1 -5 8 1 1097.0 1107.9 58.4 -4 8 1 1824.0 1821.3 93.8 -2 8 1 1323.0 1348.7 69.4 -1 8 1 688.0 655.3 36.8 0 8 1 1112.0 1137.3 57.6 1 8 1 522.0 545.7 28.3 3 8 1 1021.0 1083.3 53.5 4 8 1 588.0 586.1 31.4 5 8 1 900.0 905.8 47.8 6 8 1 253.0 264.8 25.4 9 8 1 521.0 530.0 30.6 -10 9 1 291.0 317.7 35.2 -6 9 1 584.0 578.4 31.6 -4 9 1 240.0 229.5 23.3 -3 9 1 487.0 478.7 26.7 -2 9 1 1109.0 1098.8 58.0 0 9 1 1717.0 1740.2 87.7 1 9 1 312.0 350.4 21.0 2 9 1 804.0 830.5 42.9 6 9 1 367.0 378.6 25.0 7 9 1 456.0 466.4 28.4 8 9 1 994.0 892.8 52.9 -6 10 1 504.0 475.5 28.8 -5 10 1 324.0 339.6 24.2 -4 10 1 917.0 961.5 48.9 -2 10 1 1962.0 1958.8 101.2 -1 10 1 206.0 210.5 28.0 0 10 1 367.0 395.0 20.9 1 10 1 219.0 251.1 23.7 3 10 1 396.0 410.9 23.7 5 10 1 536.0 522.2 29.8 6 10 1 801.0 815.9 43.5 -7 11 1 737.0 649.1 39.8 -5 11 1 530.0 537.7 30.0 -2 11 1 478.0 454.5 27.7 0 11 1 888.0 873.7 46.3 1 11 1 732.0 776.8 38.8 3 11 1 499.0 538.5 27.7 -4 12 1 558.0 535.6 31.2 -3 12 1 432.0 413.0 28.1 0 12 1 617.0 607.9 32.4 3 12 1 1012.0 972.5 54.0 7 12 1 367.0 357.0 31.0 -5 13 1 393.0 350.1 28.0 0 13 1 315.0 340.3 23.9 1 13 1 560.0 564.9 31.3 3 13 1 481.0 486.7 28.3 2 14 1 512.0 503.1 30.2 3 14 1 448.0 432.5 28.7 -14 0 2 553.0 574.6 32.5 -12 0 2 473.0 477.1 28.6 -8 0 2 1193.0 1299.5 64.7 -6 0 2 1598.0 1558.7 82.4 -4 0 2 1860.0 1671.3 94.9 -2 0 2 1723.0 1231.8 87.8 0 0 2 1004.0 536.7 53.0 2 0 2 608.0 512.0 32.7 4 0 2 1341.0 1294.4 69.4 6 0 2 887.0 953.7 47.5 8 0 2 1348.0 1453.9 71.9 10 0 2 1336.0 1409.8 73.2 -12 1 2 559.0 578.5 30.4 -11 1 2 653.0 677.0 35.5 -9 1 2 602.0 603.3 32.0 -8 1 2 233.0 246.0 18.2 -6 1 2 803.0 780.5 41.9 -5 1 2 757.0 692.9 40.0 -4 1 2 2711.0 2463.2 137.2 -3 1 2 474.0 365.6 25.7 -2 1 2 2734.0 2117.6 138.3 -1 1 2 1245.0 759.8 65.1 1 1 2 321.0 212.1 17.9 3 1 2 1435.0 1229.7 73.3 4 1 2 961.0 918.9 50.0 5 1 2 1224.0 1223.8 63.0 6 1 2 1518.0 1600.8 77.8 8 1 2 717.0 771.4 38.9 10 1 2 411.0 429.0 23.8 12 1 2 434.0 449.5 25.8 13 1 2 436.0 474.9 26.5 -12 2 2 323.0 348.2 23.4 -10 2 2 628.0 645.9 33.6 -9 2 2 1103.0 1146.3 58.0 -8 2 2 439.0 425.1 23.7 -7 2 2 1791.0 1781.9 91.3 -6 2 2 1424.0 1374.2 73.0 -5 2 2 766.0 700.5 39.8 -4 2 2 328.0 294.1 17.5 -3 2 2 957.0 752.7 49.6 -2 2 2 646.0 528.8 34.8 -1 2 2 696.0 541.5 36.8 0 2 2 997.0 756.9 50.8 1 2 2 2800.0 2248.2 141.7 2 2 2 216.0 179.5 15.4 3 2 2 2320.0 2123.1 117.9 4 2 2 526.0 526.6 27.8 7 2 2 903.0 917.0 47.3 8 2 2 939.0 1020.0 49.3 10 2 2 460.0 482.9 25.9 11 2 2 623.0 625.7 33.0 -11 3 2 1142.0 1122.7 60.5 -9 3 2 1147.0 1148.2 60.7 -8 3 2 789.0 850.0 42.2 -6 3 2 538.0 522.6 28.7 -5 3 2 980.0 922.5 51.5 -3 3 2 779.0 663.6 41.4 -2 3 2 252.0 175.1 14.4 -1 3 2 1655.0 1360.4 84.1 0 3 2 1198.0 1012.3 60.9 2 3 2 1217.0 1111.7 62.9 3 3 2 2592.0 2324.3 131.6 4 3 2 432.0 413.5 23.8 5 3 2 1737.0 1786.4 89.1 6 3 2 266.0 267.8 18.6 7 3 2 570.0 576.3 30.2 8 3 2 214.0 255.6 20.9 9 3 2 382.0 399.1 22.6 11 3 2 570.0 577.1 30.5 13 3 2 468.0 500.6 27.3 -12 4 2 509.0 464.7 28.1 -11 4 2 232.0 211.1 24.9 -10 4 2 629.0 665.7 34.0 -9 4 2 850.0 872.3 45.4 -8 4 2 475.0 483.5 25.8 -7 4 2 1448.0 1506.9 74.6 -6 4 2 850.0 875.9 44.4 -5 4 2 969.0 969.8 51.3 -4 4 2 211.0 206.6 16.7 -3 4 2 766.0 707.5 40.4 -2 4 2 963.0 861.4 50.1 -1 4 2 1544.0 1396.4 78.6 0 4 2 1652.0 1489.5 83.8 1 4 2 2347.0 2193.4 119.0 2 4 2 573.0 541.5 31.1 3 4 2 2091.0 1998.3 106.6 4 4 2 1042.0 1028.7 54.8 5 4 2 266.0 259.8 22.4 6 4 2 374.0 399.2 22.2 8 4 2 757.0 816.5 40.4 10 4 2 367.0 404.8 23.1 11 4 2 363.0 403.1 24.2 -13 5 2 387.0 386.0 25.8 -12 5 2 669.0 617.5 35.5 -9 5 2 685.0 692.6 37.0 -8 5 2 550.0 572.7 30.0 -7 5 2 516.0 520.7 27.7 -5 5 2 746.0 757.0 39.8 -4 5 2 1911.0 1851.6 97.4 -2 5 2 1456.0 1352.5 74.5 0 5 2 204.0 169.8 12.4 1 5 2 951.0 918.5 50.2 2 5 2 1173.0 1162.3 60.8 3 5 2 431.0 420.2 23.0 4 5 2 394.0 409.8 22.6 5 5 2 1034.0 1039.3 55.1 6 5 2 1464.0 1376.5 76.4 7 5 2 627.0 629.7 33.9 8 5 2 671.0 695.1 36.0 9 5 2 836.0 913.3 44.8 -10 6 2 380.0 417.3 24.2 -6 6 2 512.0 498.5 28.7 -5 6 2 1094.0 1109.6 57.6 -4 6 2 696.0 703.2 37.5 -3 6 2 2119.0 2153.3 107.8 -2 6 2 1082.0 1060.9 56.7 -1 6 2 1437.0 1412.7 73.8 1 6 2 471.0 466.2 25.6 2 6 2 594.0 570.2 31.7 4 6 2 407.0 409.0 22.7 5 6 2 1219.0 1219.0 64.1 6 6 2 325.0 336.9 22.8 8 6 2 926.0 960.9 49.0 10 6 2 790.0 790.6 42.3 11 6 2 406.0 442.0 25.8 -10 7 2 451.0 419.5 26.5 -7 7 2 1107.0 1063.4 58.9 -6 7 2 907.0 918.4 48.1 -5 7 2 1119.0 1117.9 59.1 -4 7 2 955.0 948.7 50.4 -2 7 2 1480.0 1484.9 76.4 -1 7 2 1705.0 1742.3 87.3 0 7 2 971.0 1006.7 50.3 1 7 2 420.0 430.2 22.8 2 7 2 980.0 994.0 51.9 3 7 2 391.0 393.4 22.0 4 7 2 729.0 762.5 38.7 5 7 2 633.0 675.2 34.2 6 7 2 707.0 724.2 37.7 7 7 2 981.0 965.0 51.9 8 7 2 349.0 376.8 25.8 9 7 2 906.0 910.2 49.1 -9 8 2 492.0 445.9 30.5 -7 8 2 424.0 431.8 26.0 -5 8 2 469.0 494.4 26.8 -3 8 2 1294.0 1281.2 68.0 -2 8 2 473.0 483.7 25.7 -1 8 2 506.0 550.3 27.2 0 8 2 174.0 183.6 20.9 1 8 2 807.0 823.5 43.0 2 8 2 698.0 746.6 37.6 3 8 2 352.0 380.9 21.9 4 8 2 1317.0 1376.8 68.5 5 8 2 493.0 512.1 27.4 6 8 2 843.0 839.8 45.1 7 8 2 847.0 798.5 45.6 8 8 2 409.0 422.3 26.6 -8 9 2 1170.0 1093.1 61.5 -6 9 2 930.0 862.1 49.9 -5 9 2 622.0 620.2 33.0 -3 9 2 412.0 383.4 23.8 -2 9 2 379.0 402.3 23.0 0 9 2 1506.0 1641.6 77.2 1 9 2 344.0 373.3 21.0 2 9 2 1795.0 1962.5 92.2 3 9 2 695.0 727.5 37.5 4 9 2 734.0 791.6 38.9 10 9 2 341.0 342.1 27.0 -10 10 2 468.0 401.6 32.8 -6 10 2 503.0 522.8 28.8 -3 10 2 647.0 636.2 34.5 -1 10 2 482.0 468.3 26.9 0 10 2 523.0 543.9 27.7 1 10 2 300.0 327.9 21.2 2 10 2 638.0 694.0 34.1 4 10 2 1299.0 1348.6 68.6 6 10 2 849.0 838.5 45.0 -8 11 2 538.0 536.0 32.4 -6 11 2 480.0 446.2 28.8 -5 11 2 889.0 820.3 47.2 -1 11 2 390.0 407.2 25.2 0 11 2 841.0 878.2 44.0 1 11 2 662.0 690.0 35.6 2 11 2 846.0 928.2 45.2 4 11 2 470.0 460.1 27.4 -5 12 2 736.0 705.7 39.7 -3 12 2 1231.0 1120.5 65.7 -1 12 2 826.0 783.6 44.3 4 12 2 282.0 276.6 27.0 5 12 2 579.0 562.4 33.1 7 12 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924.0 51.0 -5 2 3 2298.0 2242.6 116.6 -3 2 3 766.0 672.0 40.4 -2 2 3 1274.0 1015.7 66.5 -1 2 3 1082.0 907.0 55.9 1 2 3 572.0 430.7 30.3 2 2 3 1933.0 1737.5 98.3 3 2 3 1439.0 1379.7 74.7 4 2 3 1293.0 1314.7 67.1 5 2 3 897.0 912.8 47.6 6 2 3 564.0 572.2 30.3 7 2 3 837.0 877.4 44.5 8 2 3 721.0 778.1 38.7 9 2 3 1009.0 1049.8 53.2 10 2 3 448.0 465.0 25.4 12 2 3 338.0 362.1 24.7 -11 3 3 311.0 278.1 23.0 -9 3 3 1051.0 1080.6 55.5 -8 3 3 685.0 729.3 37.0 -7 3 3 455.0 463.1 24.5 -6 3 3 1056.0 1018.7 55.8 -5 3 3 1111.0 1051.5 57.8 -4 3 3 1088.0 1051.2 56.7 -3 3 3 3241.0 3113.6 164.3 -1 3 3 1175.0 1035.5 60.4 2 3 3 496.0 414.2 26.7 5 3 3 2271.0 2397.9 115.9 7 3 3 1439.0 1569.2 74.7 8 3 3 458.0 483.9 25.0 9 3 3 560.0 606.5 30.1 11 3 3 382.0 406.5 24.3 -12 4 3 514.0 483.2 28.8 -11 4 3 363.0 355.1 23.5 -10 4 3 489.0 481.3 26.8 -9 4 3 504.0 514.6 27.1 -8 4 3 491.0 496.0 26.1 -7 4 3 1492.0 1517.8 77.0 -5 4 3 1860.0 1804.4 95.1 -4 4 3 1746.0 1740.9 89.3 -3 4 3 996.0 940.9 52.0 -2 4 3 790.0 733.3 41.6 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