#------------------------------------------------------------------------------ #$Date: 2009-05-05 17:46:52 +0300 (Tue, 05 May 2009) $ #$Revision: 697 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/2103458.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2103458_Fobs loop_ _publ_author_name 'Norberg, Stefan T.' _publ_section_title ; New phosphate langbeinites, K~2~MTi(PO~4~)~3~ (M = Er, Yb or Y), and an alternative description of the langbeinite framework ; _journal_issue 5 _journal_name_full 'Acta Crystallographica Section B' _journal_page_first 743 _journal_page_last 749 _journal_volume 58 _journal_year 2002 _space_group_IT_number 198 _symmetry_space_group_name_Hall 'P 2ac 2ab 3' _symmetry_space_group_name_H-M 'P 21 3' _[local]_cod_data_source_file os0095KYTPsup4.hkl _[local]_cod_data_source_block KYTP loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_F_squared_sigma 0 0 2 11.66 174.01 107.72 0 0 4 254.28 424.42 90.29 0 0 6 3109.63 4032.23 52.19 0 0 8 113.16 169.39 112.01 0 0 10 477.83 607.00 96.06 0 0 12 386.11 468.89 134.73 0 0 14 1444.78 1296.34 90.03 0 1 2 7024.51 6757.93 85.71 0 1 3 38874.93 40208.02 1621.5 0 1 4 195.37 269.53 85.41 0 1 5 1213.53 1251.81 160.50 0 1 6 5790.47 5843.46 329.24 0 1 7 3679.40 3401.10 201.11 0 1 8 -33.78 128.30 102.16 0 1 9 896.72 929.62 51.21 0 1 10 1269.56 1184.24 56.44 0 1 11 1985.80 2026.95 63.79 0 1 12 48.57 8.10 131.60 0 1 13 -29.49 7.92 171.43 0 1 14 414.15 461.14 157.87 0 2 1 328.58 340.84 45.47 0 2 2 -180.45 156.78 114.16 0 2 3 6421.30 5684.78 77.11 0 2 4 288.03 267.27 57.68 0 2 5 12797.76 12073.18 148.14 0 2 6 6340.81 6233.16 332.25 0 2 7 6579.85 6609.31 257.20 0 2 8 2804.91 2789.64 53.24 0 2 9 6271.79 5820.35 73.80 0 2 10 108.82 7.16 135.01 0 2 11 87.79 183.82 105.22 0 2 12 2031.94 1760.13 73.00 0 2 13 776.38 943.31 111.75 0 2 14 151.45 .26 154.14 0 3 1 39830.18 44012.71 2625.2 0 3 2 3946.19 3992.24 284.42 0 3 3 224.10 282.81 74.16 0 3 4 -29.94 9.50 89.77 0 3 5 8238.03 8311.64 377.83 0 3 6 11116.64 10320.88 516.68 0 3 7 9974.68 9856.46 470.48 0 3 8 593.59 583.61 45.90 0 3 9 94.24 29.88 117.51 0 3 10 -1.64 31.08 127.99 0 3 11 1242.70 1409.00 93.86 0 3 12 1667.90 1598.91 73.36 0 3 13 -23.90 13.05 154.54 0 4 1 392.09 324.54 58.92 0 4 2 1356.62 1472.08 40.82 0 4 3 8034.08 7755.29 92.84 0 4 4 1892.83 1903.43 185.85 0 4 5 1236.58 1272.74 42.00 0 4 6 1145.89 941.73 43.34 0 4 7 2964.03 2496.93 51.93 0 4 8 671.93 723.55 48.27 0 4 9 217.49 131.63 93.00 0 4 10 1825.10 1767.01 61.34 0 4 11 823.56 722.20 63.34 0 4 12 188.74 543.17 145.17 0 4 13 225.85 188.52 130.77 0 5 1 4222.80 4122.73 276.86 0 5 2 1911.27 2152.13 41.36 0 5 3 2632.51 2499.82 153.09 0 5 4 271.46 260.73 39.48 0 5 5 2189.61 2165.55 46.83 0 5 6 -45.56 2.45 108.28 0 5 7 21.67 39.75 104.41 0 5 8 4390.35 4290.28 65.09 0 5 9 2999.98 2708.19 64.02 0 5 10 421.44 482.54 103.75 0 5 11 150.68 303.96 132.04 0 5 12 28.77 .05 155.52 0 5 13 2195.25 2148.85 84.17 0 6 1 9143.75 9071.77 628.77 0 6 2 6349.21 6796.54 464.11 0 6 3 2611.80 2550.69 201.87 0 6 4 2290.74 2237.08 194.97 0 6 5 356.62 358.25 65.60 0 6 6 7346.14 6899.81 86.03 0 6 7 1049.64 1032.71 51.83 0 6 8 2045.06 2101.56 59.40 0 6 9 1521.41 1396.05 61.50 0 6 10 1634.35 1586.85 66.04 0 6 11 -187.09 10.70 164.73 0 6 12 537.14 422.55 72.00 0 7 1 1434.20 1336.56 44.11 0 7 2 188.12 217.25 62.78 0 7 3 52.94 91.94 98.51 0 7 4 6898.49 7341.18 329.24 0 7 5 1288.42 1203.73 48.53 0 7 6 209.24 274.44 74.38 0 7 7 1742.74 1793.15 58.00 0 7 8 2376.18 2308.64 63.68 0 7 9 51.05 1.20 137.15 0 7 10 89.30 59.37 146.59 0 7 11 32.86 53.91 168.60 0 7 12 849.60 921.01 115.62 0 8 1 618.94 669.05 44.55 0 8 2 1080.50 1109.34 46.66 0 8 3 2059.11 2104.98 51.12 0 8 4 200.04 305.65 68.90 0 8 5 997.84 929.54 53.68 0 8 6 3176.07 3353.29 229.86 0 8 7 -172.22 27.29 130.65 0 8 8 1162.03 990.79 62.31 0 8 9 540.96 617.72 95.97 0 8 10 405.80 554.93 123.69 0 8 11 243.32 315.35 150.81 0 9 1 3019.89 3075.42 58.97 0 9 2 -78.60 10.68 114.35 0 9 3 2519.80 2495.32 200.71 0 9 4 141.04 223.08 108.28 0 9 5 4891.39 4795.44 250.31 0 9 6 32.62 77.34 116.29 0 9 7 98.49 123.29 134.80 0 9 8 661.36 680.74 99.01 0 9 9 -155.94 79.77 139.41 0 9 10 -83.25 16.37 160.06 0 9 11 218.32 61.88 161.27 0 10 1 249.80 221.34 76.44 0 10 2 -192.83 122.39 124.70 0 10 3 3141.09 3043.49 65.05 0 10 4 473.78 575.40 57.38 0 10 5 -33.97 23.39 134.57 0 10 6 904.81 825.22 62.33 0 10 7 104.90 211.31 133.00 0 10 8 1236.47 1284.87 74.03 0 10 9 80.73 16.51 175.42 0 10 10 1610.14 1429.84 82.00 0 11 1 90.56 58.17 117.04 0 11 2 -12.86 16.17 132.81 0 11 3 218.03 190.08 127.71 0 11 4 1725.88 1738.79 65.80 0 11 5 -252.34 9.32 159.65 0 11 6 1182.43 1115.81 70.33 0 11 7 2767.40 2799.99 80.90 0 11 8 1108.03 949.93 76.34 0 11 9 83.21 138.14 207.37 0 12 1 2521.40 2279.91 74.50 0 12 2 776.76 925.76 95.75 0 12 3 469.69 509.70 95.17 0 12 4 2244.92 2079.07 76.07 0 12 5 355.96 287.30 99.66 0 12 6 477.09 564.97 132.94 0 12 7 -93.44 1.10 165.57 0 13 1 79.46 131.98 155.93 0 13 2 3580.92 3163.20 84.64 0 13 3 206.98 354.15 169.13 0 13 4 -117.60 4.09 161.24 0 13 5 -52.99 4.46 166.32 0 14 1 -283.26 98.10 191.79 0 14 2 3.45 117.27 183.87 1 1 1 4602.14 5450.56 128.41 -1 -1 -1 7176.43 6208.13 192.44 1 1 2 3507.87 3987.68 65.08 -1 -1 -2 2530.54 2316.93 61.68 1 1 3 7824.58 8018.12 671.95 -1 -1 -3 9059.52 8832.96 135.35 1 1 4 -5.38 118.64 131.97 -1 -1 -4 58.23 45.05 132.28 1 1 5 1525.93 1360.85 51.61 -1 -1 -5 1215.06 1251.80 50.92 1 1 6 10802.30 10283.90 159.77 -1 -1 -6 12131.79 11884.74 179.37 1 1 7 978.84 1233.65 55.27 -1 -1 -7 1323.05 1257.88 56.71 1 1 8 223.87 321.95 99.31 -1 -1 -8 180.40 155.22 118.02 1 1 9 3528.70 2992.50 78.48 -1 -1 -9 3100.13 3025.83 77.95 1 1 10 1782.23 1716.75 76.23 -1 -1 -10 2097.26 1962.33 77.66 1 1 11 1327.68 1540.30 81.33 -1 -1 -11 1406.43 1237.70 80.30 1 1 12 1564.63 1431.82 91.21 -1 -1 -12 1368.62 1370.39 90.56 1 1 13 190.06 78.11 221.47 -1 -1 -13 -184.51 146.28 237.87 1 1 14 710.30 544.57 98.87 -1 -1 -14 846.92 633.58 98.42 1 2 2 2030.58 2101.16 60.43 -1 -2 -2 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162.86 -7 -7 -9 1028.92 867.27 98.28 7 7 10 409.39 237.93 162.72 -7 -7 -10 201.62 231.80 98.43 7 8 8 -133.18 79.86 193.51 -7 -8 -8 -96.35 67.28 204.01 7 8 9 210.92 254.06 155.37 -7 -8 -9 452.34 262.15 212.37 7 9 8 -146.47 69.22 203.64 -7 -9 -8 -6.33 103.68 249.65 8 8 8 1723.86 1678.98 176.91 -8 -8 -8 1336.95 1123.53 183.65