#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/22/14/2221450.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_2221450_Fobs
loop_
_publ_author_name
'Yoshimura, Takashi'
'Kikunaga, Hidetoshi'
'Shinohara, Atsushi'
_publ_section_title
;
 Poly[(\m~2~-2-hydroxy-2-methylpropionato-\k^3^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^)(\m~2~-2-hydroxy-2-methylpropionato-\k^2^<i>O</i>^1^:\k<i>O</i>^1'^)dioxidouranium(VI)]
;
_journal_coeditor_code           NG2546
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m355
_journal_page_last               m356
_journal_volume                  65
_journal_year                    2009
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 98.246(9)
_cell_angle_gamma                90
_cell_length_a                   9.009(2)
_cell_length_b                   8.237(2)
_cell_length_c                   17.552(6)
_[local]_cod_data_source_file    ng2546Isup2.hkl
_[local]_cod_data_source_block   I
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
1/2-x,1/2+y,1/2-z
-x,-y,-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_sigma
_refln_F_squared_calc
_refln_observed_status
1 1 0 144.88 9.09 125.82 o
0 1 2 68308.54 5415.84 103443.60 o
1 1 -1 1120.89 59.89 1065.82 o
1 1 1 54150.11 3388.35 57248.09 o
1 0 -3 925.15 59.64 897.58 o
1 1 -2 29014.11 1715.69 30986.13 o
1 1 2 1642.83 90.28 1795.57 o
0 1 3 2278.69 133.68 2244.56 o
1 0 3 114384.61 8595.81 139456.44 o
2 0 0 3673.70 199.93 3612.09 o
1 1 -3 110190.98 8383.78 135789.38 o
0 0 4 37603.49 2294.60 40297.34 o
2 0 -2 40287.03 2608.28 43986.14 o
0 2 1 17304.81 960.65 17220.95 o
1 1 3 5599.00 310.81 6108.83 o
2 1 -1 3394.31 195.52 3471.36 o
2 1 0 68101.17 4968.17 89693.50 o
0 1 4 293.70 27.47 264.68 o
2 1 -2 5121.87 296.81 5291.16 o
-2 0 -2 82285.61 5740.50 96081.87 o
1 2 0 11552.79 675.86 12503.76 o
2 1 1 5501.75 320.91 5752.83 o
0 2 2 9519.56 519.65 9461.51 o
1 1 -4 3602.96 201.77 3594.14 o
1 2 -1 33675.93 2039.10 37413.15 o
1 2 1 1563.99 86.24 1649.11 o
1 2 -2 12653.66 717.96 13400.38 o
2 1 -3 20193.78 1237.76 22589.55 o
2 1 2 3428.18 190.73 3346.90 o
1 0 -5 29254.31 1835.22 31260.64 o
1 1 4 4282.60 239.37 4476.88 o
1 2 2 6085.62 328.26 6181.55 o
2 0 -4 498.97 49.26 481.82 o
0 2 3 10734.78 629.31 11503.41 o
1 2 -3 3414.36 183.38 3080.73 o
0 1 5 3553.85 220.17 3857.66 o
1 1 -5 2398.14 137.93 2247.84 o
2 1 -4 62006.84 4285.12 70274.65 o
1 0 5 676.08 49.65 674.58 o
2 1 3 6246.68 340.43 5944.58 o
1 2 3 35926.25 2185.31 38392.89 o
2 2 -1 3597.14 227.03 3890.06 o
2 2 0 484.82 32.17 525.45 o
3 0 -1 1772.68 120.41 1983.64 o
0 2 4 43371.34 2900.98 49096.73 o
2 2 -2 42467.04 2709.91 47261.70 o
2 2 1 14987.38 874.27 14471.54 o
1 2 -4 9448.15 560.89 10136.78 o
2 0 4 7033.43 374.16 6861.20 o
0 0 6 102.34 22.80 90.04 o
1 1 5 60148.68 3893.73 64380.30 o
-3 0 -1 35085.34 2277.78 40701.40 o
3 1 -1 36260.62 2335.35 39424.25 o
3 0 -3 30908.09 1998.07 33521.93 o
2 2 -3 9797.17 572.53 10426.42 o
3 1 0 2769.74 164.17 3036.27 o
2 1 -5 129.24 29.64 138.71 o
2 2 2 29646.18 1801.38 30864.02 o
3 1 -2 345.38 40.16 307.61 o
1 2 4 22619.98 1277.60 22614.48 o
2 1 4 67474.58 4342.97 71755.84 o
0 1 6 37840.59 2436.30 42223.21 o
1 1 -6 84.81 40.03 113.26 o
0 3 1 28829.03 1735.91 29319.30 o
3 1 1 6075.64 359.67 6423.51 o
3 1 -3 227.93 42.08 94.15 o
0 2 5 25767.06 1586.79 26611.53 o
1 2 -5 26189.76 1610.51 29500.27 o
1 3 0 29118.91 1843.29 30441.73 o
0 3 2 6205.20 383.17 7308.72 o
1 3 -1 3859.83 224.06 4181.67 o
2 0 -6 33896.05 2286.32 38033.98 o
2 2 -4 2360.79 154.73 2494.75 o
2 2 3 14438.35 842.42 14769.28 o
1 3 1 16186.26 962.24 16878.06 o
3 1 2 16316.31 936.24 16011.88 o
1 3 -2 17570.69 1031.19 19044.62 o
1 1 6 3647.86 204.31 3461.00 o
3 1 -4 4304.65 267.30 4367.32 o
-3 0 -3 3143.82 188.35 3452.44 o
1 0 -7 94.40 31.75 17.14 o
2 1 -6 1846.66 129.38 1956.58 o
1 3 2 14440.28 841.62 15818.48 o
0 3 3 20012.74 1187.35 20682.78 o
1 2 5 799.09 61.41 835.23 o
2 1 5 11871.17 669.42 12345.84 o
3 0 -5 7710.89 488.03 7715.90 o
1 3 -3 11845.40 711.30 12939.79 o
3 2 -1 2411.23 147.35 2575.24 o
3 2 0 10257.72 533.54 9083.54 o
2 2 -5 47346.15 3011.47 48697.29 o
3 1 3 45028.15 2955.84 49576.99 o
3 2 -2 4361.15 314.83 4838.90 o
1 1 -7 40815.16 2673.97 44787.28 o
0 1 7 2073.83 135.10 2142.85 o
2 2 4 5126.28 319.52 5149.23 o
0 2 6 220.89 46.64 207.59 o
1 2 -6 15547.38 927.07 16372.21 o
1 3 3 360.81 47.23 344.83 o
3 2 1 24007.76 1385.54 26075.18 o
2 3 -1 24421.56 1481.72 23470.36 o
2 3 0 30149.58 1835.71 29109.68 o
3 1 -5 35093.88 2301.64 37499.70 o
3 2 -3 48112.50 3354.83 54164.23 o
0 3 4 4185.66 252.45 3952.88 o
1 0 7 80505.91 5655.71 86877.49 o
2 3 -2 3607.86 249.91 3882.47 o
2 3 1 17226.24 1044.68 17601.89 o
1 3 -4 20775.49 1269.38 22194.57 o
2 0 6 75422.94 5113.81 78302.48 o
3 2 2 15935.20 974.99 16962.35 o
4 0 -2 6369.87 385.98 6565.84 o
4 0 0 34887.85 2284.07 37965.03 o
2 1 -7 2694.51 208.43 2877.43 o
2 3 -3 33500.48 2120.64 36943.51 o
1 2 6 3812.76 238.99 4367.47 o
1 1 7 2583.95 153.56 2312.33 o
3 2 -4 4618.98 294.86 4648.14 o
-3 1 -4 23248.61 1336.19 22366.37 o
2 3 2 3091.66 155.99 2798.59 o
1 3 4 5356.74 349.60 6196.66 o
2 2 -6 35515.02 2271.11 37857.11 o
2 1 6 41.09 17.12 20.60 o
2 2 5 6901.77 369.11 6824.87 o
4 1 -1 5185.66 337.68 6011.45 o
0 0 8 48144.65 3190.25 49888.77 o
3 1 -6 4095.61 312.92 4282.51 o
4 1 -2 28866.31 1913.17 32601.52 o
0 3 5 9495.48 630.08 10712.52 o
4 1 0 4916.87 290.13 4525.63 o
3 2 3 4877.21 288.37 4399.07 o
1 3 -5 5927.97 348.83 5469.20 o
1 2 -7 174.53 46.10 134.96 o
2 3 -4 17283.11 989.73 17094.27 o
0 2 7 3617.06 255.30 4002.03 o
4 1 -3 163.07 41.21 161.38 o
2 3 3 16639.28 907.61 16578.68 o
-3 0 -5 72249.66 5010.60 75940.78 o
1 1 -8 2421.66 163.39 2340.18 o
4 0 -4 28570.04 1820.29 29092.32 o
4 1 1 8014.81 456.91 7244.92 o
0 1 8 287.20 42.53 231.47 o
3 2 -5 1070.77 86.06 1102.85 o
4 0 2 24941.02 1477.11 24098.17 o
2 0 -8 1102.71 112.37 1185.00 o
0 4 0 3811.50 245.56 3566.86 o
3 0 -7 39939.09 2745.73 42122.10 o
1 3 5 14162.12 823.99 13350.66 o
-3 1 -5 7252.15 412.78 7143.86 o
0 4 1 30597.49 1913.32 31096.28 o
4 1 -4 622.81 83.73 711.33 o
3 3 -1 10718.81 680.56 10806.01 o
4 1 2 40487.32 2653.91 41117.42 o
2 2 -7 1835.92 144.07 2165.31 o
3 3 0 21390.44 1319.52 21400.38 o
1 2 7 42865.63 2721.88 44391.12 o
2 3 -5 12388.93 737.81 11934.39 o
3 2 4 15963.23 940.92 15415.28 o
2 1 -8 29123.53 1949.91 30424.99 o
3 3 -2 11714.07 791.67 13135.30 o
1 4 0 15246.04 885.33 15621.27 o
0 4 2 437.94 51.24 429.64 o
1 4 -1 786.48 63.66 843.78 o
2 2 6 31270.97 1862.55 32280.21 o
2 3 4 16551.53 928.57 17302.63 o
3 1 -7 3413.97 242.52 3621.63 o
0 3 6 18614.53 1182.79 18864.31 o
1 3 -6 27647.70 1696.99 28662.72 o
2 1 7 1616.50 104.65 1637.03 o
1 4 1 388.78 65.21 360.56 o
1 1 8 208.55 38.64 152.72 o
3 3 1 7875.36 526.32 7596.25 o
4 2 -1 10320.36 620.40 9490.78 o
1 4 -2 28567.32 1762.37 29970.49 o
3 2 -6 41680.12 2834.34 46189.25 o
-4 2 2 4687.53 303.82 4800.45 o
3 3 -3 1199.51 121.65 1219.16 o
4 2 0 29950.89 1975.43 31865.33 o
4 1 -5 1067.82 105.69 1142.79 o
1 0 -9 40573.81 2714.16 41705.54 o
1 4 2 18816.91 1171.34 18792.95 o
0 4 3 36711.33 2348.78 38959.09 o
4 1 3 6261.24 369.21 5679.69 o
4 2 -3 21865.31 1399.34 21994.60 o
1 2 -8 7840.42 487.25 8296.10 o
3 3 2 11872.29 702.70 11033.56 o
0 2 8 31444.64 1928.70 30127.16 o
4 2 1 12427.51 738.27 14293.43 o
1 4 -3 789.76 71.21 786.16 o
1 3 6 28521.11 1722.72 28362.06 o
4 0 -6 6783.98 513.25 6788.18 o
3 3 -4 22987.88 1435.68 24004.83 o
1 1 -9 18.83 45.91 17.34 o
2 3 -6 4134.55 250.48 3961.95 o
3 1 6 1948.69 119.68 2061.24 o
3 2 5 38373.83 2359.88 38233.61 o
0 1 9 145.71 48.56 121.17 o
4 2 -4 35354.98 2424.73 36012.86 o
1 4 3 8484.78 489.70 8420.70 o
-4 0 -4 44404.09 2908.19 46450.96 o
2 3 5 21304.69 1201.26 21640.35 o
2 4 -1 28602.19 1916.79 31125.32 o
2 4 0 47.97 18.89 22.08 o
4 2 2 1524.08 117.75 1374.23 o
0 4 4 2373.45 170.41 2423.03 o
4 1 -6 39812.33 2764.66 42606.30 o
2 2 -8 1975.03 180.18 2212.97 o
2 4 -2 1180.79 138.98 1244.24 o
2 0 8 1506.17 110.57 1515.99 o
3 3 3 25329.59 1649.70 27779.04 o
2 4 1 12888.14 758.94 14358.20 o
1 4 -4 32648.01 2064.61 33810.87 o
1 3 -7 11224.12 708.98 12454.41 o
0 3 7 23388.41 1446.45 23130.03 o
3 1 -8 7300.96 500.35 7824.68 o
3 2 -7 33926.32 2239.89 36053.69 o
1 0 9 1275.00 108.77 1263.61 o
2 2 7 26065.70 1494.34 25432.33 o
1 2 8 18547.12 1128.13 19119.82 o
-4 1 -4 2801.24 176.29 2926.21 o
2 1 -9 1439.58 129.11 1482.71 o
3 3 -5 21596.13 1362.27 22059.54 o
2 4 -3 23266.16 1383.68 22719.47 o
4 2 -5 595.72 89.96 643.11 o
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2 4 2 3018.59 170.38 2796.03 o
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1 1 9 40756.62 2674.43 42745.19 o
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3 0 7 167.38 30.81 60.67 o
5 0 -3 9237.82 589.49 9501.22 o
0 4 5 15361.41 978.25 15598.21 o
2 3 -7 28595.68 1817.48 29474.04 o
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3 3 4 22890.27 1414.74 22721.60 o
1 4 -5 1002.95 78.13 975.61 o
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2 4 -4 444.08 55.68 369.19 o
2 3 6 1602.41 93.03 1564.47 o
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2 4 3 21357.36 1248.84 21226.69 o
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0 2 9 2080.89 152.25 2169.64 o
3 1 7 61211.04 3879.61 58649.43 o
5 1 0 51.41 37.50 27.72 o
4 3 -1 24198.92 1605.37 25706.41 o
5 1 -3 35691.63 2378.98 37192.50 o
0 0 10 427.03 60.66 446.00 o
3 0 -9 3199.98 260.19 3289.82 o
3 3 -6 8067.11 492.80 8151.25 o
4 3 -2 10641.86 637.85 10591.41 o
4 3 0 2043.73 131.54 2114.35 o
4 2 -6 1111.08 104.41 1009.47 o
-4 1 -5 2908.24 195.54 2835.40 o
3 2 -8 3876.11 271.80 3907.86 o
1 1 -10 3272.11 238.23 3459.50 o
1 4 5 23.94 39.43 3.48 o
4 3 -3 3158.35 251.49 3222.67 o
5 1 1 28839.29 1877.79 27803.97 o
1 3 -8 21156.38 1374.15 22323.52 o
4 2 4 26849.52 1723.81 25759.54 o
2 2 -9 8105.97 531.76 8583.06 o
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0 3 8 -35.70 39.82 4.29 o
2 0 -10 44829.34 3208.90 48743.16 o
5 1 -4 908.47 127.48 923.45 o
0 1 10 45046.31 3052.02 48619.87 o
3 1 -9 35954.39 2470.22 38101.36 o
3 4 -1 101.01 27.29 102.15 o
3 4 0 9931.61 546.42 9454.02 o
2 4 -5 27100.97 1685.40 28293.15 o
2 2 8 357.20 46.60 316.60 o
5 0 -5 37831.30 2705.85 37906.99 o
3 4 -2 36956.49 2231.40 35170.78 o
2 4 4 328.51 46.83 426.90 o
4 0 -8 46221.91 3236.20 45988.46 o
0 4 6 100.87 63.80 116.81 o
3 3 5 1253.39 106.84 1047.31 o
1 2 9 155.63 42.47 104.82 o
1 -4 -6 17102.09 1057.27 17491.33 o
4 3 -4 491.67 109.86 432.01 o
3 4 1 2012.72 109.48 1776.54 o
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4 3 2 16760.82 1038.63 15861.22 o
3 4 -3 2646.41 235.05 2827.88 o
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2 3 -8 9306.08 581.11 9365.77 o
5 1 -5 5775.53 380.23 5376.19 o
2 1 9 1884.91 138.02 1975.52 o
5 2 -1 19447.00 1259.39 22094.34 o
5 2 -2 3618.63 245.98 3466.75 o
4 1 -8 13140.50 898.66 13765.26 o
3 3 -7 154.21 43.42 123.47 o
4 2 -7 15505.41 1046.15 15357.20 o
2 3 7 8856.73 464.13 7814.37 o
0 5 1 23968.18 1460.76 23654.33 o
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1 4 6 25012.01 1596.04 25691.75 o
3 4 -4 15412.12 916.86 14345.53 o
4 3 -5 28927.62 1814.42 28186.30 o
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0 5 2 615.51 83.72 737.04 o
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2 4 -6 2998.19 215.44 2789.01 o
1 2 -10 1384.27 132.27 1708.78 o
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1 5 1 1672.62 135.79 1565.27 o
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5 2 -4 12376.61 850.15 13251.72 o
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0 3 9 25427.63 1633.80 24176.80 o
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3 1 -10 425.97 81.83 408.02 o
3 4 -5 1113.69 90.62 1117.66 o
1 5 -3 15.73 25.41 12.86 o
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2 5 -3 30785.66 2192.68 32176.42 o
2 5 2 808.12 67.42 895.84 o
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1 5 4 10867.85 658.05 10303.15 o
5 3 -2 26351.82 1625.79 23679.60 o
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6 0 -2 37518.23 2559.37 39849.84 o
4 3 -7 3339.34 277.24 3265.24 o
4 4 -3 30916.08 1973.40 30111.78 o
1 4 -8 20681.02 1338.35 19957.40 o
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5 3 0 3729.96 220.91 3720.01 o
0 4 8 2683.42 233.38 2463.48 o
3 2 -10 11002.94 742.18 11196.46 o
4 4 1 40566.57 2809.08 39744.12 o
1 1 11 62.26 35.94 72.97 o
5 3 -3 6277.23 422.60 5823.31 o
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1 2 -11 1534.40 176.09 1377.23 o
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1 3 -10 22482.98 1515.70 22170.67 o
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