#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/01/60/2016002.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_2016002_Fobs
loop_
_publ_author_name
'Centore, Roberto'
'De Tommaso, Gaetano'
'Iuliano, Mauro'
'Tuzi, Angela'
_publ_section_title
;
 An organouranium coordination polymer containing infinite metal oxide
 chains
;
_journal_coeditor_code           LN3054
_journal_issue                   6
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m253
_journal_page_last               m255
_journal_volume                  63
_journal_year                    2007
_space_group_IT_number           56
_symmetry_space_group_name_Hall  '-P 2ab 2ac'
_symmetry_space_group_name_H-M   'P c c n'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   12.6490
_cell_length_b                   16.2580
_cell_length_c                   8.7560
_exptl_crystal_F_000             1144.00
_reflns_d_resolution_high        0.7692
_[local]_cod_data_source_file    ln3054Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' Compound X'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            420.34
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y+1/2, z'
'x+1/2, -y, -z+1/2'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y-1/2, -z'
'-x-1/2, y, z-1/2'
'x, -y-1/2, z-1/2'
loop_
_refln_index_h
_refln_index_k
_refln_index_l
_refln_F_squared_calc
_refln_F_squared_meas
_refln_F_squared_sigma
_refln_observed_status
2 0 0 118123.21 121475.75 2634.54 o
4 0 0 12144.00 11800.23 441.80 o
6 0 0 66080.23 65495.46 2822.52 o
8 0 0 35928.19 38753.74 1474.09 o
10 0 0 14317.93 15875.00 937.28 o
12 0 0 12709.74 12924.70 919.57 o
14 0 0 9709.87 9689.95 1958.69 o
16 0 0 4182.68 4931.92 1468.86 o
3 1 0 176685.47 172661.17 3343.90 o
5 1 0 66814.63 64053.07 1365.37 o
7 1 0 30958.63 30708.12 690.89 o
9 1 0 29572.53 29341.25 878.57 o
11 1 0 12737.19 11893.42 576.02 o
13 1 0 10347.95 10568.79 634.22 o
15 1 0 7248.48 6937.51 715.54 o
2 2 0 85628.87 86070.72 2733.40 o
4 2 0 102296.90 102622.49 2041.06 o
6 2 0 80531.90 80381.90 1525.32 o
8 2 0 40315.17 39554.08 864.35 o
10 2 0 20041.82 20916.59 746.25 o
12 2 0 11511.99 11977.93 633.77 o
14 2 0 7435.69 8124.93 1076.80 o
16 2 0 4402.70 4943.50 1784.48 o
1 3 0 89122.81 90394.81 2873.95 o
3 3 0 30240.92 28361.45 813.75 o
5 3 0 39765.80 40868.35 1028.65 o
7 3 0 101255.51 101811.85 2476.26 o
9 3 0 37132.37 36333.50 987.63 o
11 3 0 14223.93 14408.83 698.87 o
13 3 0 8344.82 6714.92 590.92 o
15 3 0 4858.91 4728.29 1211.28 o
2 4 0 64752.30 59996.31 2002.49 o
4 4 0 31779.27 30536.31 799.24 o
6 4 0 60268.11 61572.79 1508.47 o
8 4 0 51768.14 53301.16 1384.52 o
10 4 0 21913.15 22344.75 845.38 o
12 4 0 11483.14 11985.91 848.11 o
14 4 0 6459.17 7425.85 1136.25 o
16 4 0 3327.98 2066.17 1181.17 o
1 5 0 61911.18 60031.27 2024.13 o
3 5 0 50434.71 48882.80 1747.41 o
5 5 0 53616.63 55950.44 1374.41 o
7 5 0 31631.55 32506.09 920.72 o
9 5 0 19967.09 19619.37 701.30 o
11 5 0 15391.64 16303.70 999.36 o
13 5 0 9709.53 9943.05 995.14 o
15 5 0 6070.87 5045.23 1231.04 o
0 6 0 89740.88 89591.26 4173.46 o
2 6 0 71812.23 71301.72 2423.80 o
4 6 0 55965.27 57899.46 2082.92 o
6 6 0 18229.02 18055.65 622.60 o
8 6 0 19569.46 19960.18 670.64 o
10 6 0 14972.34 13310.71 797.08 o
12 6 0 9943.77 9796.83 735.52 o
14 6 0 9729.00 9506.95 1068.82 o
1 7 0 127294.96 121276.57 5596.05 o
3 7 0 18318.06 16766.91 855.75 o
5 7 0 31166.06 32236.31 1191.86 o
7 7 0 27624.19 26519.49 830.25 o
9 7 0 15518.66 15449.52 1452.36 o
11 7 0 10114.99 10253.99 667.01 o
13 7 0 8848.70 9974.29 862.74 o
15 7 0 4849.83 5313.03 1447.64 o
0 8 0 42075.57 42701.94 2301.60 o
2 8 0 44542.64 43960.00 1668.63 o
4 8 0 46060.96 42298.83 1643.68 o
6 8 0 29359.42 29461.11 884.62 o
8 8 0 21498.16 20678.67 758.80 o
10 8 0 14827.24 16103.03 890.95 o
12 8 0 8549.12 9990.02 1507.45 o
14 8 0 5214.87 6723.58 1000.53 o
1 9 0 21855.87 21810.08 1506.81 o
3 9 0 53144.17 50933.94 1940.10 o
5 9 0 35881.90 35592.05 1859.96 o
7 9 0 27634.36 27102.99 1041.30 o
9 9 0 18591.59 16954.96 662.93 o
11 9 0 12862.45 13390.09 1280.64 o
13 9 0 8165.18 7857.68 855.69 o
0 10 0 37912.21 40619.73 2399.01 o
2 10 0 35071.27 36692.59 2263.83 o
4 10 0 23612.66 21081.16 1185.67 o
6 10 0 35656.05 35122.90 1545.19 o
8 10 0 26986.83 26750.57 1204.93 o
10 10 0 16285.31 15227.08 978.12 o
12 10 0 10556.83 9458.34 1060.55 o
14 10 0 5511.60 4693.19 902.50 o
1 11 0 32749.16 35505.91 1562.42 o
3 11 0 38812.02 45034.63 2688.33 o
5 11 0 32704.76 31167.09 1179.56 o
7 11 0 25049.02 26049.87 1153.31 o
9 11 0 18471.36 15051.61 1859.11 o
11 11 0 13591.94 14372.33 1164.46 o
13 11 0 6663.41 6722.12 1136.97 o
0 12 0 41235.73 39496.58 2348.59 o
2 12 0 39565.04 40124.21 2520.63 o
4 12 0 39551.34 38139.77 2357.80 o
6 12 0 25402.67 23883.44 1110.86 o
8 12 0 16755.99 15456.71 758.95 o
10 12 0 13674.57 14612.62 1064.85 o
12 12 0 8184.28 7199.52 1395.94 o
1 13 0 42533.72 47194.22 1995.47 o
3 13 0 40233.74 43213.01 2739.47 o
5 13 0 32482.02 31633.13 1605.55 o
7 13 0 17667.37 18703.32 1572.80 o
9 13 0 12544.76 11417.90 1001.82 o
11 13 0 7650.68 8828.02 1478.74 o
0 14 0 33174.26 31939.04 2294.37 o
2 14 0 37948.54 39845.72 2355.18 o
4 14 0 39658.39 40226.49 2574.84 o
6 14 0 20310.48 20369.25 1160.77 o
8 14 0 11536.84 12750.90 734.88 o
10 14 0 9087.38 8901.65 1208.20 o
12 14 0 6250.55 12075.81 3073.80 o
1 15 0 36869.09 38304.70 3092.96 o
3 15 0 27775.25 26090.92 2192.72 o
5 15 0 18938.71 20701.28 1514.41 o
7 15 0 14844.04 14778.62 1108.70 o
9 15 0 10906.46 9707.06 1163.56 o
11 15 0 8280.92 6745.41 2583.70 o
0 16 0 23372.93 28010.99 2305.21 o
2 16 0 25208.05 27967.21 1643.16 o
4 16 0 21091.33 22298.74 2336.47 o
6 16 0 15042.62 14221.88 1453.21 o
8 16 0 10456.43 8098.98 1390.30 o
10 16 0 9611.00 6510.12 2545.02 o
1 17 0 11809.39 13223.62 1273.67 o
3 17 0 25585.96 24171.04 1353.40 o
5 17 0 17962.21 18339.94 1753.85 o
7 17 0 10602.31 11187.83 1777.07 o
0 18 0 16110.88 14361.14 2088.72 o
2 18 0 12434.84 13074.96 1268.59 o
4 18 0 13865.45 13824.29 1178.89 o
6 18 0 16217.34 14926.55 1720.93 o
1 19 0 12318.66 13353.65 1256.42 o
3 19 0 14576.53 14600.64 1264.37 o
5 19 0 11422.62 10239.44 1282.44 o
0 20 0 11300.85 12241.52 1642.23 o
2 20 0 12352.62 12632.26 1133.58 o
4 20 0 13019.00 11542.22 2237.37 o
1 21 0 10540.16 10474.08 2913.50 o
1 1 1 9485.51 9570.24 194.70 o
2 1 1 11.33 185.20 89.67 o
3 1 1 28601.58 29940.29 493.44 o
4 1 1 2886.73 3409.55 150.11 o
5 1 1 0.08 -118.65 118.65 o
6 1 1 237.39 506.55 126.12 o
7 1 1 33.39 242.71 130.39 o
8 1 1 1924.29 2016.49 173.00 o
9 1 1 0.00 617.19 188.80 o
10 1 1 0.01 345.50 201.28 o
11 1 1 110.28 83.80 269.60 o
12 1 1 129.52 -224.87 282.14 o
13 1 1 6.59 -53.33 200.39 o
14 1 1 13.01 374.31 416.00 o
15 1 1 0.70 376.46 533.97 o
16 1 1 37.91 -790.34 790.34 o
1 2 1 92.31 63.07 60.36 o
2 2 1 3770.96 4010.20 158.11 o
3 2 1 2893.26 3227.04 233.88 o
4 2 1 24238.51 23467.14 453.08 o
5 2 1 109.41 -105.65 221.02 o
6 2 1 2402.15 2728.97 180.44 o
7 2 1 665.36 613.17 190.60 o
8 2 1 1.44 222.77 147.90 o
9 2 1 91.90 172.94 167.59 o
10 2 1 140.84 363.16 192.26 o
11 2 1 184.20 190.21 277.26 o
12 2 1 6.23 6.65 278.75 o
13 2 1 30.13 608.63 316.55 o
14 2 1 1.53 27.96 398.06 o
15 2 1 0.02 -450.00 473.67 o
16 2 1 21.10 475.15 641.86 o
1 3 1 95.33 730.43 131.46 o
2 3 1 1543.74 2101.93 232.68 o
3 3 1 32.20 410.45 398.41 o
4 3 1 1577.35 1700.01 201.38 o
5 3 1 247.19 196.03 176.64 o
6 3 1 385.54 566.92 207.55 o
7 3 1 3441.03 3449.04 168.83 o
8 3 1 192.53 206.84 151.54 o
9 3 1 28.34 7.44 115.44 o
10 3 1 54.22 157.09 185.60 o
11 3 1 50.08 -50.10 202.81 o
12 3 1 240.12 -122.19 270.78 o
13 3 1 43.79 -291.93 445.39 o
14 3 1 1.44 178.26 535.88 o
15 3 1 7.85 -553.08 863.87 o
16 3 1 0.60 -75.66 890.17 o
1 4 1 5762.49 6768.20 252.56 o
2 4 1 955.51 871.37 167.73 o
3 4 1 365.35 758.74 241.82 o
4 4 1 245.87 289.63 158.78 o
5 4 1 1466.54 1795.03 239.51 o
6 4 1 8.54 -262.30 291.61 o
7 4 1 651.03 1022.37 250.00 o
8 4 1 6.36 -76.68 293.46 o
9 4 1 1378.85 813.13 246.71 o
10 4 1 1148.83 956.34 266.00 o
11 4 1 6.01 -83.89 262.46 o
12 4 1 230.14 603.83 314.54 o
13 4 1 66.87 1042.03 515.54 o
14 4 1 13.26 -521.02 609.67 o
15 4 1 72.41 -219.02 603.98 o
16 4 1 1.76 192.48 1057.07 o
1 5 1 783.48 1127.92 280.60 o
2 5 1 4556.26 5145.58 384.03 o
3 5 1 5319.03 5545.58 339.46 o
4 5 1 4.58 280.14 198.95 o
5 5 1 343.23 584.51 264.29 o
6 5 1 37.13 -146.98 197.31 o
7 5 1 1.45 -163.31 327.81 o
8 5 1 333.87 371.70 240.61 o
9 5 1 20.51 60.37 316.46 o
10 5 1 212.98 319.38 264.34 o
11 5 1 508.32 456.29 278.08 o
12 5 1 8.25 630.44 295.20 o
13 5 1 336.33 717.32 446.79 o
14 5 1 5.01 230.09 732.55 o
15 5 1 1.00 618.34 691.38 o
1 6 1 203.91 209.22 224.48 o
2 6 1 3446.50 3374.31 378.02 o
3 6 1 355.76 175.69 309.56 o
4 6 1 240.30 504.90 350.98 o
5 6 1 783.90 1222.04 210.12 o
6 6 1 1038.30 1197.97 241.15 o
7 6 1 2.40 210.52 234.05 o
8 6 1 88.03 233.52 317.06 o
9 6 1 2.32 38.34 295.82 o
10 6 1 32.30 163.80 284.31 o
11 6 1 183.81 662.15 316.04 o
12 6 1 50.99 203.57 340.96 o
13 6 1 23.28 48.11 444.17 o
14 6 1 38.88 438.59 633.92 o
15 6 1 12.60 207.47 788.56 o
1 7 1 497.03 392.71 373.70 o
2 7 1 396.09 -180.13 433.23 o
3 7 1 493.75 920.65 391.15 o
4 7 1 12.51 496.83 448.13 o
5 7 1 665.30 936.95 300.86 o
6 7 1 677.87 1206.10 265.13 o
7 7 1 2.42 199.37 269.46 o
8 7 1 165.42 203.91 270.19 o
9 7 1 48.94 -238.85 238.85 o
10 7 1 436.13 537.54 291.39 o
11 7 1 235.39 753.12 320.36 o
12 7 1 60.07 19.40 343.20 o
13 7 1 13.91 1332.70 531.22 o
14 7 1 50.69 256.41 572.38 o
15 7 1 51.16 -24.06 787.18 o
1 8 1 477.71 119.42 268.58 o
2 8 1 878.55 1666.71 595.63 o
3 8 1 32.49 -359.13 359.13 o
4 8 1 999.04 815.25 313.76 o
5 8 1 1797.75 1449.86 344.33 o
6 8 1 2.40 -296.12 296.12 o
7 8 1 36.45 33.50 278.66 o
8 8 1 1.36 5.71 258.42 o
9 8 1 158.09 9.62 272.89 o
10 8 1 388.39 854.08 346.39 o
11 8 1 127.88 205.19 326.68 o
12 8 1 0.79 685.69 415.13 o
13 8 1 10.34 -275.12 344.84 o
14 8 1 12.94 -473.66 797.96 o
15 8 1 25.75 480.83 729.67 o
1 9 1 2126.72 2029.33 464.61 o
2 9 1 506.80 727.65 302.15 o
3 9 1 0.04 -300.28 300.28 o
4 9 1 3.77 -35.18 334.32 o
5 9 1 860.56 1810.24 435.22 o
6 9 1 1032.77 2361.93 379.37 o
7 9 1 2.72 746.00 451.40 o
8 9 1 62.93 -266.38 325.12 o
9 9 1 331.90 329.07 434.67 o
10 9 1 3.01 363.94 334.38 o
11 9 1 3.41 -61.82 316.34 o
12 9 1 0.67 -137.39 366.94 o
13 9 1 18.17 -352.88 367.50 o
14 9 1 2.90 1346.51 650.59 o
1 10 1 41.31 464.77 324.34 o
2 10 1 326.83 -256.35 382.58 o
3 10 1 19.36 634.63 310.26 o
4 10 1 548.01 709.72 333.63 o
5 10 1 110.48 89.34 371.09 o
6 10 1 5.56 -233.08 409.33 o
7 10 1 218.37 77.95 318.96 o
8 10 1 0.33 -49.20 338.88 o
9 10 1 18.80 237.08 316.54 o
10 10 1 169.83 601.39 324.26 o
11 10 1 9.75 -236.73 448.25 o
12 10 1 148.12 767.22 504.66 o
13 10 1 84.60 -542.64 564.47 o
14 10 1 9.92 -755.15 755.15 o
1 11 1 13.58 -111.14 543.41 o
2 11 1 262.23 1201.45 440.09 o
3 11 1 945.92 1115.71 414.28 o
4 11 1 428.25 462.07 722.71 o
5 11 1 94.16 -198.18 325.45 o
6 11 1 27.36 1186.93 429.89 o
7 11 1 230.56 203.28 337.43 o
8 11 1 50.19 350.20 308.01 o
9 11 1 306.62 -59.94 375.39 o
10 11 1 1.15 234.56 373.29 o
11 11 1 20.04 -66.52 288.01 o
12 11 1 29.20 480.68 415.23 o
13 11 1 1.25 -302.88 793.00 o
1 12 1 696.03 755.94 653.11 o
2 12 1 416.54 292.28 446.59 o
3 12 1 354.20 915.94 1063.11 o
4 12 1 114.58 186.75 390.71 o
5 12 1 186.58 212.71 411.02 o
6 12 1 70.06 149.77 523.30 o
7 12 1 130.97 -19.63 259.05 o
8 12 1 873.45 681.20 328.08 o
9 12 1 117.27 8.05 418.79 o
10 12 1 98.89 -442.35 442.35 o
11 12 1 14.58 257.49 399.09 o
12 12 1 35.27 -5.57 680.39 o
13 12 1 24.72 -2.28 422.27 o
1 13 1 7.85 746.12 435.12 o
2 13 1 24.01 -66.67 623.80 o
3 13 1 47.94 657.46 486.04 o
4 13 1 20.16 648.83 564.29 o
5 13 1 77.39 199.12 684.70 o
6 13 1 13.56 735.20 327.54 o
7 13 1 129.57 -37.66 250.14 o
8 13 1 100.71 -1.55 231.17 o
9 13 1 51.44 496.34 482.65 o
10 13 1 1.35 -407.91 407.91 o
11 13 1 16.82 105.00 468.72 o
12 13 1 12.09 1011.18 791.20 o
1 14 1 26.66 220.31 347.44 o
2 14 1 222.64 453.22 438.07 o
3 14 1 33.21 -273.84 500.64 o
4 14 1 23.37 103.98 745.32 o
5 14 1 51.92 -42.97 331.09 o
6 14 1 20.19 -198.76 360.17 o
7 14 1 8.05 195.56 336.49 o
8 14 1 99.36 -147.24 412.97 o
9 14 1 8.53 277.05 403.68 o
10 14 1 17.75 -459.21 459.21 o
11 14 1 12.11 336.03 467.73 o
12 14 1 29.98 -1717.53 1717.53 o
1 15 1 303.50 760.18 565.34 o
2 15 1 361.02 343.09 407.34 o
3 15 1 0.11 230.33 505.25 o
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5 15 1 256.16 -113.76 410.57 o
6 15 1 127.66 146.58 420.97 o
7 15 1 40.57 184.27 404.00 o
8 15 1 17.67 253.78 244.48 o
9 15 1 0.21 -283.48 479.16 o
10 15 1 15.21 -476.25 476.25 o
11 15 1 18.59 -2400.99 2400.99 o
1 16 1 13.83 558.06 468.55 o
2 16 1 600.08 1002.27 514.48 o
3 16 1 16.91 -420.85 420.85 o
4 16 1 77.18 -44.26 384.11 o
5 16 1 39.49 -499.63 543.10 o
6 16 1 3.14 822.25 584.40 o
7 16 1 112.97 -33.76 594.33 o
8 16 1 6.12 61.28 536.32 o
9 16 1 30.97 -99.12 555.91 o
10 16 1 0.54 -1300.59 3338.79 o
1 17 1 15.99 -466.89 466.89 o
2 17 1 40.58 503.17 478.17 o
3 17 1 75.68 -76.97 504.38 o
4 17 1 6.28 367.71 575.02 o
5 17 1 139.88 -240.35 597.32 o
6 17 1 6.20 148.62 713.81 o
7 17 1 4.37 31.27 466.10 o
8 17 1 28.98 1044.80 1082.96 o
9 17 1 9.98 3391.86 2807.60 o
1 18 1 4.67 -171.21 654.36 o
2 18 1 64.40 1371.67 632.70 o
3 18 1 4.32 322.52 574.67 o
4 18 1 5.12 224.54 552.34 o
5 18 1 57.08 -396.26 627.70 o
6 18 1 60.64 -158.00 648.72 o
7 18 1 48.71 838.80 715.00 o
1 19 1 28.55 -176.49 665.87 o
2 19 1 49.60 -208.91 590.11 o
3 19 1 16.07 -631.81 631.81 o
4 19 1 38.41 -636.66 636.66 o
5 19 1 93.26 795.31 690.43 o
6 19 1 24.75 131.19 842.80 o
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1 20 1 15.84 195.03 728.44 o
2 20 1 18.92 -152.20 700.13 o
3 20 1 11.50 265.54 805.37 o
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1 0 2 83698.52 83686.27 2626.11 o
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8 0 2 5849.38 5862.41 307.35 o
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10 0 2 1062.44 862.75 291.14 o
11 0 2 13435.98 13897.12 562.77 o
12 0 2 759.74 462.40 355.27 o
13 0 2 7016.25 7843.15 595.34 o
14 0 2 895.67 131.61 518.09 o
15 0 2 4793.88 4808.63 761.18 o
16 0 2 423.38 1082.09 1251.90 o
0 1 2 64304.78 64445.03 1428.78 o
1 1 2 5423.86 5990.49 210.69 o
2 1 2 59652.59 56613.67 980.46 o
3 1 2 3736.59 3689.75 167.81 o
4 1 2 31384.86 29298.65 510.58 o
5 1 2 6712.30 7020.79 217.96 o
6 1 2 41687.76 43212.22 743.78 o
7 1 2 6087.06 5492.20 206.53 o
8 1 2 29546.21 29856.26 555.31 o
9 1 2 1478.95 1389.04 208.87 o
10 1 2 13339.20 13374.90 372.64 o
11 1 2 1619.43 1310.53 258.24 o
12 1 2 9700.99 9881.66 384.93 o
13 1 2 904.07 747.34 306.96 o
14 1 2 7478.65 7444.36 506.35 o
15 1 2 504.82 234.37 569.45 o
16 1 2 3817.71 4640.67 1034.60 o
0 2 2 6928.81 7097.65 227.80 o
1 2 2 74520.76 72218.59 1215.56 o
2 2 2 10504.03 10223.00 229.73 o
3 2 2 25174.44 23262.84 435.29 o
4 2 2 6315.73 5849.23 201.13 o
5 2 2 47841.23 47713.50 794.53 o
6 2 2 775.31 754.24 165.64 o
7 2 2 46022.95 47071.12 778.67 o
8 2 2 4092.39 3566.87 188.21 o
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