#------------------------------------------------------------------------------
#$Date: 2009-09-11 11:49:26 +0300 (Fri, 11 Sep 2009) $
#$Revision: 819 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2222068.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_2222068_Fobs
loop_
_publ_author_name
'Wen, Yan-Mei'
'Feng, Tian-Jun'
'He, Li-Xin'
_publ_section_title
;
Poly[[aquabis(\m~3~-isonicotinato-\k^3^O:O':N)tris(\m~2~-isonicotinato-\k^3^O,O':N)(nitrato-\kO)bis(\m~4~-oxalato-\k^6^O^1^,O^2^:O^2^:O^1'^,O^2'^:O^1'^)dierbium(III)tetrasilver(I)]
tetrahydrate]
;
_journal_coeditor_code HY2195
_journal_issue 6
_journal_name_full 'Acta Crystallographica Section E'
_journal_page_first m676
_journal_page_last m677
_journal_volume 65
_journal_year 2009
_space_group_IT_number 2
_symmetry_space_group_name_Hall '-P 1'
_symmetry_space_group_name_H-M 'P -1'
_cell_angle_alpha 76.940
_cell_angle_beta 76.612
_cell_angle_gamma 76.035
_cell_length_a 8.8561
_cell_length_b 11.6428
_cell_length_c 11.9597
_exptl_crystal_F_000 808.00
_reflns_d_resolution_high 0.8347
_[local]_cod_data_source_file hy2195Isup2.hkl
_[local]_cod_data_source_block I
#BEGIN Tags that were not found in dictionaries:
_shelx_title ' DD in P-1'
_shelx_refln_list_code 4
_shelx_f_calc_maximum 465.58
_shelx_f_squared_multiplier 1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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
1 0 0 1349.63 1728.07 59.88 o
2 0 0 1922.71 2488.42 177.78 o
3 0 0 5936.02 5886.85 130.68 o
4 0 0 11724.18 12574.13 238.33 o
5 0 0 3242.04 3462.80 124.91 o
6 0 0 60.01 86.06 45.33 o
7 0 0 835.40 788.48 138.92 o
8 0 0 3226.46 3341.40 162.94 o
9 0 0 581.24 616.02 167.10 o
10 0 0 2116.33 2271.00 274.77 o
-9 1 0 2569.75 2481.92 260.90 o
-8 1 0 406.00 214.88 113.16 o
-7 1 0 3469.64 3650.00 154.56 o
-6 1 0 753.51 772.76 102.27 o
-5 1 0 44.44 161.69 93.24 o
-4 1 0 133.54 130.99 31.16 o
-3 1 0 3206.17 3482.88 79.10 o
-2 1 0 7378.73 7270.13 106.82 o
-1 1 0 20018.12 21608.10 289.52 o
0 1 0 16390.16 15297.04 292.82 o
1 1 0 26606.23 28418.64 519.37 o
2 1 0 57.41 97.82 24.66 o
3 1 0 9234.23 10369.76 265.30 o
4 1 0 4692.31 4921.20 133.28 o
5 1 0 1628.26 1743.98 89.41 o
6 1 0 1169.85 1132.92 89.08 o
7 1 0 1708.04 1968.16 164.46 o
8 1 0 8246.71 8532.96 388.70 o
9 1 0 394.33 275.20 95.55 o
-9 2 0 1388.89 1420.72 225.45 o
-8 2 0 1292.94 1286.86 195.73 o
-7 2 0 139.54 152.13 97.53 o
-6 2 0 574.55 452.74 71.33 o
-5 2 0 350.32 358.51 84.65 o
-4 2 0 540.86 409.29 37.20 o
-3 2 0 25608.34 25349.54 303.28 o
-2 2 0 461.31 561.97 28.56 o
-1 2 0 22364.10 22616.56 322.02 o
0 2 0 36564.24 34104.42 437.16 o
1 2 0 27063.86 23643.49 470.93 o
2 2 0 4574.81 4512.94 90.78 o
3 2 0 2947.80 3175.12 91.29 o
4 2 0 7437.94 7979.89 263.98 o
5 2 0 10201.82 11204.08 237.72 o
6 2 0 4325.98 4445.28 153.11 o
7 2 0 6648.73 7108.74 216.69 o
8 2 0 90.31 81.41 58.90 o
9 2 0 6897.99 6669.01 339.49 o
10 2 0 347.60 244.16 128.80 o
-9 3 0 16.96 96.87 130.12 o
-8 3 0 401.43 372.74 138.04 o
-7 3 0 706.27 649.27 143.11 o
-6 3 0 7640.47 6969.31 333.11 o
-5 3 0 1482.01 1658.55 104.00 o
-4 3 0 2937.38 2755.91 84.45 o
-3 3 0 1551.71 1618.83 59.04 o
-2 3 0 51601.48 52402.62 1003.29 o
-1 3 0 14793.34 16534.82 270.17 o
0 3 0 22030.57 20807.86 426.57 o
1 3 0 1427.59 1175.02 81.02 o
2 3 0 2996.84 3161.79 142.67 o
3 3 0 4438.33 4650.58 107.68 o
4 3 0 1969.05 1849.73 189.89 o
5 3 0 5577.11 5686.84 202.55 o
6 3 0 780.48 733.42 61.64 o
7 3 0 996.47 1172.09 198.37 o
8 3 0 6662.73 6955.88 330.69 o
9 3 0 1448.16 1475.76 185.82 o
10 3 0 1050.41 1136.05 187.80 o
-9 4 0 978.03 964.98 216.20 o
-8 4 0 66.57 111.18 111.62 o
-7 4 0 1160.44 869.87 170.41 o
-6 4 0 770.25 670.40 142.23 o
-5 4 0 804.48 816.43 85.63 o
-4 4 0 1921.33 1952.97 108.09 o
-3 4 0 9012.98 9177.13 220.14 o
-2 4 0 34393.46 33143.95 520.69 o
-1 4 0 9014.43 8706.46 186.07 o
0 4 0 89.29 455.67 38.18 o
1 4 0 28156.30 27983.79 389.73 o
2 4 0 12635.42 12652.87 352.48 o
3 4 0 4936.32 5065.11 212.02 o
4 4 0 56.44 96.51 30.56 o
5 4 0 1384.71 1277.62 78.02 o
6 4 0 16373.13 17134.83 409.07 o
7 4 0 11.45 22.02 60.33 o
8 4 0 5342.56 6151.84 317.04 o
9 4 0 3541.72 3630.52 258.69 o
10 4 0 1490.36 1642.21 214.22 o
-8 5 0 21.55 89.83 123.51 o
-7 5 0 529.56 490.53 150.37 o
-6 5 0 1141.06 913.68 163.80 o
-5 5 0 7623.74 7926.51 295.24 o
-4 5 0 302.23 461.84 101.94 o
-3 5 0 2175.01 2217.33 110.36 o
-2 5 0 5987.98 5958.19 170.94 o
-1 5 0 20448.14 20015.37 346.70 o
0 5 0 4503.33 3984.99 116.54 o
1 5 0 2534.13 2496.14 79.25 o
2 5 0 280.12 243.50 66.27 o
3 5 0 6118.20 6009.62 248.13 o
4 5 0 1191.91 846.31 107.00 o
5 5 0 7646.59 7594.80 309.11 o
6 5 0 5911.46 5864.09 285.11 o
7 5 0 2597.89 2527.93 209.82 o
8 5 0 652.69 493.17 128.36 o
9 5 0 7282.83 7260.59 382.43 o
10 5 0 166.79 122.85 118.01 o
-8 6 0 467.02 551.95 177.45 o
-7 6 0 386.12 459.04 150.59 o
-6 6 0 2063.28 1960.57 225.23 o
-5 6 0 1032.71 945.35 170.96 o
-4 6 0 3203.34 3116.02 151.09 o
-3 6 0 87.34 90.20 40.40 o
-2 6 0 14449.59 13516.71 295.69 o
-1 6 0 1829.63 1795.29 94.99 o
0 6 0 3995.26 3913.92 125.10 o
1 6 0 5482.78 6113.73 145.29 o
2 6 0 8357.25 7641.92 297.88 o
3 6 0 6895.45 6410.32 276.53 o
4 6 0 20.76 440.55 93.13 o
5 6 0 3228.67 3181.38 205.85 o
6 6 0 9008.23 9372.63 375.82 o
7 6 0 4326.65 4040.24 255.39 o
8 6 0 4083.12 3122.82 240.20 o
9 6 0 138.40 39.19 80.58 o
-7 7 0 168.55 154.56 138.04 o
-6 7 0 904.30 840.37 180.98 o
-5 7 0 1928.25 2060.20 151.09 o
-4 7 0 3931.35 3801.43 178.49 o
-3 7 0 1726.60 1663.42 119.22 o
-2 7 0 1178.54 1320.09 100.76 o
-1 7 0 6945.72 6642.48 194.48 o
0 7 0 4255.58 4306.60 223.36 o
1 7 0 210.64 469.26 58.89 o
2 7 0 2882.96 2711.55 191.54 o
3 7 0 304.09 524.87 101.28 o
4 7 0 7855.80 8080.26 341.48 o
5 7 0 640.14 594.66 117.35 o
6 7 0 11839.18 11984.67 451.78 o
7 7 0 554.80 388.81 110.52 o
8 7 0 1865.23 1654.54 203.65 o
9 7 0 938.05 792.37 165.78 o
-6 8 0 8.92 107.88 130.56 o
-5 8 0 2364.16 2320.89 169.59 o
-4 8 0 173.96 193.12 65.90 o
-3 8 0 2534.02 2359.13 143.09 o
-2 8 0 1578.08 1730.88 119.77 o
-1 8 0 5218.53 5222.19 181.61 o
0 8 0 1236.13 1319.04 89.15 o
1 8 0 367.55 839.49 129.68 o
2 8 0 307.57 299.20 93.13 o
3 8 0 10969.43 11807.65 439.89 o
4 8 0 6455.23 6645.67 325.62 o
5 8 0 2067.47 2306.45 208.50 o
6 8 0 0.99 45.57 80.14 o
7 8 0 11836.83 10717.62 443.19 o
8 8 0 257.72 365.91 120.21 o
9 8 0 664.32 641.34 166.44 o
-6 9 0 821.86 1058.77 223.03 o
-5 9 0 93.35 153.90 119.55 o
-4 9 0 2888.63 3124.68 186.82 o
-3 9 0 1252.72 1400.09 137.27 o
-2 9 0 1504.68 1770.29 130.22 o
-1 9 0 145.44 407.37 71.25 o
0 9 0 1578.60 1654.98 188.68 o
1 9 0 3323.11 3038.27 230.07 o
2 9 0 1154.13 1086.07 155.88 o
3 9 0 3678.54 3710.66 255.39 o
4 9 0 3465.58 3829.76 263.76 o
5 9 0 2811.48 3041.14 244.38 o
6 9 0 5321.68 5650.09 330.69 o
7 9 0 1074.13 927.59 193.08 o
8 9 0 425.19 402.46 145.75 o
-5 10 0 609.17 553.27 182.96 o
-4 10 0 987.17 1088.52 215.87 o
-3 10 0 554.54 403.02 93.39 o
-2 10 0 425.48 439.09 91.25 o
-1 10 0 381.51 453.10 129.46 o
0 10 0 1839.18 1823.18 214.22 o
1 10 0 555.76 1010.78 164.90 o
2 10 0 852.99 1083.87 169.31 o
3 10 0 216.45 227.65 97.31 o
4 10 0 16752.63 17808.46 626.37 o
5 10 0 1.21 60.33 94.45 o
6 10 0 1093.29 1077.71 189.34 o
7 10 0 2021.48 1797.45 158.71 o
8 10 0 1623.20 1718.39 225.67 o
-4 11 0 118.68 184.81 105.19 o
-3 11 0 1441.75 1536.31 229.19 o
-2 11 0 45.55 77.50 90.27 o
-1 11 0 78.43 294.58 134.30 o
0 11 0 945.52 1196.38 195.95 o
1 11 0 2305.70 2715.95 269.04 o
2 11 0 2634.42 2767.69 263.32 o
3 11 0 3009.74 3090.01 275.43 o
4 11 0 903.38 902.90 174.15 o
5 11 0 4108.80 4306.42 317.48 o
6 11 0 6.04 -18.27 99.51 o
7 11 0 1368.03 1401.13 150.11 o
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-1 12 0 283.90 244.60 138.70 o
0 12 0 473.79 435.93 151.91 o
1 12 0 2623.52 3189.09 306.47 o
2 12 0 187.17 208.72 107.88 o
3 12 0 1918.95 1644.19 227.87 o
4 12 0 2688.68 3287.28 304.27 o
5 12 0 1929.42 1895.18 245.92 o
6 12 0 564.48 343.31 98.44 o
0 13 0 391.08 597.75 185.16 o
1 13 0 14.41 1.32 91.15 o
2 13 0 4811.61 4545.96 358.21 o
3 13 0 4.68 205.85 130.78 o
4 13 0 2210.77 2525.07 294.80 o
-4 -13 1 1542.01 1466.52 244.60 o
-3 -13 1 452.01 508.80 178.99 o
-2 -13 1 856.12 614.70 171.51 o
-1 -13 1 453.85 411.05 156.98 o
0 -13 1 4.12 158.96 126.37 o
-6 -12 1 2037.43 2118.95 177.14 o
-5 -12 1 1174.47 1267.17 145.09 o
-4 -12 1 1219.97 1090.70 199.47 o
-3 -12 1 19.19 -32.80 96.65 o
-2 -12 1 287.18 789.95 181.20 o
-1 -12 1 32.22 -5.06 85.20 o
0 -12 1 2981.15 2742.15 286.43 o
1 -12 1 325.61 346.76 147.29 o
2 -12 1 981.47 767.05 180.09 o
-7 -11 1 4863.98 4252.70 310.43 o
-6 -11 1 548.41 314.05 90.38 o
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-4 -11 1 1026.89 1143.92 121.42 o
-3 -11 1 1897.49 1933.49 231.83 o
-2 -11 1 1350.70 1523.54 210.92 o
-1 -11 1 860.13 936.36 177.23 o
0 -11 1 496.64 452.00 144.43 o
1 -11 1 864.85 926.89 179.43 o
2 -11 1 766.53 899.15 187.58 o
3 -11 1 1527.05 1207.38 215.76 o
4 -11 1 438.20 420.97 119.66 o
-8 -10 1 1787.44 1872.06 239.98 o
-7 -10 1 1203.11 1080.57 179.65 o
-6 -10 1 1581.74 1692.05 143.92 o
-5 -10 1 17.74 449.03 87.52 o
-4 -10 1 2103.68 2286.99 146.91 o
-3 -10 1 2182.24 2261.31 229.63 o
-2 -10 1 578.84 556.80 136.06 o
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0 -10 1 313.81 276.97 105.02 o
1 -10 1 5756.42 6412.96 364.59 o
2 -10 1 77.89 151.01 63.63 o
3 -10 1 1000.09 1175.70 132.46 o
4 -10 1 873.32 858.06 123.41 o
5 -10 1 867.78 805.15 139.53 o
-8 -9 1 3445.38 4048.17 304.93 o
-7 -9 1 1872.59 1723.89 210.26 o
-6 -9 1 5606.08 5338.40 221.50 o
-5 -9 1 1.63 -4.96 47.71 o
-4 -9 1 131.09 933.28 145.97 o
-3 -9 1 250.48 312.41 106.78 o
-2 -9 1 3877.41 4261.73 268.82 o
-1 -9 1 2303.56 2282.23 210.70 o
0 -9 1 4054.92 4213.73 269.92 o
1 -9 1 512.03 521.38 74.55 o
2 -9 1 4467.94 4392.44 187.71 o
3 -9 1 7.31 152.69 77.61 o
4 -9 1 2387.34 2584.83 174.58 o
5 -9 1 99.19 6.12 80.60 o
6 -9 1 267.38 207.40 151.47 o
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-5 -8 1 471.49 687.27 91.37 o
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0 -8 1 664.99 677.55 70.79 o
1 -8 1 9363.68 9028.07 243.80 o
2 -8 1 5186.61 5154.40 205.63 o
3 -8 1 302.62 466.65 83.26 o
4 -8 1 108.19 403.09 82.35 o
5 -8 1 381.00 564.66 105.42 o
6 -8 1 642.80 441.87 164.90 o
-9 -7 1 4145.76 3463.63 298.76 o
-8 -7 1 1774.12 1551.50 207.84 o
-7 -7 1 288.99 548.21 125.05 o
-6 -7 1 4843.82 4568.81 185.86 o
-5 -7 1 3059.61 3045.26 144.20 o
-4 -7 1 2173.92 2075.05 174.59 o
-3 -7 1 2106.86 2178.75 167.99 o
-2 -7 1 387.65 475.56 93.35 o
-1 -7 1 19842.36 19738.96 613.60 o
0 -7 1 227.69 230.97 94.78 o
1 -7 1 8324.83 7737.46 210.59 o
2 -7 1 577.91 504.96 70.99 o
3 -7 1 3588.21 3564.57 161.83 o
4 -7 1 397.56 400.28 79.49 o
5 -7 1 962.16 871.83 110.72 o
6 -7 1 126.44 141.13 117.79 o
7 -7 1 603.32 398.94 148.17 o
-9 -6 1 554.59 449.58 140.69 o
-8 -6 1 6753.68 6923.74 368.12 o
-7 -6 1 114.57 306.69 105.68 o
-6 -6 1 344.03 291.23 59.24 o
-5 -6 1 48.43 104.81 43.18 o
-4 -6 1 712.73 945.83 116.91 o
-3 -6 1 2311.84 2092.23 155.00 o
-2 -6 1 19082.25 17800.32 494.05 o
-1 -6 1 13359.94 13372.23 588.28 o
0 -6 1 9729.07 9502.22 211.64 o
1 -6 1 396.38 472.15 56.71 o
2 -6 1 15403.62 15764.16 329.04 o
3 -6 1 983.25 1013.73 119.66 o
4 -6 1 41.33 213.38 81.79 o
5 -6 1 6.71 35.98 65.17 o
6 -6 1 2247.10 2232.25 235.14 o
7 -6 1 1652.87 1594.21 222.37 o
8 -6 1 363.31 468.51 178.11 o
-9 -5 1 6028.13 5874.21 350.06 o
-8 -5 1 2622.33 2593.10 236.24 o
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-6 -5 1 1343.37 1141.99 139.36 o
-5 -5 1 1812.03 1666.39 101.89 o
-4 -5 1 15983.94 14941.91 300.15 o
-3 -5 1 169.56 555.04 83.22 o
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-1 -5 1 19616.82 19368.45 310.15 o
0 -5 1 22790.13 20910.65 343.21 o
1 -5 1 4672.93 4609.99 139.92 o
2 -5 1 3130.49 2884.26 119.23 o
3 -5 1 182.64 143.61 60.88 o
4 -5 1 223.83 192.60 50.53 o
5 -5 1 49.53 8.55 40.96 o
6 -5 1 4119.70 3797.76 300.75 o
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8 -5 1 766.31 525.31 157.42 o
-10 -4 1 190.39 217.30 124.39 o
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-5 -4 1 971.18 885.66 58.06 o
-4 -4 1 4091.35 4220.41 102.07 o
-3 -4 1 13400.24 11439.10 328.49 o
-2 -4 1 35.51 108.10 40.51 o
-1 -4 1 27273.60 25446.43 367.41 o
0 -4 1 700.88 863.43 52.74 o
1 -4 1 3574.56 3789.66 124.39 o
2 -4 1 12435.73 12601.24 256.15 o
3 -4 1 2824.57 2756.08 230.40 o
4 -4 1 1915.85 1904.75 110.58 o
5 -4 1 155.71 128.91 50.61 o
6 -4 1 451.19 600.57 89.84 o
7 -4 1 5259.92 4739.71 307.79 o
8 -4 1 431.06 382.87 141.57 o
9 -4 1 631.77 720.16 204.09 o
-10 -3 1 2382.35 1757.35 223.69 o
-9 -3 1 300.74 224.79 106.78 o
-8 -3 1 3946.66 3485.65 242.18 o
-7 -3 1 309.66 311.09 98.41 o
-6 -3 1 55.13 65.30 45.53 o
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-4 -3 1 14384.77 14955.34 219.72 o
-3 -3 1 64707.94 65466.92 677.20 o
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0 -3 1 20467.21 21416.56 339.38 o
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3 -3 1 138.19 234.76 42.57 o
4 -3 1 494.85 455.35 38.49 o
5 -3 1 4823.48 4262.44 161.61 o
6 -3 1 2701.09 2695.48 209.82 o
7 -3 1 5637.51 4966.70 299.86 o
8 -3 1 783.49 755.83 169.75 o
9 -3 1 418.51 271.90 153.23 o
-10 -2 1 1450.48 1307.12 199.25 o
-9 -2 1 195.45 231.61 101.72 o
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-3 -2 1 197.75 218.40 26.03 o
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0 -2 1 7067.18 7818.03 105.10 o
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2 -2 1 9484.67 9768.59 190.77 o
3 -2 1 1860.37 2316.43 61.28 o
4 -2 1 12147.83 11533.62 182.04 o
5 -2 1 2474.75 2396.51 102.93 o
6 -2 1 3304.24 2980.81 209.16 o
7 -2 1 482.24 322.54 112.72 o
8 -2 1 5729.22 5437.85 328.49 o
9 -2 1 0.19 -74.64 105.90 o
-9 -1 1 496.43 474.38 104.47 o
-8 -1 1 784.73 735.17 101.56 o
-7 -1 1 2123.95 2108.31 194.19 o
-6 -1 1 3839.44 4162.42 154.97 o
-5 -1 1 3337.55 3838.54 135.41 o
-4 -1 1 1.08 27.05 20.26 o
-3 -1 1 39896.57 41629.51 451.51 o
-2 -1 1 5099.96 5558.98 107.62 o
-1 -1 1 10645.33 9610.34 128.00 o
0 -1 1 6105.38 7809.50 170.51 o
1 -1 1 16650.38 17397.72 250.48 o
2 -1 1 2222.67 2006.17 69.75 o
3 -1 1 87.45 164.47 23.05 o
4 -1 1 4028.52 3775.50 200.79 o
5 -1 1 5319.70 5378.67 151.55 o
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7 -1 1 8008.45 9072.11 381.55 o
8 -1 1 1136.33 847.85 160.94 o
9 -1 1 1006.11 770.14 181.86 o
10 -1 1 87.31 16.73 136.94 o
-9 0 1 1287.01 1251.20 203.21 o
-8 0 1 393.66 426.39 122.19 o
-7 0 1 171.68 183.93 62.86 o
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-4 0 1 10988.81 11850.00 236.17 o
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