#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/58/2205844.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_2205844_Fobs
loop_
_publ_author_name
'Il'in, Maxim A.'
'Kuratieva, Natalia V.'
'Kirichenko, Olga A.'
'Baidina, Iraida A.'
'Naumov, Dmitry Yu.'
'Korolkow, Ilya V.'
'Emel'yanov, Vyacheslav A.'
_publ_section_title
;
 Tetraamminehydroxonitrosylruthenium(III) tetranitropalladate(II)
 monohydrate
;
_journal_issue                   6
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i126
_journal_page_last               i128
_journal_volume                  61
_journal_year                    2005
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                100.147
_cell_angle_beta                 115.390
_cell_angle_gamma                108.728
_cell_length_a                   9.0710
_cell_length_b                   10.0861
_cell_length_c                   10.1864
_exptl_crystal_F_000             492.00
_reflns_d_resolution_high        0.8200
_[local]_cod_data_source_file    ac6171Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     'Max41 in P-1'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            204.48
_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 0 727.32 772.42 7.97 o
2 0 0 21659.91 21760.91 209.33 o
3 0 0 1181.57 1221.64 15.79 o
4 0 0 17881.57 18251.05 263.89 o
5 0 0 1.66 0.00 3.05 o
6 0 0 6364.50 6372.80 84.41 o
7 0 0 48.26 32.06 8.76 o
8 0 0 3252.03 3373.01 78.17 o
-9 1 0 168.77 171.36 18.28 o
-8 1 0 149.25 147.32 15.19 o
-7 1 0 1065.09 1028.30 33.47 o
-6 1 0 117.76 102.35 12.97 o
-5 1 0 866.97 843.58 17.67 o
-4 1 0 761.92 738.32 14.98 o
-3 1 0 342.95 346.56 6.95 o
-2 1 0 6380.29 6477.88 78.53 o
-1 1 0 1474.73 1498.03 16.17 o
0 1 0 1487.32 1439.41 24.37 o
1 1 0 5739.41 6000.80 52.41 o
2 1 0 2019.02 2120.93 27.92 o
3 1 0 898.93 852.46 14.32 o
4 1 0 33.49 25.57 3.02 o
5 1 0 0.43 0.40 3.15 o
6 1 0 684.33 649.24 23.43 o
7 1 0 22.25 33.03 9.16 o
8 1 0 118.76 83.99 13.65 o
-9 2 0 1213.44 1176.10 42.19 o
-8 2 0 1.51 0.84 8.50 o
-7 2 0 2136.85 2096.03 37.32 o
-6 2 0 1293.46 1246.39 52.94 o
-5 2 0 10982.74 11345.60 140.91 o
-4 2 0 1400.76 1441.16 23.92 o
-3 2 0 12862.77 12569.86 151.35 o
-2 2 0 651.49 637.07 10.06 o
-1 2 0 17848.37 17837.37 172.30 o
0 2 0 1315.14 1391.27 13.15 o
1 2 0 32525.40 32669.99 325.65 o
2 2 0 633.47 701.39 9.14 o
3 2 0 10740.25 10984.24 130.58 o
4 2 0 901.14 873.49 15.89 o
5 2 0 4200.57 4091.93 80.02 o
6 2 0 99.50 89.75 10.13 o
7 2 0 2089.89 2136.09 53.73 o
8 2 0 1.82 5.15 10.75 o
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-8 3 0 677.54 653.68 20.41 o
-7 3 0 2767.76 2689.91 44.78 o
-6 3 0 1597.69 1550.04 28.95 o
-5 3 0 2879.86 2838.74 57.91 o
-4 3 0 2445.54 2256.73 34.08 o
-3 3 0 6977.92 7084.90 88.67 o
-2 3 0 5059.34 4960.13 51.16 o
-1 3 0 2523.43 2563.54 27.42 o
0 3 0 963.75 904.89 10.80 o
1 3 0 24162.90 24682.50 292.55 o
2 3 0 6557.53 6694.72 81.70 o
3 3 0 4533.28 4503.14 57.56 o
4 3 0 596.64 562.17 12.92 o
5 3 0 1896.51 1882.02 43.42 o
6 3 0 680.66 683.51 24.71 o
7 3 0 547.96 528.97 24.62 o
-9 4 0 1893.56 1975.70 57.87 o
-8 4 0 258.66 249.93 13.61 o
-7 4 0 1738.28 1692.08 35.03 o
-6 4 0 438.48 417.87 13.89 o
-5 4 0 4028.80 4100.74 58.00 o
-4 4 0 1087.89 1089.85 20.49 o
-3 4 0 3605.39 3507.36 47.77 o
-2 4 0 4873.38 4953.41 51.55 o
-1 4 0 11839.97 11644.08 139.29 o
0 4 0 7569.67 7905.69 78.08 o
1 4 0 7613.66 7679.04 93.22 o
2 4 0 3019.40 3036.60 39.67 o
3 4 0 5252.03 5265.45 104.00 o
4 4 0 1337.90 1341.76 34.09 o
5 4 0 1150.30 1128.18 31.05 o
6 4 0 639.66 634.53 24.66 o
-9 5 0 565.23 548.21 21.62 o
-8 5 0 163.65 167.77 19.66 o
-7 5 0 2089.21 2006.61 50.71 o
-6 5 0 613.39 589.78 16.72 o
-5 5 0 520.41 526.04 14.56 o
-4 5 0 2961.44 2921.47 53.71 o
-3 5 0 2750.13 2671.68 38.71 o
-2 5 0 3834.24 3834.05 41.62 o
-1 5 0 1057.62 1014.85 16.45 o
0 5 0 2018.30 2046.89 31.20 o
1 5 0 1003.96 992.66 16.29 o
2 5 0 1172.60 1174.39 18.72 o
3 5 0 5033.82 5275.02 147.16 o
4 5 0 928.46 867.95 24.57 o
5 5 0 572.25 545.62 20.88 o
6 5 0 403.31 351.05 18.98 o
-9 6 0 132.95 104.67 11.97 o
-8 6 0 2018.97 2085.40 40.93 o
-7 6 0 0.70 2.11 5.78 o
-6 6 0 7334.04 7216.79 97.50 o
-5 6 0 453.21 463.37 14.29 o
-4 6 0 8797.58 8857.00 112.85 o
-3 6 0 847.50 903.70 18.11 o
-2 6 0 10102.95 10418.32 170.09 o
-1 6 0 85.74 78.67 3.94 o
0 6 0 7489.58 7473.44 102.81 o
1 6 0 704.19 712.03 15.08 o
2 6 0 6624.80 6857.10 118.84 o
3 6 0 1.21 0.00 5.20 o
4 6 0 6763.85 6798.66 123.62 o
5 6 0 9.69 18.14 8.32 o
-9 7 0 79.85 71.20 10.94 o
-8 7 0 113.83 93.53 31.62 o
-7 7 0 29.15 19.14 6.70 o
-6 7 0 21.33 15.31 5.93 o
-5 7 0 590.89 588.84 16.87 o
-4 7 0 482.97 469.09 25.92 o
-3 7 0 477.76 429.50 13.90 o
-2 7 0 313.38 298.72 8.38 o
-1 7 0 427.64 433.90 13.89 o
0 7 0 34.24 36.56 4.50 o
1 7 0 8.13 10.83 4.08 o
2 7 0 1.36 25.06 6.47 o
3 7 0 5.61 1.41 6.39 o
4 7 0 9.78 4.76 7.66 o
-9 8 0 3052.18 3209.41 58.30 o
-8 8 0 0.16 0.37 7.79 o
-7 8 0 3213.04 3312.49 55.33 o
-6 8 0 3.38 2.04 5.50 o
-5 8 0 4076.57 4260.71 104.75 o
-4 8 0 121.06 113.46 8.11 o
-3 8 0 7934.84 8115.72 103.94 o
-2 8 0 274.99 271.55 14.62 o
-1 8 0 6119.99 6311.44 116.00 o
0 8 0 140.39 135.38 10.66 o
1 8 0 5678.08 6080.31 110.89 o
2 8 0 209.14 205.23 12.99 o
3 8 0 2832.70 2788.16 57.83 o
-9 9 0 992.04 980.73 29.94 o
-8 9 0 2924.85 2907.62 123.36 o
-7 9 0 270.04 265.31 15.51 o
-6 9 0 941.78 891.90 23.93 o
-5 9 0 801.00 808.58 30.56 o
-4 9 0 1118.80 1143.60 35.28 o
-3 9 0 985.89 982.81 31.05 o
-2 9 0 951.91 916.00 28.67 o
-1 9 0 423.88 421.95 18.23 o
0 9 0 650.15 694.34 23.12 o
1 9 0 373.50 341.71 16.29 o
2 9 0 313.12 310.49 15.72 o
-8 10 0 640.87 656.03 33.60 o
-7 10 0 1073.78 1064.02 40.78 o
-6 10 0 1060.95 1060.58 38.84 o
-5 10 0 789.22 793.08 31.40 o
-4 10 0 2432.31 2330.89 58.05 o
-3 10 0 694.03 717.20 27.48 o
-2 10 0 1221.80 1218.07 35.80 o
-1 10 0 732.06 727.46 25.81 o
0 10 0 2049.56 2137.99 49.46 o
1 10 0 494.81 477.88 19.86 o
-7 11 0 1233.77 1125.85 42.81 o
-6 11 0 1050.67 1094.14 40.34 o
-5 11 0 435.09 396.89 23.96 o
-4 11 0 998.73 978.98 35.19 o
-3 11 0 567.54 632.51 26.91 o
-2 11 0 1731.35 1716.04 46.55 o
-1 11 0 398.66 448.60 21.71 o
-5 12 0 28.62 17.70 11.63 o
-4 12 0 1370.70 1468.18 46.95 o
3 -12 1 436.21 422.70 23.74 o
4 -12 1 278.87 288.73 21.36 o
5 -12 1 597.24 566.01 29.37 o
0 -11 1 975.19 887.46 26.78 o
1 -11 1 253.54 242.57 16.29 o
2 -11 1 2027.63 2061.53 51.35 o
3 -11 1 597.99 562.09 25.41 o
4 -11 1 1608.70 1759.55 49.77 o
5 -11 1 1105.27 1100.26 39.06 o
6 -11 1 2765.22 2849.24 73.37 o
7 -11 1 496.23 419.27 27.22 o
-1 -10 1 457.19 476.74 17.48 o
0 -10 1 2044.74 2146.40 47.61 o
1 -10 1 837.76 888.56 27.61 o
2 -10 1 1844.09 1844.06 45.85 o
3 -10 1 628.05 618.55 24.79 o
4 -10 1 3370.05 3448.32 77.11 o
5 -10 1 626.08 636.56 28.19 o
6 -10 1 371.11 357.56 22.72 o
7 -10 1 904.50 920.18 37.79 o
8 -10 1 824.43 973.60 42.15 o
-3 -9 1 27.22 30.52 6.52 o
-2 -9 1 1333.39 1383.97 31.14 o
-1 -9 1 19.83 21.93 6.56 o
0 -9 1 3302.08 3592.91 70.24 o
1 -9 1 139.04 138.20 11.41 o
2 -9 1 3946.82 4200.89 83.72 o
3 -9 1 49.00 46.51 8.54 o
4 -9 1 1763.42 1832.92 47.87 o
5 -9 1 27.57 13.48 8.15 o
6 -9 1 4013.83 4085.92 63.99 o
7 -9 1 402.25 403.26 18.34 o
8 -9 1 1903.99 1903.10 41.40 o
-4 -8 1 153.04 137.63 11.10 o
-3 -8 1 140.47 149.56 10.39 o
-2 -8 1 3.87 5.46 5.15 o
-1 -8 1 345.48 369.32 10.47 o
0 -8 1 18.13 21.73 4.33 o
1 -8 1 99.98 105.74 6.74 o
2 -8 1 914.23 949.75 15.62 o
3 -8 1 332.32 315.54 11.58 o
4 -8 1 352.88 299.76 16.85 o
5 -8 1 877.10 851.28 21.36 o
6 -8 1 77.45 58.74 8.18 o
7 -8 1 72.05 70.94 9.49 o
8 -8 1 207.27 219.59 14.81 o
9 -8 1 88.67 111.79 13.53 o
-5 -7 1 3846.37 3749.47 72.45 o
-4 -7 1 60.33 64.34 8.02 o
-3 -7 1 6712.38 7250.13 89.36 o
-2 -7 1 111.68 110.78 5.97 o
-1 -7 1 2801.64 2976.28 108.58 o
0 -7 1 654.71 622.27 12.80 o
1 -7 1 9083.14 9290.65 114.58 o
2 -7 1 10.01 3.10 3.00 o
3 -7 1 11410.27 11823.17 146.25 o
4 -7 1 492.68 497.81 14.49 o
5 -7 1 10374.51 10773.96 175.52 o
6 -7 1 88.97 84.24 8.37 o
7 -7 1 5681.99 5719.79 119.42 o
8 -7 1 52.28 43.93 9.54 o
9 -7 1 2813.42 2993.99 55.97 o
-6 -6 1 183.06 158.68 12.73 o
-5 -6 1 303.21 259.22 13.78 o
-4 -6 1 2090.96 2038.24 42.15 o
-3 -6 1 1.43 8.83 3.28 o
-2 -6 1 1202.73 1186.73 17.81 o
-1 -6 1 3.80 4.91 2.43 o
0 -6 1 513.64 512.01 10.41 o
1 -6 1 502.57 502.26 10.03 o
2 -6 1 305.73 298.19 13.23 o
3 -6 1 735.88 743.39 16.27 o
4 -6 1 515.69 465.10 14.47 o
5 -6 1 112.04 109.53 7.84 o
6 -6 1 320.52 328.16 13.53 o
7 -6 1 237.86 201.24 12.18 o
8 -6 1 780.60 782.98 23.88 o
9 -6 1 31.03 27.83 9.86 o
-6 -5 1 1826.89 1880.75 44.17 o
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-4 -5 1 4299.54 4454.29 87.64 o
-3 -5 1 255.61 262.67 6.94 o
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-1 -5 1 803.98 844.84 20.59 o
0 -5 1 10641.91 10818.06 129.53 o
1 -5 1 2222.41 2208.20 30.28 o
2 -5 1 2586.93 2504.10 29.08 o
3 -5 1 142.71 147.51 7.06 o
4 -5 1 4548.35 4525.05 88.87 o
5 -5 1 69.19 56.87 6.02 o
6 -5 1 3765.66 3778.37 93.63 o
7 -5 1 27.84 28.13 7.03 o
8 -5 1 1624.05 1611.25 35.17 o
9 -5 1 209.96 163.13 18.85 o
-7 -4 1 1241.55 1222.30 36.03 o
-6 -4 1 874.77 876.54 27.00 o
-5 -4 1 2280.16 2281.96 48.18 o
-4 -4 1 1821.04 1807.90 34.40 o
-3 -4 1 2618.00 2614.11 38.12 o
-2 -4 1 5183.10 5116.83 72.40 o
-1 -4 1 7238.32 7303.94 90.18 o
0 -4 1 1064.20 1021.08 32.35 o
1 -4 1 1217.36 1298.98 62.78 o
2 -4 1 1329.54 1284.31 16.99 o
3 -4 1 4352.27 4372.84 58.48 o
4 -4 1 3751.09 3788.78 53.41 o
5 -4 1 642.15 631.38 16.24 o
6 -4 1 2262.56 2276.29 38.99 o
7 -4 1 896.42 873.51 22.72 o
8 -4 1 1689.72 1671.86 35.51 o
9 -4 1 1153.34 1123.12 43.25 o
-8 -3 1 1639.89 1710.35 47.78 o
-7 -3 1 169.01 154.27 13.61 o
-6 -3 1 3284.11 3317.17 68.44 o
-5 -3 1 1933.28 1938.68 29.99 o
-4 -3 1 4611.20 4647.86 65.40 o
-3 -3 1 832.78 832.44 13.22 o
-2 -3 1 4990.18 4892.17 73.79 o
0 -3 1 7256.58 7430.58 99.81 o
1 -3 1 942.91 886.05 11.36 o
2 -3 1 1270.41 1215.94 15.79 o
3 -3 1 2208.15 2220.79 32.81 o
4 -3 1 8142.45 8208.60 104.12 o
5 -3 1 626.51 608.98 15.68 o
6 -3 1 3498.16 3627.21 55.93 o
7 -3 1 668.96 662.74 20.83 o
8 -3 1 1046.97 1022.53 37.43 o
9 -3 1 147.30 128.33 17.97 o
-8 -2 1 481.54 452.91 23.17 o
-7 -2 1 426.67 427.19 20.57 o
-6 -2 1 1106.50 1069.17 30.17 o
-5 -2 1 623.37 603.54 21.10 o
-4 -2 1 2380.19 2356.70 64.34 o
-3 -2 1 1097.61 1059.93 26.12 o
-2 -2 1 8614.01 8760.81 106.81 o
0 -2 1 5032.84 5293.87 46.22 o
1 -2 1 7203.55 7506.72 74.08 o
2 -2 1 2043.20 2039.34 28.73 o
3 -2 1 160.71 188.70 10.75 o
4 -2 1 1085.05 973.08 18.98 o
5 -2 1 885.45 900.42 19.57 o
6 -2 1 1025.60 1009.08 22.46 o
7 -2 1 291.22 256.20 13.39 o
8 -2 1 994.30 902.56 34.79 o
9 -2 1 143.99 146.21 18.59 o
-8 -1 1 46.20 31.00 10.22 o
-7 -1 1 6299.90 6230.36 119.97 o
-6 -1 1 4.70 2.95 5.24 o
-5 -1 1 7638.19 7487.79 108.39 o
-4 -1 1 224.20 217.83 6.88 o
-3 -1 1 13118.32 12689.35 314.00 o
-2 -1 1 95.84 65.28 2.80 o
-1 -1 1 32170.21 29486.93 406.85 o
0 -1 1 88.57 90.65 1.89 o
1 -1 1 27866.80 27200.95 260.72 o
2 -1 1 1088.66 1055.76 15.42 o
3 -1 1 2592.19 2437.29 34.91 o
4 -1 1 566.81 592.73 13.95 o
5 -1 1 8458.88 8525.57 109.02 o
6 -1 1 29.39 34.24 6.16 o
7 -1 1 4227.53 4237.00 90.99 o
8 -1 1 3.12 0.09 9.42 o
-9 0 1 428.03 405.17 24.13 o
-8 0 1 19.11 12.42 8.46 o
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-6 0 1 513.43 547.27 12.07 o
-5 0 1 952.85 918.29 25.52 o
-4 0 1 428.55 463.56 8.71 o
-3 0 1 148.07 149.59 4.14 o
-2 0 1 44.92 49.32 2.09 o
-1 0 1 399.66 426.47 4.94 o
0 0 1 202.79 186.70 6.56 o
1 0 1 1355.57 1408.90 16.01 o
2 0 1 4.93 7.58 1.65 o
3 0 1 237.53 241.81 6.31 o
4 0 1 41.73 32.60 3.59 o
5 0 1 291.66 260.31 10.33 o
6 0 1 71.38 61.57 9.69 o
7 0 1 54.44 43.69 10.17 o
8 0 1 53.69 67.38 12.73 o
-9 1 1 7.64 1.50 9.64 o
-8 1 1 2041.32 2008.20 53.11 o
-7 1 1 12.64 17.88 9.20 o
-6 1 1 10305.36 10584.12 132.67 o
-5 1 1 79.20 70.93 12.13 o
-4 1 1 12912.87 13147.09 129.54 o
-3 1 1 1796.97 1806.71 21.22 o
-2 1 1 19264.42 18593.17 207.61 o
-1 1 1 115.66 147.96 2.47 o
0 1 1 28899.25 27706.24 231.17 o
1 1 1 1942.85 1898.30 21.00 o
2 1 1 20302.04 20699.23 308.66 o
3 1 1 741.81 728.16 11.77 o
4 1 1 3044.82 2950.41 46.15 o
5 1 1 597.63 548.79 14.75 o
6 1 1 3573.26 3578.20 76.76 o
7 1 1 20.43 18.14 9.34 o
8 1 1 2505.54 2551.92 66.90 o
-9 2 1 74.28 59.10 12.86 o
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-5 2 1 2220.87 2238.14 34.72 o
-4 2 1 1443.51 1389.20 23.01 o
-3 2 1 12749.75 12617.20 151.84 o
-2 2 1 1911.31 1801.74 20.87 o
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1 2 1 5920.96 5943.26 87.09 o
2 2 1 5269.46 5154.90 64.79 o
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4 2 1 640.77 672.94 12.51 o
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6 2 1 743.41 728.25 27.22 o
7 2 1 1198.04 1174.69 38.84 o
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-9 3 1 2306.63 2373.60 63.81 o
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0 3 1 14794.94 14958.35 177.89 o
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4 3 1 2138.91 2084.13 46.64 o
5 3 1 629.04 642.42 23.78 o
6 3 1 949.87 973.51 32.85 o
7 3 1 694.74 741.07 31.22 o
-10 4 1 423.02 451.85 28.19 o
-9 4 1 1232.21 1259.91 43.95 o
-8 4 1 927.73 938.81 24.02 o
-7 4 1 502.96 471.70 15.57 o
-6 4 1 1331.65 1247.85 25.04 o
-5 4 1 3928.75 3734.35 53.49 o
-4 4 1 3567.02 3666.44 51.12 o
-3 4 1 515.64 470.40 19.55 o
-2 4 1 1842.97 1813.70 22.10 o
-1 4 1 5445.71 5561.59 49.51 o
0 4 1 1447.20 1395.45 19.68 o
1 4 1 3426.39 3395.06 45.20 o
2 4 1 479.32 471.83 11.25 o
3 4 1 3137.78 3147.20 44.42 o
4 4 1 1226.07 1148.93 31.31 o
5 4 1 1574.43 1583.25 41.79 o
6 4 1 55.37 37.57 10.53 o
-10 5 1 7.23 2.07 11.89 o
-9 5 1 2795.65 2909.76 52.27 o
-8 5 1 503.77 488.87 17.80 o
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-6 5 1 8.00 3.71 4.32 o
-5 5 1 6392.98 6396.21 103.05 o
-4 5 1 379.65 360.44 11.17 o
-3 5 1 14045.65 14002.15 170.00 o
-2 5 1 106.40 110.32 9.45 o
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0 5 1 93.20 86.77 5.18 o
1 5 1 10588.23 10885.92 132.82 o
2 5 1 98.77 105.63 6.25 o
3 5 1 5302.82 5372.94 100.54 o
4 5 1 100.77 79.40 9.69 o
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