#------------------------------------------------------------------------------
#$Date: 2009-05-03 21:56:13 +0300 (Sun, 03 May 2009) $
#$Revision: 691 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2220280.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_2220280_Fobs
loop_
_publ_author_name
'Quan, Li'
'Yin, Handong'
'Wang, Daqi'
_publ_section_title
;
 Bis(5-bromopyridine-2-carboxylato-\k<i>O</i>)triphenylantimony(V)
;
_journal_coeditor_code           LX2073
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1503
_journal_volume                  64
_journal_year                    2008
_space_group_IT_number           43
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   20.5970
_cell_length_b                   13.0570
_cell_length_c                   20.5410
_exptl_crystal_F_000             2944.00
_reflns_d_resolution_high        0.8107
_[local]_cod_data_source_file    lx2073Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' 080329G                IN FDD2'
_shelx_refln_list_code           4
_shelx_F_calc_maximum            1106.01
_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'
'-x+1/4, y+1/4, z+1/4'
'x+3/4, -y+3/4, z+1/4'
'x, y+1/2, z+1/2'
'-x, -y+1/2, z+1/2'
'-x+1/4, y+3/4, z+3/4'
'x+3/4, -y+5/4, z+3/4'
'x+1/2, y, z+1/2'
'-x+1/2, -y, z+1/2'
'-x+3/4, y+1/4, z+3/4'
'x+5/4, -y+3/4, z+3/4'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, z'
'-x+3/4, y+3/4, z+1/4'
'x+5/4, -y+5/4, z+1/4'
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
0 4 -24 1606.14 2149.17 1387.55 o
2 4 -24 27.37 662.61 1349.47 o
4 4 -24 1999.72 2690.05 1456.09 o
1 3 -23 1323.64 2641.81 1319.00 o
3 3 -23 1700.84 1883.87 1372.32 o
1 5 -23 971.62 1866.12 1255.53 o
3 5 -23 1827.94 1391.36 1385.01 o
5 5 -23 1154.94 808.72 1456.09 o
7 5 -23 773.94 1067.67 1475.14 o
2 2 -22 204.34 305.94 1194.58 o
4 2 -22 4064.87 3722.05 1251.73 o
2 4 -22 3540.26 4709.74 1412.94 o
4 4 -22 21.28 -413.81 1217.45 o
6 4 -22 3150.54 2745.90 1476.40 o
8 4 -22 75.98 10.15 1377.39 o
0 6 -22 4480.63 3469.44 1557.64 o
2 6 -22 60.89 -975.26 949.24 o
4 6 -22 4331.05 2498.37 1532.26 o
6 6 -22 19.65 -469.67 1405.32 o
8 6 -22 2062.59 1996.85 1783.59 o
3 1 -21 4219.31 6972.02 1315.19 o
1 3 -21 2477.42 3589.92 889.13 o
3 3 -21 1974.49 3727.12 1273.31 o
5 3 -21 2260.54 2796.68 1313.93 o
7 3 -21 2557.17 2880.46 1254.26 o
1 5 -21 2935.12 3626.49 1023.18 o
3 5 -21 2114.37 2187.57 962.73 o
5 5 -21 2954.55 4546.00 1447.21 o
7 5 -21 2217.18 2067.93 1448.48 o
9 5 -21 1205.03 1900.37 1503.06 o
11 5 -21 1331.59 -40.62 1555.11 o
1 7 -21 2115.47 388.76 1003.11 o
3 7 -21 2963.39 3320.43 1160.12 o
5 7 -21 2272.59 -484.90 1561.45 o
7 7 -21 1703.09 656.26 1730.28 o
2 2 -20 6520.31 7058.33 1345.66 o
4 2 -20 48.08 402.43 1109.52 o
6 2 -20 6283.60 6603.77 1321.54 o
0 4 -20 3276.37 3823.72 1313.93 o
2 4 -20 217.12 248.62 812.32 o
4 4 -20 5715.63 5621.28 1345.66 o
6 4 -20 1.92 851.87 1286.00 o
10 4 -20 900.55 1958.77 1426.90 o
4 6 -20 37.59 -339.72 938.51 o
6 6 -20 4089.83 2700.20 1619.84 o
8 6 -20 63.51 -995.31 1560.18 o
10 6 -20 2326.29 5802.80 2001.92 o
12 6 -20 38.86 -1403.92 1716.19 o
0 8 -20 4000.69 2377.78 1666.81 o
2 8 -20 21.71 -1006.92 1062.15 o
4 8 -20 3601.68 2168.47 1184.55 o
6 8 -20 20.90 -2439.10 1626.06 o
8 8 -20 3804.63 2017.16 1958.77 o
1 1 -19 4447.80 5171.80 1075.28 o
3 1 -19 6314.59 8410.34 1270.77 o
5 1 -19 11982.68 14022.73 1393.77 o
1 3 -19 4232.83 4807.99 858.18 o
3 3 -19 1337.69 1355.81 1063.86 o
5 3 -19 1593.36 2554.23 1170.49 o
7 3 -19 4711.67 4830.33 1311.39 o
9 3 -19 4088.56 6154.42 1343.12 o
1 5 -19 2975.60 3650.27 1006.04 o
3 5 -19 6530.11 5608.30 979.50 o
7 5 -19 2944.59 2530.11 1416.74 o
9 5 -19 3134.37 1821.67 1463.71 o
11 5 -19 2261.95 1126.06 1565.26 o
13 5 -19 884.97 -401.12 1642.69 o
1 7 -19 3032.77 1503.25 1013.66 o
3 7 -19 4366.09 3180.16 1075.39 o
5 7 -19 5189.23 3609.94 1383.11 o
7 7 -19 2481.37 1628.73 1668.08 o
9 7 -19 555.47 -2217.59 1788.54 o
11 7 -19 1524.77 901.38 1971.46 o
1 9 -19 1985.84 635.98 1541.14 o
3 9 -19 1137.12 -114.94 1129.53 o
5 9 -19 1348.31 550.20 1187.84 o
7 9 -19 1926.90 -350.35 1951.15 o
9 9 -19 1325.32 -2726.61 1990.37 o
2 0 -18 29158.60 30434.42 1893.90 o
0 2 -18 8580.35 11523.09 1437.05 o
2 2 -18 20.78 1095.56 1009.24 o
4 2 -18 7266.42 8541.09 1277.11 o
6 2 -18 942.39 2055.24 971.20 o
8 2 -18 10907.52 12868.88 1506.74 o
2 4 -18 8313.77 8018.25 965.64 o
4 4 -18 265.76 929.47 779.09 o
8 4 -18 19.18 672.82 1146.33 o
10 4 -18 10205.74 7751.41 1596.99 o
12 4 -18 619.41 1289.81 1414.21 o
2 6 -18 773.16 1257.67 895.56 o
4 6 -18 10523.66 6923.78 1542.41 o
6 6 -18 152.70 -200.56 1272.04 o
8 6 -18 6754.07 5980.51 1708.70 o
10 6 -18 308.22 -1123.52 1528.45 o
12 6 -18 3974.55 882.34 1862.29 o
14 6 -18 29.94 -2783.73 1855.82 o
2 8 -18 6432.94 3223.81 1250.46 o
4 8 -18 20.39 -1507.47 1156.40 o
6 8 -18 5705.87 3580.46 1103.11 o
8 8 -18 471.09 -2378.17 1585.44 o
10 8 -18 4380.95 -326.23 1939.72 o
12 8 -18 96.61 -2802.77 2083.04 o
0 10 -18 1355.38 -903.92 1372.32 o
2 10 -18 0.62 -1629.47 1086.31 o
4 10 -18 4261.91 2114.11 1251.02 o
6 10 -18 76.84 -1650.89 1100.59 o
8 10 -18 1991.64 -642.30 2051.43 o
1 1 -17 2775.74 4182.63 703.11 o
3 1 -17 9610.36 9610.22 791.12 o
5 1 -17 8829.79 9072.95 1189.53 o
7 1 -17 16592.00 19116.72 1548.63 o
1 3 -17 8507.50 9377.66 910.70 o
3 3 -17 8341.12 9501.01 919.62 o
5 3 -17 6562.54 7602.89 1222.53 o
7 3 -17 3519.90 4862.07 1204.76 o
9 3 -17 6619.17 6417.17 1362.16 o
11 3 -17 6367.34 5830.73 1396.43 o
3 5 -17 6308.18 5638.03 884.87 o
7 5 -17 4927.31 4930.61 1524.64 o
9 5 -17 4665.20 1786.13 1406.59 o
11 5 -17 3524.54 1722.66 1599.53 o
13 5 -17 3536.32 -323.69 1684.58 o
15 5 -17 1412.01 -2196.01 1750.46 o
1 7 -17 3905.50 2932.18 956.24 o
3 7 -17 8193.01 7226.45 1108.13 o
5 7 -17 9651.22 9077.70 1180.45 o
7 7 -17 2868.60 610.57 1556.37 o
9 7 -17 3904.04 1909.26 1731.55 o
11 7 -17 2736.53 1293.62 1951.15 o
13 7 -17 2653.61 -1490.24 2015.76 o
15 7 -17 1845.10 -2198.55 2065.27 o
1 9 -17 4146.89 1985.51 1015.08 o
3 9 -17 2136.57 838.27 1080.12 o
5 9 -17 540.59 -1330.60 1104.99 o
7 9 -17 2389.71 1689.12 1173.76 o
9 9 -17 2932.82 1642.69 2009.54 o
11 9 -17 3730.64 -323.69 2144.09 o
1 11 -17 3877.91 1457.02 1177.92 o
3 11 -17 1109.59 -967.75 1185.96 o
5 11 -17 642.35 -1256.51 837.67 o
7 11 -17 1951.69 -260.66 1093.48 o
4 0 -16 10461.93 10675.02 1070.21 o
2 2 -16 13137.63 13862.45 954.88 o
4 2 -16 761.17 1622.38 897.57 o
6 2 -16 18925.32 19682.86 1561.33 o
8 2 -16 2037.99 2140.29 952.15 o
10 2 -16 10871.66 12247.90 1510.68 o
12 2 -16 1862.92 2235.49 1140.02 o
0 4 -16 8762.25 8487.77 1266.96 o
2 4 -16 2354.40 3133.74 741.20 o
4 4 -16 19766.14 23483.35 1873.59 o
6 4 -16 102.14 -387.16 1060.05 o
8 4 -16 9971.76 7512.77 1397.70 o
10 4 -16 2014.19 1231.42 1269.50 o
12 4 -16 8018.05 5559.08 1626.19 o
14 4 -16 16.93 -2237.27 1491.51 o
16 4 -16 4281.45 2626.58 1934.65 o
4 6 -16 43.81 -48.46 761.39 o
6 6 -16 4163.31 2712.12 914.36 o
8 6 -16 429.21 130.75 1393.90 o
10 6 -16 10495.22 7252.55 1906.72 o
12 6 -16 581.61 -2317.24 1544.82 o
14 6 -16 2391.76 -314.80 1876.26 o
16 6 -16 94.89 -2840.85 1893.90 o
0 8 -16 12220.21 8810.19 1647.77 o
2 8 -16 1056.66 -270.39 795.09 o
4 8 -16 5428.42 4498.52 1067.98 o
6 8 -16 282.80 -915.53 1102.45 o
8 8 -16 8337.72 5358.52 1924.49 o
10 8 -16 1243.10 -206.91 1904.18 o
12 8 -16 4211.66 1336.77 2074.28 o
14 8 -16 305.34 -1145.10 2125.05 o
2 10 -16 4642.59 3421.93 1160.38 o
4 10 -16 143.85 -1444.01 962.67 o
6 10 -16 8052.22 6433.55 942.76 o
8 10 -16 8.49 -1163.20 775.47 o
10 10 -16 2810.76 353.83 1521.40 o
0 12 -16 5636.72 2083.16 1579.22 o
2 12 -16 304.38 -1845.92 1439.47 o
4 12 -16 2821.62 -326.23 1175.16 o
1 1 -15 6453.28 7103.60 690.30 o
3 1 -15 10388.43 11993.00 773.59 o
5 1 -15 42313.14 41034.70 1586.25 o
7 1 -15 7948.01 9882.81 1166.68 o
9 1 -15 3711.73 3242.23 869.65 o
11 1 -15 5161.93 7062.14 1171.76 o
1 3 -15 11259.44 12079.79 923.62 o
3 3 -15 7000.70 6380.43 766.69 o
5 3 -15 4620.18 5035.97 1077.82 o
7 3 -15 6683.96 6922.51 1153.98 o
9 3 -15 8432.72 7879.62 1334.24 o
11 3 -15 5378.85 4063.64 1287.27 o
13 3 -15 2672.90 1145.10 1273.31 o
15 3 -15 3757.56 1133.67 1456.09 o
1 5 -15 4608.68 4816.45 809.47 o
3 5 -15 5616.91 4587.15 783.92 o
5 5 -15 612.49 460.48 736.48 o
7 5 -15 11329.04 7517.85 1475.14 o
9 5 -15 5911.82 5127.37 1567.80 o
11 5 -15 1043.63 -721.00 1392.63 o
13 5 -15 2576.62 449.36 1591.92 o
15 5 -15 2519.55 -284.34 1942.26 o
17 5 -15 1306.04 -417.62 1872.45 o
1 7 -15 2502.56 1779.96 848.45 o
3 7 -15 6300.28 5843.54 988.26 o
5 7 -15 3960.81 2535.04 1203.43 o
7 7 -15 4218.59 3194.25 981.54 o
9 7 -15 1876.87 1815.33 1721.39 o
11 7 -15 1051.68 -1959.91 1623.52 o
13 7 -15 2347.84 -328.77 1892.76 o
15 7 -15 1753.78 516.63 1991.77 o
17 7 -15 962.49 -1247.92 2057.78 o
1 9 -15 5119.06 4885.31 789.39 o
3 9 -15 6221.21 5890.66 795.16 o
5 9 -15 2643.19 2018.77 770.86 o
7 9 -15 1199.24 130.58 700.74 o
9 9 -15 3068.46 1856.54 1024.33 o
11 9 -15 5130.60 2948.51 1057.70 o
13 9 -15 3476.58 2934.51 1082.30 o
1 11 -15 4792.77 2677.14 1163.61 o
3 11 -15 3234.76 2478.26 826.65 o
5 11 -15 1943.45 -233.19 790.45 o
7 11 -15 1994.23 -66.83 835.68 o
9 11 -15 2849.43 1407.01 1130.49 o
2 0 -14 35408.54 35357.04 1935.79 o
6 0 -14 31350.16 29300.88 1732.69 o
0 2 -14 22744.79 24538.20 1645.10 o
2 2 -14 3324.18 3875.54 599.26 o
4 2 -14 29827.34 31113.44 1263.33 o
6 2 -14 1330.14 1986.69 845.53 o
8 2 -14 20142.70 19237.31 1571.48 o
10 2 -14 5949.29 5392.79 1113.36 o
12 2 -14 10291.61 8289.62 1368.51 o
14 2 -14 2356.72 1359.62 1202.22 o
2 4 -14 15774.21 16836.71 1110.70 o
4 4 -14 24.71 625.96 626.10 o
6 4 -14 21454.07 19076.10 1713.65 o
8 4 -14 370.92 -616.91 1010.55 o
10 4 -14 6853.06 5199.72 1395.16 o
12 4 -14 673.19 -1152.72 1223.80 o
14 4 -14 8368.73 4405.10 1876.26 o
16 4 -14 1286.28 -1346.80 1604.48 o
18 4 -14 2551.30 1362.16 1958.77 o
0 6 -14 23396.94 21472.67 1841.86 o
2 6 -14 3156.34 2532.53 728.13 o
4 6 -14 11020.85 11072.48 994.16 o
6 6 -14 1189.39 772.79 1251.03 o
8 6 -14 5759.17 4019.21 1538.60 o
10 6 -14 244.29 -1411.54 1368.38 o
12 6 -14 8958.14 5390.25 1949.88 o
14 6 -14 465.23 -1587.98 1722.54 o
16 6 -14 1988.58 -1430.58 1838.05 o
18 6 -14 53.91 417.62 2046.35 o
2 8 -14 11805.97 9820.39 841.16 o
4 8 -14 356.42 -603.40 758.10 o
6 8 -14 4196.19 3328.42 714.29 o
8 8 -14 518.27 -305.22 620.30 o
10 8 -14 12562.50 6587.27 1822.94 o
12 8 -14 413.58 -890.07 893.95 o
14 8 -14 2590.54 2011.03 1011.81 o
16 8 -14 540.34 318.50 1086.27 o
0 10 -14 12526.88 9826.96 1750.59 o
2 10 -14 488.70 -482.45 964.01 o
4 10 -14 6082.52 3983.58 799.39 o
6 10 -14 431.48 -925.94 688.00 o
8 10 -14 11220.84 9930.16 1015.65 o
10 10 -14 29.32 -781.43 914.07 o
12 10 -14 4143.13 2947.62 1100.57 o
14 10 -14 91.97 -19.22 1144.40 o
2 12 -14 7406.27 4231.22 1201.04 o
4 12 -14 190.64 -1191.66 794.44 o
6 12 -14 3863.94 880.23 893.80 o
8 12 -14 414.57 -1265.22 843.48 o
1 1 -13 24565.92 26333.57 922.26 o
3 1 -13 6228.88 6548.71 588.09 o
5 1 -13 9349.27 8520.35 626.78 o
7 1 -13 37619.93 38235.17 1730.79 o
9 1 -13 17232.52 17633.35 948.20 o
11 1 -13 1446.53 1663.00 882.34 o
13 1 -13 7089.66 4872.22 1203.49 o
1 3 -13 10127.96 10868.77 816.17 o
3 3 -13 32719.21 33501.30 2406.09 o
5 3 -13 20033.93 18239.58 1506.74 o
7 3 -13 9527.76 9701.29 1292.35 o
9 3 -13 6644.18 4378.44 1176.83 o
11 3 -13 8983.90 6122.68 1437.05 o
13 3 -13 10325.03 7215.74 1666.81 o
15 3 -13 1822.29 732.43 1406.59 o
17 3 -13 5156.51 1128.60 1593.19 o
1 5 -13 7947.30 8290.90 839.77 o
3 5 -13 35108.36 34779.48 2226.48 o
5 5 -13 17867.70 19858.03 1674.30 o
7 5 -13 3184.73 2544.07 1186.99 o
9 5 -13 6253.69 4425.41 1277.11 o
11 5 -13 22444.14 15978.83 2169.35 o
13 5 -13 3269.46 848.07 1583.03 o
15 5 -13 1405.45 -2300.10 1533.40 o
17 5 -13 5293.94 2783.98 1949.88 o
19 5 -13 3636.01 3381.86 2064.12 o
1 7 -13 16676.17 15445.78 879.12 o
3 7 -13 8357.59 7820.59 733.67 o
5 7 -13 12868.00 10505.23 834.91 o
7 7 -13 8237.19 6192.32 693.54 o
9 7 -13 9879.38 9923.64 2255.23 o
11 7 -13 6059.08 4533.58 931.01 o
13 7 -13 3387.90 2299.27 915.54 o
15 7 -13 3695.12 3831.83 1114.21 o
17 7 -13 1845.73 2066.51 1247.23 o
1 9 -13 12170.71 11488.04 921.76 o
3 9 -13 1034.78 836.31 607.73 o
5 9 -13 6919.74 5532.51 762.78 o
7 9 -13 5809.05 4641.27 752.94 o
9 9 -13 6494.18 5953.07 1043.01 o
11 9 -13 1858.52 839.83 981.17 o
13 9 -13 4729.36 3970.14 1152.89 o
15 9 -13 3621.06 3799.32 1212.50 o
1 11 -13 7905.46 6338.00 1121.31 o
3 11 -13 3320.31 1637.62 756.35 o
5 11 -13 1868.25 298.37 748.91 o
7 11 -13 2144.20 925.52 782.84 o
9 11 -13 2809.83 1326.79 1109.19 o
11 11 -13 2509.03 2010.21 1177.65 o
13 11 -13 3038.13 1842.62 1257.82 o
1 13 -13 3522.01 1724.97 1163.97 o
3 13 -13 3097.73 604.51 1160.91 o
5 13 -13 2206.24 -1015.10 868.04 o
7 13 -13 2061.22 -1198.97 976.74 o
0 0 -12 20722.57 20935.72 1322.68 o
4 0 -12 83609.84 80747.19 3712.91 o
8 0 -12 10827.05 10372.91 1021.97 o
2 2 -12 35625.20 35633.01 2446.71 o
4 2 -12 2892.65 3000.18 424.23 o
6 2 -12 31073.97 29669.75 1197.80 o
8 2 -12 9508.87 7096.41 1033.39 o
10 2 -12 15632.30 14441.63 1582.90 o
12 2 -12 6590.22 3444.06 1230.15 o
14 2 -12 14924.22 10133.00 1744.24 o
16 2 -12 1382.15 996.58 1377.39 o
0 4 -12 33814.93 31691.10 1964.99 o
2 4 -12 1817.91 2045.91 685.52 o
4 4 -12 26416.09 26121.72 1744.11 o
6 4 -12 2248.36 1508.14 939.46 o
10 4 -12 703.29 341.49 1134.91 o
12 4 -12 17965.63 12558.90 1880.06 o
14 4 -12 220.80 -1254.26 1373.59 o
16 4 -12 15403.64 12563.97 2276.11 o
18 4 -12 133.22 552.18 1709.97 o
20 4 -12 2224.85 337.65 1944.80 o
2 6 -12 43433.20 41177.34 1744.37 o
4 6 -12 213.72 223.75 544.36 o
6 6 -12 36118.27 36615.10 1743.67 o
8 6 -12 1816.73 729.87 617.55 o
10 6 -12 18876.85 15815.69 3155.15 o
12 6 -12 269.65 33.10 790.94 o
14 6 -12 10265.49 10600.88 1257.26 o
16 6 -12 259.69 -219.68 917.18 o
18 6 -12 4996.22 4981.39 2048.89 o
20 6 -12 307.77 1193.34 2075.55 o
0 8 -12 33589.21 31950.05 2052.57 o
2 8 -12 6960.89 6622.47 555.38 o
4 8 -12 29391.83 28153.08 1235.72 o
6 8 -12 5711.18 6397.15 731.20 o
8 8 -12 8002.50 6461.56 738.59 o
10 8 -12 48.05 -123.52 733.63 o
12 8 -12 11445.04 10980.52 1233.35 o
14 8 -12 151.08 -494.71 918.66 o
16 8 -12 2640.00 2735.31 1466.88 o
18 8 -12 628.94 1398.57 1256.17 o
2 10 -12 5479.89 4078.46 702.78 o
4 10 -12 26.14 -907.76 605.17 o
6 10 -12 7899.63 5984.18 826.72 o
8 10 -12 55.88 -639.82 648.65 o
10 10 -12 12309.01 10257.86 1286.62 o
12 10 -12 36.04 -312.82 1008.49 o
14 10 -12 4858.65 4126.00 1238.02 o
0 12 -12 6520.16 5242.88 1640.15 o
2 12 -12 2200.16 1.70 762.48 o
4 12 -12 6021.21 4117.80 1028.22 o
6 12 -12 2711.10 1107.09 849.07 o
8 12 -12 5399.30 2304.01 1446.68 o
10 12 -12 78.91 -1340.39 1559.42 o
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2 12 12 2574.16 2270.33 1220.11 o
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6 12 12 2698.68 3935.90 1256.82 o
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1 1 13 25879.79 32523.81 1877.40 o
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3 5 13 33640.32 40926.30 1424.08 o
5 5 13 16834.18 19116.21 964.11 o
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13 5 13 3436.48 4527.62 985.98 o
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