#------------------------------------------------------------------------------
#$Date: 2012-09-11 12:26:43 +0300 (Tue, 11 Sep 2012) $
#$Revision: 66590 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/44/2234426.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_2234426_Fobs
loop_
_publ_author_name
'Ha, Kwang'
_publ_section_title
;
 <i>cis</i>-(Di-2-pyridylamine-\k^2^<i>N</i>^2^,<i>N</i>^2'^)bis(thiocyanato-\k<i>S</i>)platinum(II)
;
_journal_coeditor_code           TK5067
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m440
_journal_volume                  68
_journal_year                    2012
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                94.292
_cell_angle_beta                 93.081
_cell_angle_gamma                106.123
_cell_length_a                   7.2282
_cell_length_b                   9.8308
_cell_length_c                   10.2501
_exptl_crystal_F_000             452.00
_reflns_d_resolution_high        0.8106
_[local]_cod_data_source_file    tk5067Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' [Pt(SCN)2(dpa)]'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            235.93
_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 32950.64 34366.12 346.81 o
2 0 0 12473.14 13275.29 150.31 o
3 0 0 19234.87 19783.69 223.99 o
4 0 0 9762.92 9789.16 138.50 o
5 0 0 2245.25 2286.22 59.44 o
6 0 0 1255.07 1424.19 53.13 o
7 0 0 1013.93 1082.80 149.77 o
8 0 0 249.68 130.32 47.56 o
-8 1 0 714.12 758.30 76.58 o
-7 1 0 1228.19 1201.86 53.90 o
-6 1 0 2197.59 2239.53 65.52 o
-5 1 0 3050.51 2969.74 69.51 o
-4 1 0 7782.61 7863.47 116.69 o
-3 1 0 4244.62 4141.54 68.67 o
-2 1 0 4595.15 5010.51 69.70 o
-1 1 0 26821.75 31452.20 319.09 o
0 1 0 26276.41 27067.68 281.36 o
1 1 0 15920.32 16059.37 241.23 o
2 1 0 23208.42 23267.59 501.50 o
3 1 0 20380.18 20795.90 233.62 o
4 1 0 5780.59 5776.20 93.31 o
5 1 0 4389.07 4222.02 84.00 o
6 1 0 1792.55 1717.35 56.47 o
7 1 0 975.47 895.50 77.56 o
8 1 0 196.03 201.81 57.27 o
-8 2 0 1853.01 1782.66 102.32 o
-7 2 0 2178.46 2062.70 104.11 o
-6 2 0 3343.55 3287.35 81.52 o
-5 2 0 7111.23 7271.70 120.81 o
-4 2 0 4333.82 4245.68 78.90 o
-3 2 0 6242.90 6835.28 98.38 o
-2 2 0 13885.05 16110.02 143.86 o
-1 2 0 17122.89 19714.93 298.38 o
0 2 0 3446.99 3597.13 47.68 o
1 2 0 15542.25 14617.73 232.27 o
2 2 0 22532.77 22510.62 471.82 o
3 2 0 8503.63 8455.30 112.05 o
4 2 0 4806.00 4829.74 82.17 o
5 2 0 5588.59 5705.19 100.29 o
6 2 0 2675.61 2370.37 110.96 o
7 2 0 390.26 392.01 62.65 o
-8 3 0 1895.79 1786.15 73.16 o
-7 3 0 2010.11 1943.04 68.28 o
-6 3 0 4236.42 4255.81 95.35 o
-5 3 0 8443.70 8782.05 138.47 o
-4 3 0 10207.73 10988.43 152.57 o
-3 3 0 11127.00 12600.89 159.71 o
-2 3 0 11731.82 13075.13 223.20 o
-1 3 0 13992.31 15934.71 251.69 o
0 3 0 12488.43 13131.94 147.30 o
1 3 0 19536.02 20353.48 322.14 o
2 3 0 15901.59 15141.33 262.09 o
3 3 0 3841.34 3584.42 105.99 o
4 3 0 5736.22 5814.23 155.98 o
5 3 0 3517.21 3482.30 128.59 o
6 3 0 932.55 992.99 76.29 o
7 3 0 663.78 628.44 72.24 o
-8 4 0 1239.85 1218.96 62.74 o
-7 4 0 2299.44 2208.27 74.67 o
-6 4 0 5080.96 4997.26 106.73 o
-5 4 0 9141.83 9863.94 152.51 o
-4 4 0 11375.85 12931.59 291.71 o
-3 4 0 14509.58 16051.08 244.12 o
-2 4 0 15931.63 18123.21 300.06 o
-1 4 0 8831.82 9573.13 168.75 o
0 4 0 4084.14 4004.26 43.87 o
1 4 0 10363.26 9931.56 189.79 o
2 4 0 5469.94 5171.29 129.34 o
3 4 0 3605.06 3580.03 112.93 o
4 4 0 4016.86 4197.94 135.81 o
5 4 0 1456.61 1599.47 91.08 o
6 4 0 989.17 871.40 75.07 o
7 4 0 697.57 535.62 77.85 o
-8 5 0 1078.61 1075.56 60.01 o
-7 5 0 2779.89 2872.76 125.24 o
-6 5 0 5745.17 5936.13 129.80 o
-5 5 0 5352.64 5696.97 149.16 o
-4 5 0 8444.35 8774.43 164.16 o
-3 5 0 16684.23 17928.56 315.26 o
-2 5 0 17477.07 19625.01 328.09 o
-1 5 0 7083.93 7256.22 142.17 o
0 5 0 9344.78 8918.41 84.73 o
1 5 0 5979.27 5890.75 141.19 o
2 5 0 3675.60 3910.02 116.45 o
3 5 0 3329.18 3820.50 124.95 o
4 5 0 1864.96 1942.59 94.55 o
5 5 0 1019.28 1036.86 77.85 o
6 5 0 1354.43 1347.67 95.94 o
-8 6 0 968.48 953.06 73.80 o
-7 6 0 2741.60 2772.26 351.47 o
-6 6 0 3612.23 3810.86 95.26 o
-5 6 0 3531.55 3810.96 124.83 o
-4 6 0 13563.25 14649.22 186.43 o
-3 6 0 14979.46 16818.42 307.51 o
-2 6 0 9383.61 9785.98 194.59 o
-1 6 0 11422.97 12027.41 215.97 o
0 6 0 14358.68 14106.53 127.16 o
1 6 0 6362.87 6128.28 154.77 o
2 6 0 2387.91 2507.68 97.96 o
3 6 0 2711.86 2776.53 110.85 o
4 6 0 830.98 837.88 69.58 o
5 6 0 344.52 389.81 56.93 o
6 6 0 312.47 13.00 17.63 o
-8 7 0 988.88 1027.50 88.25 o
-7 7 0 2344.35 2278.77 112.58 o
-6 7 0 1728.11 1847.92 93.74 o
-5 7 0 4555.23 4938.10 152.34 o
-4 7 0 8891.06 9487.15 200.57 o
-3 7 0 10218.54 11291.94 233.60 o
-2 7 0 9760.55 10597.96 213.43 o
-1 7 0 14553.44 15003.90 283.99 o
0 7 0 11004.42 10632.36 144.78 o
1 7 0 5489.05 5355.01 152.05 o
2 7 0 3208.24 3574.30 125.64 o
3 7 0 3102.29 2708.34 115.70 o
4 7 0 782.27 849.78 73.40 o
5 7 0 307.19 57.62 36.00 o
-7 8 0 1948.66 2019.97 107.21 o
-6 8 0 2008.71 2025.00 100.50 o
-5 8 0 3317.21 3384.45 125.29 o
-4 8 0 1788.00 1874.04 86.40 o
-3 8 0 2327.49 2725.16 101.72 o
-2 8 0 6250.96 6680.89 159.91 o
-1 8 0 7597.14 7650.10 89.38 o
0 8 0 4486.01 4641.27 140.61 o
1 8 0 3038.19 3298.29 122.35 o
2 8 0 4846.75 5062.29 162.74 o
3 8 0 1661.61 1604.79 95.24 o
4 8 0 926.70 987.91 84.78 o
-7 9 0 2037.66 1983.91 110.67 o
-6 9 0 3262.62 3610.08 142.81 o
-5 9 0 4685.38 5050.16 163.15 o
-4 9 0 2483.69 2692.97 109.40 o
-3 9 0 2020.67 2346.27 95.36 o
-2 9 0 4701.60 4652.52 71.24 o
-1 9 0 3317.03 3449.59 123.39 o
0 9 0 1894.09 1992.63 94.78 o
1 9 0 3049.52 3222.40 129.34 o
2 9 0 2576.18 2412.84 116.91 o
3 9 0 1008.67 1083.38 85.07 o
-6 10 0 4146.21 4006.13 155.40 o
-5 10 0 4312.06 4183.90 151.71 o
-4 10 0 3062.07 2958.70 119.05 o
-2 10 0 3727.58 3574.19 133.85 o
-1 10 0 1855.69 1709.22 92.64 o
0 10 0 1827.81 1992.17 101.83 o
1 10 0 1732.00 2129.26 110.15 o
2 10 0 848.94 871.57 77.62 o
-5 11 0 2364.35 2319.28 116.34 o
-3 11 0 3381.72 3245.69 134.60 o
-2 11 0 1599.69 1891.84 102.70 o
-1 11 0 1340.33 1400.37 90.16 o
0 11 0 1514.98 1720.66 102.87 o
1 11 0 797.02 945.55 83.51 o
-3 12 0 2939.48 3017.59 140.09 o
-2 12 0 1464.64 1476.49 98.54 o
3 -12 1 2.65 -8.15 32.88 o
-1 -11 1 1003.97 966.47 83.63 o
0 -11 1 296.74 275.27 53.17 o
1 -11 1 49.52 68.31 33.98 o
2 -11 1 96.32 20.52 29.36 o
3 -11 1 117.89 96.80 38.78 o
4 -11 1 501.83 532.91 55.02 o
5 -11 1 258.27 181.64 42.88 o
-2 -10 1 454.06 454.71 58.89 o
-1 -10 1 237.58 237.12 47.22 o
0 -10 1 55.01 82.47 30.40 o
1 -10 1 439.09 393.80 49.41 o
2 -10 1 113.46 107.38 32.60 o
3 -10 1 127.14 145.51 24.07 o
4 -10 1 27.57 21.92 18.89 o
5 -10 1 58.28 50.22 28.95 o
6 -10 1 600.92 551.57 59.12 o
-3 -9 1 388.29 387.73 63.86 o
-2 -9 1 536.67 593.01 62.59 o
-1 -9 1 239.64 204.88 44.10 o
0 -9 1 107.10 86.69 30.92 o
1 -9 1 346.08 300.93 43.23 o
2 -9 1 9.83 2.49 29.65 o
3 -9 1 117.57 120.67 29.94 o
4 -9 1 6.09 19.89 19.74 o
5 -9 1 212.69 268.04 44.44 o
6 -9 1 888.06 878.22 70.56 o
7 -9 1 641.02 561.98 62.30 o
-4 -8 1 257.82 268.45 54.73 o
-3 -8 1 614.96 634.79 65.71 o
-2 -8 1 688.44 751.88 62.59 o
-1 -8 1 294.08 271.28 42.71 o
0 -8 1 260.23 246.83 39.36 o
1 -8 1 329.64 285.78 54.33 o
2 -8 1 16.63 8.35 11.70 o
3 -8 1 3.06 -2.72 15.72 o
4 -8 1 214.59 200.78 24.36 o
5 -8 1 1433.30 1333.74 77.90 o
6 -8 1 264.38 303.58 48.37 o
7 -8 1 394.84 292.66 51.67 o
-5 -7 1 122.44 133.44 42.88 o
-4 -7 1 655.56 785.86 69.76 o
-3 -7 1 695.46 567.76 58.20 o
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-1 -7 1 152.09 112.58 30.86 o
0 -7 1 127.90 102.53 10.03 o
1 -7 1 194.32 178.42 22.77 o
2 -7 1 136.00 79.75 22.02 o
3 -7 1 10.89 4.23 10.99 o
4 -7 1 963.87 919.99 53.49 o
5 -7 1 1055.56 978.03 65.31 o
6 -7 1 168.16 122.52 30.05 o
7 -7 1 488.50 431.13 56.29 o
-6 -6 1 284.44 3.24 19.07 o
-5 -6 1 185.61 253.77 51.67 o
-4 -6 1 1192.94 1222.37 80.22 o
-3 -6 1 766.80 744.14 58.49 o
-2 -6 1 16.74 33.98 23.12 o
-1 -6 1 332.87 287.75 36.64 o
0 -6 1 133.98 142.77 15.32 o
1 -6 1 153.71 111.56 18.32 o
2 -6 1 402.63 356.41 32.31 o
3 -6 1 228.36 215.21 20.42 o
4 -6 1 1541.41 1518.38 101.63 o
5 -6 1 327.98 249.66 36.29 o
6 -6 1 746.30 721.01 43.02 o
7 -6 1 1135.19 1096.76 55.29 o
8 -6 1 806.48 696.15 50.08 o
-6 -5 1 506.85 605.15 72.18 o
-5 -5 1 1636.80 1537.00 92.64 o
-4 -5 1 1022.13 919.77 66.40 o
-3 -5 1 512.17 536.03 48.60 o
-2 -5 1 1187.03 1051.19 56.87 o
-1 -5 1 729.82 742.52 45.08 o
0 -5 1 140.29 130.04 20.95 o
1 -5 1 47.12 54.61 12.95 o
2 -5 1 105.34 129.63 21.73 o
3 -5 1 2297.77 2329.93 51.82 o
4 -5 1 2596.73 2600.33 56.27 o
5 -5 1 1352.39 1230.07 79.70 o
6 -5 1 1921.26 1987.89 65.28 o
7 -5 1 1969.01 1854.52 176.27 o
8 -5 1 499.58 485.17 43.99 o
-7 -4 1 239.80 200.02 57.91 o
-6 -4 1 816.04 761.94 72.13 o
-5 -4 1 1638.47 1690.49 93.05 o
-4 -4 1 786.02 736.57 57.85 o
-3 -4 1 1381.03 1281.90 65.07 o
-2 -4 1 1976.29 1856.88 71.20 o
-1 -4 1 348.55 366.93 30.63 o
0 -4 1 113.65 130.41 30.23 o
1 -4 1 469.65 524.82 29.01 o
2 -4 1 220.68 199.91 20.26 o
3 -4 1 3142.81 3288.23 48.85 o
4 -4 1 1425.84 1361.00 31.83 o
5 -4 1 2072.46 2110.24 89.95 o
6 -4 1 4273.75 4261.37 96.45 o
7 -4 1 1536.14 1534.99 130.81 o
8 -4 1 644.49 701.47 49.33 o
-7 -3 1 256.99 375.42 64.50 o
-6 -3 1 635.31 507.71 60.57 o
-5 -3 1 822.56 813.61 67.27 o
-4 -3 1 232.78 191.00 35.02 o
-3 -3 1 509.74 373.28 36.00 o
-2 -3 1 656.09 534.52 37.97 o
-1 -3 1 1690.54 1495.85 50.34 o
0 -3 1 404.36 384.92 22.77 o
1 -3 1 189.72 233.31 19.07 o
2 -3 1 472.83 490.41 29.62 o
3 -3 1 850.42 872.07 22.70 o
4 -3 1 34.51 52.57 28.98 o
5 -3 1 2013.82 1967.75 56.80 o
6 -3 1 2907.63 2843.21 76.14 o
7 -3 1 969.01 953.31 50.44 o
8 -3 1 1380.58 1312.09 62.99 o
-8 -2 1 152.93 239.38 61.26 o
-7 -2 1 342.69 313.70 56.81 o
-6 -2 1 1901.31 1770.25 97.61 o
-5 -2 1 866.71 869.72 64.55 o
-4 -2 1 133.74 97.45 14.03 o
-3 -2 1 206.80 128.45 19.30 o
-2 -2 1 1368.54 1252.31 49.18 o
-1 -2 1 6.06 4.10 7.69 o
0 -2 1 76.96 90.12 7.66 o
1 -2 1 504.89 574.24 28.67 o
2 -2 1 675.80 694.12 16.88 o
3 -2 1 397.17 388.79 20.47 o
4 -2 1 1426.03 1381.14 59.53 o
5 -2 1 3277.35 3310.41 74.78 o
6 -2 1 1469.67 1425.64 136.77 o
7 -2 1 1360.52 1362.25 58.05 o
8 -2 1 1593.12 1418.40 65.70 o
-8 -1 1 329.48 349.30 65.42 o
-7 -1 1 1137.08 1167.07 84.38 o
-6 -1 1 1826.13 1932.01 95.99 o
-5 -1 1 51.67 56.60 15.52 o
-4 -1 1 1629.27 1593.32 43.39 o
-3 -1 1 1456.88 1436.72 38.75 o
-2 -1 1 39.51 36.11 10.29 o
-1 -1 1 309.47 253.35 9.69 o
0 -1 1 1083.50 1057.51 15.91 o
1 -1 1 3225.41 3278.28 45.28 o
2 -1 1 3013.23 3140.01 50.01 o
3 -1 1 40.99 39.01 9.32 o
4 -1 1 2236.67 2179.72 52.92 o
5 -1 1 1959.18 1950.16 96.48 o
6 -1 1 832.20 762.04 42.59 o
7 -1 1 972.24 978.48 78.48 o
8 -1 1 1227.63 1116.84 89.23 o
-8 0 1 802.19 876.31 81.78 o
-7 0 1 2126.22 1928.25 102.58 o
-6 0 1 64.57 55.86 20.16 o
-5 0 1 314.82 289.75 24.96 o
-4 0 1 1915.40 1748.82 98.07 o
-3 0 1 7.32 7.95 9.59 o
-2 0 1 4375.26 4698.11 66.29 o
-1 0 1 7.05 12.44 2.41 o
0 0 1 221.10 249.63 9.19 o
1 0 1 1336.87 1396.57 24.35 o
2 0 1 6586.23 6707.38 188.87 o
3 0 1 1522.83 1497.01 37.83 o
4 0 1 2099.67 2118.15 52.05 o
5 0 1 1580.34 1517.14 49.17 o
6 0 1 268.63 265.31 39.65 o
7 0 1 1431.49 1407.64 57.73 o
8 0 1 671.80 767.83 81.95 o
-8 1 1 874.21 797.83 80.16 o
-7 1 1 658.29 641.51 64.18 o
-6 1 1 592.39 556.39 35.85 o
-5 1 1 3796.48 3657.72 78.63 o
-4 1 1 2131.97 2014.95 75.77 o
-3 1 1 27.61 25.80 8.32 o
-2 1 1 1019.18 1074.75 27.54 o
-1 1 1 595.52 664.68 17.86 o
0 1 1 48.43 69.00 9.36 o
1 1 1 1387.18 1383.26 27.30 o
2 1 1 745.81 662.48 21.60 o
3 1 1 8401.29 8642.52 116.82 o
4 1 1 4538.67 4220.17 143.01 o
5 1 1 894.29 885.16 38.51 o
6 1 1 1852.29 1890.31 110.30 o
7 1 1 2367.49 2286.57 116.11 o
8 1 1 430.26 534.00 77.21 o
-8 2 1 755.45 641.45 47.09 o
-7 2 1 345.11 320.01 35.35 o
-6 2 1 1424.50 1343.86 52.80 o
-5 2 1 2415.69 2323.07 62.34 o
-4 2 1 348.45 349.33 23.76 o
-3 2 1 52.49 46.22 10.55 o
-2 2 1 3984.64 4730.73 71.71 o
-1 2 1 767.78 864.12 31.55 o
0 2 1 2767.75 2615.87 55.19 o
1 2 1 53.42 38.66 11.44 o
2 2 1 3941.36 3696.42 92.82 o
3 2 1 6042.24 5672.93 86.80 o
4 2 1 1610.26 1470.37 43.49 o
5 2 1 795.07 855.33 62.44 o
6 2 1 3064.62 3150.57 128.42 o
7 2 1 906.37 954.85 82.12 o
-8 3 1 823.65 716.02 121.91 o
-7 3 1 487.35 424.54 38.33 o
-6 3 1 760.65 767.78 84.15 o
-5 3 1 779.04 749.18 38.05 o
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-3 3 1 374.86 291.96 20.62 o
-2 3 1 210.37 261.92 24.16 o
-1 3 1 2068.30 2121.34 57.04 o
0 3 1 128.39 114.14 14.56 o
1 3 1 569.13 531.43 20.59 o
2 3 1 5314.02 4973.87 120.44 o
3 3 1 1695.99 1532.20 68.14 o
4 3 1 1446.44 1561.74 44.34 o
5 3 1 2582.92 2601.94 110.73 o
6 3 1 1563.96 1465.56 92.41 o
7 3 1 407.47 425.53 62.76 o
-8 4 1 409.58 427.94 56.58 o
-7 4 1 327.97 319.65 63.14 o
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-5 4 1 218.58 216.71 25.55 o
-4 4 1 784.88 765.71 35.12 o
-3 4 1 1119.68 1101.99 52.07 o
-2 4 1 86.58 85.36 17.40 o
-1 4 1 75.70 73.02 8.65 o
0 4 1 36.28 42.24 8.43 o
1 4 1 959.70 771.67 52.62 o
2 4 1 396.34 315.26 35.83 o
3 4 1 700.89 611.97 47.74 o
4 4 1 2165.57 2267.55 97.73 o
5 4 1 2430.12 2307.49 109.11 o
6 4 1 1030.34 989.30 79.81 o
7 4 1 598.81 765.98 85.07 o
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-1 5 1 37.42 18.81 7.11 o
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2 5 1 520.76 443.73 45.02 o
3 5 1 507.39 556.02 48.72 o
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5 5 1 1081.48 1133.66 82.53 o
6 5 1 295.07 247.47 52.07 o
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-6 6 1 140.02 110.31 22.64 o
-5 6 1 6.27 6.82 13.70 o
-4 6 1 26.69 28.43 21.04 o
-3 6 1 284.71 296.71 35.48 o
-2 6 1 1137.62 1100.37 54.38 o
-1 6 1 1042.14 938.05 29.01 o
0 6 1 1446.65 1335.36 39.61 o
1 6 1 2264.02 2048.00 85.07 o
2 6 1 400.36 479.91 46.99 o
3 6 1 960.65 849.38 63.40 o
4 6 1 1008.77 1020.10 75.01 o
5 6 1 503.10 638.32 71.49 o
6 6 1 228.35 371.03 70.28 o
-8 7 1 821.84 859.55 82.41 o
-7 7 1 525.71 393.34 56.12 o
-6 7 1 253.69 227.07 41.03 o
-5 7 1 92.93 65.88 25.66 o
-4 7 1 262.06 266.19 39.41 o
-3 7 1 118.59 117.38 28.09 o
-1 7 1 1323.14 1352.07 32.31 o
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4 7 1 800.50 718.25 71.08 o
5 7 1 408.13 35.66 28.09 o
-8 8 1 485.05 9.71 23.46 o
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