#------------------------------------------------------------------------------
#$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $
#$Revision: 26025 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2014206.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_2014206_Fobs
loop_
_publ_author_name
'Butikofer, Jeffrey L.'
'Kalberer, Eric W.'
'Schuster, William C.'
'Roddick, Dean M.'
_publ_section_title
;
 Dichloro(norbornadiene)platinum(II): a comparison with
 dichloro(cyclooctadiene)platinum(II)
;
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m353
_journal_page_last               m354
_journal_volume                  60
_journal_year                    2004
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 120.507
_cell_angle_gamma                90.000
_cell_length_a                   12.8717
_cell_length_b                   11.5173
_cell_length_c                   12.6441
_exptl_crystal_F_000             1296.00
_reflns_d_resolution_high        0.7696
_[local]_cod_data_source_file    na1667Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' jlb31 in C2/c; PSI corrected; H added'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            516.07
_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+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -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
4 0 0 233215.28 235100.44 2531.01 o
6 0 0 79935.59 85370.82 2025.72 o
8 0 0 23298.73 25963.85 969.10 o
10 0 0 38558.87 39853.46 1396.93 o
12 0 0 11958.74 12343.26 742.87 o
14 0 0 17154.91 16527.58 776.25 o
1 1 0 58424.09 54593.18 1112.66 o
3 1 0 89713.86 83514.65 7583.63 o
5 1 0 13758.78 14932.32 1141.37 o
7 1 0 77604.78 78744.68 5441.24 o
9 1 0 2139.61 2571.29 230.12 o
11 1 0 21713.24 23177.11 658.42 o
13 1 0 4071.88 3869.30 298.50 o
0 2 0 23775.00 26742.38 621.33 o
2 2 0 37546.85 39457.72 784.03 o
4 2 0 10699.41 10139.28 395.74 o
6 2 0 982.65 1345.40 152.33 o
8 2 0 10546.53 10442.33 510.80 o
10 2 0 6368.37 7013.19 345.83 o
12 2 0 520.53 1076.71 321.20 o
14 2 0 1012.02 1284.47 439.82 o
1 3 0 102799.95 107510.17 3470.46 o
3 3 0 174730.03 155652.81 1777.44 o
5 3 0 6789.85 7183.35 329.95 o
7 3 0 76625.12 73651.80 1915.84 o
9 3 0 312.86 205.81 240.82 o
11 3 0 41166.70 39899.81 1468.89 o
13 3 0 3126.18 3627.82 391.21 o
0 4 0 214245.55 219916.33 2378.35 o
2 4 0 2047.02 2225.05 141.64 o
4 4 0 138426.53 125546.45 1901.26 o
6 4 0 33901.49 32764.10 1276.36 o
8 4 0 40547.52 38872.04 1638.08 o
10 4 0 42689.70 41100.00 1373.92 o
12 4 0 4930.48 5693.40 449.22 o
1 5 0 10086.08 11565.15 309.02 o
3 5 0 25098.49 23466.22 1018.04 o
5 5 0 171.13 298.19 165.95 o
7 5 0 8008.87 7219.33 384.72 o
9 5 0 74.61 449.87 233.36 o
11 5 0 1336.09 1087.40 291.70 o
13 5 0 9.90 -363.66 363.66 o
0 6 0 57903.28 61364.62 1721.05 o
2 6 0 1319.64 1960.57 181.83 o
4 6 0 28959.38 30143.31 1331.14 o
6 6 0 2426.28 2707.33 216.51 o
8 6 0 14876.38 14499.59 701.71 o
10 6 0 15635.22 13620.59 581.46 o
12 6 0 3298.68 2859.99 351.02 o
1 7 0 49477.03 48765.26 1901.26 o
3 7 0 80581.13 83804.38 2097.67 o
5 7 0 11821.08 12091.10 575.95 o
7 7 0 77768.52 75277.90 2370.25 o
9 7 0 174.66 603.83 254.75 o
11 7 0 35484.71 34932.43 1437.12 o
0 8 0 19442.76 19673.76 845.62 o
2 8 0 478.47 874.14 242.76 o
4 8 0 35993.59 36331.95 1720.40 o
6 8 0 4314.65 4232.29 272.26 o
8 8 0 28931.33 27613.59 1052.08 o
10 8 0 10608.57 10232.62 503.03 o
12 8 0 3954.96 3932.81 411.30 o
1 9 0 964.99 1083.02 204.31 o
3 9 0 694.81 538.35 260.59 o
5 9 0 260.09 73.25 253.46 o
7 9 0 3149.50 3033.39 288.14 o
9 9 0 341.04 502.05 300.78 o
11 9 0 1129.10 1033.28 366.57 o
0 10 0 70505.38 77395.66 2535.87 o
2 10 0 4130.23 4750.87 293.65 o
4 10 0 37365.79 37844.92 1396.61 o
6 10 0 14706.86 15613.90 690.04 o
8 10 0 10681.26 11313.22 597.67 o
10 10 0 10034.87 10155.48 443.39 o
1 11 0 11834.71 13194.69 496.06 o
3 11 0 24131.76 26796.50 1055.32 o
5 11 0 9235.99 8823.05 450.52 o
7 11 0 33869.85 32203.38 1334.70 o
9 11 0 57.97 -136.78 351.02 o
0 12 0 3921.71 4670.17 334.49 o
2 12 0 418.86 179.88 296.56 o
4 12 0 2004.43 2590.00 332.22 o
6 12 0 519.81 934.75 314.07 o
8 12 0 1283.14 1394.67 376.62 o
1 13 0 3416.47 2899.20 245.66 o
3 13 0 12987.50 13470.53 747.08 o
5 13 0 77.95 57.69 330.92 o
7 13 0 4845.94 4323.04 410.33 o
0 14 0 22418.40 24903.67 1122.08 o
2 14 0 451.95 791.49 338.05 o
4 14 0 16619.19 16683.80 756.16 o
-13 1 1 22340.04 21543.01 712.05 o
-11 1 1 1240.97 1803.52 567.85 o
-9 1 1 63307.97 65761.24 4269.56 o
-7 1 1 4272.00 4615.93 189.15 o
-5 1 1 68232.12 72897.48 1095.00 o
-3 1 1 48796.98 48630.39 695.14 o
-1 1 1 77794.99 64617.86 2168.34 o
1 1 1 207477.77 186993.17 1853.39 o
3 1 1 10424.45 10303.75 1414.92 o
5 1 1 165600.97 157268.08 15893.77 o
7 1 1 7039.34 7384.17 419.73 o
9 1 1 63886.29 66452.12 1953.66 o
11 1 1 6199.84 6246.34 288.86 o
13 1 1 9377.28 9136.29 402.66 o
-14 2 1 7054.43 8095.41 469.64 o
-12 2 1 20362.15 22042.06 952.57 o
-10 2 1 31847.31 31643.96 1139.26 o
-8 2 1 26504.63 29293.16 1408.60 o
-6 2 1 170957.14 162801.81 2321.63 o
-4 2 1 26400.75 24631.42 815.47 o
0 2 1 17714.87 20788.23 1151.74 o
2 2 1 243928.06 210711.78 1883.75 o
4 2 1 87906.55 84722.59 1477.96 o
6 2 1 85596.57 86529.21 1975.48 o
8 2 1 68708.78 62028.09 2250.98 o
10 2 1 7805.08 7460.47 348.75 o
12 2 1 40541.79 39765.30 1595.29 o
-13 3 1 8932.61 8316.46 418.11 o
-11 3 1 892.59 1087.08 272.26 o
-9 3 1 7671.48 8103.84 404.50 o
-7 3 1 986.95 1182.69 176.64 o
-5 3 1 15899.17 16126.32 799.59 o
-3 3 1 335.39 596.05 117.33 o
-1 3 1 85918.99 88516.30 4484.13 o
1 3 1 66091.51 70369.29 2513.19 o
3 3 1 31759.91 33680.05 964.24 o
5 3 1 68466.13 60994.16 1508.11 o
7 3 1 5848.13 5488.88 271.61 o
9 3 1 10257.61 10327.59 569.15 o
11 3 1 7031.57 7029.07 381.48 o
13 3 1 1640.77 1725.91 421.35 o
-14 4 1 851.96 719.21 392.18 o
-12 4 1 8891.58 8363.78 400.61 o
-10 4 1 13464.91 13020.01 597.67 o
-8 4 1 244.90 334.81 200.63 o
-6 4 1 34649.64 32973.16 1241.04 o
-4 4 1 276.25 283.92 132.24 o
-2 4 1 12664.02 12416.51 448.90 o
0 4 1 572.49 839.42 123.03 o
2 4 1 22954.55 23956.29 949.98 o
4 4 1 13585.01 15377.62 577.90 o
6 4 1 11734.24 12057.06 513.40 o
8 4 1 6733.88 6515.35 326.38 o
10 4 1 249.99 191.23 266.75 o
12 4 1 3724.83 2808.78 384.40 o
-13 5 1 25392.23 25015.49 1078.65 o
-11 5 1 354.90 455.06 269.99 o
-9 5 1 100561.68 96101.29 2677.51 o
-7 5 1 10602.54 10325.32 406.76 o
-5 5 1 129150.39 118633.09 2129.43 o
-3 5 1 122582.35 111299.99 1883.43 o
-1 5 1 16762.81 17994.96 1052.08 o
1 5 1 132555.91 142899.02 1583.31 o
3 5 1 2152.83 2612.36 170.81 o
5 5 1 57553.60 58559.74 1682.48 o
7 5 1 40.45 -233.69 233.69 o
9 5 1 59429.71 53123.69 2362.80 o
11 5 1 5614.33 5543.98 356.53 o
13 5 1 20791.56 18443.10 801.86 o
-12 6 1 13365.61 13360.65 588.92 o
-10 6 1 34808.15 32597.18 1203.44 o
-8 6 1 5053.18 5254.87 257.02 o
-6 6 1 49308.37 48020.50 1620.25 o
-4 6 1 23.22 126.08 181.18 o
-2 6 1 99933.76 107568.79 2039.98 o
0 6 1 1719.31 1474.98 190.26 o
2 6 1 124085.09 126616.03 2376.08 o
4 6 1 30784.63 33073.30 1439.72 o
6 6 1 27565.20 27677.12 990.17 o
8 6 1 39481.89 38633.49 1875.98 o
10 6 1 2977.55 2312.56 306.61 o
12 6 1 13194.34 12128.69 491.68 o
-13 7 1 124.96 80.70 352.64 o
-11 7 1 37.93 234.66 278.74 o
-9 7 1 65.01 250.22 246.98 o
-7 7 1 243.78 -129.65 236.93 o
-5 7 1 1440.12 1686.04 220.07 o
-3 7 1 8734.09 9053.49 448.90 o
-1 7 1 3.82 -1.81 220.07 o
1 7 1 1458.29 1610.26 170.28 o
3 7 1 22.57 416.81 220.72 o
5 7 1 258.88 -84.27 238.22 o
7 7 1 2003.62 2259.40 258.00 o
9 7 1 347.40 316.98 277.77 o
11 7 1 2.69 -278.74 339.35 o
-12 8 1 7825.18 7774.21 468.99 o
-10 8 1 10645.85 10894.14 514.05 o
-8 8 1 13201.05 12946.76 588.27 o
-6 8 1 53475.64 53208.28 2002.70 o
-4 8 1 72.47 52.18 229.47 o
-2 8 1 75568.55 79386.05 2157.96 o
0 8 1 14334.46 14769.51 476.95 o
2 8 1 28195.12 29951.43 1101.02 o
4 8 1 8268.80 8294.42 354.58 o
6 8 1 15173.18 17021.53 701.71 o
8 8 1 13908.72 13967.72 700.09 o
10 8 1 5548.70 4974.19 369.17 o
-11 9 1 137.12 582.76 315.69 o
-9 9 1 42118.80 41106.49 1570.98 o
-7 9 1 14353.87 13480.58 587.30 o
-5 9 1 32955.41 32633.16 1185.94 o
-3 9 1 47465.75 45436.66 1969.32 o
-1 9 1 24920.12 25042.00 724.14 o
1 9 1 77529.90 77419.20 1733.57 o
3 9 1 9352.54 9067.43 328.98 o
5 9 1 52437.60 56316.21 2342.38 o
7 9 1 817.86 1029.06 280.36 o
9 9 1 25592.58 29556.99 1129.54 o
-10 10 1 4430.56 4047.87 363.01 o
-8 10 1 2534.05 2360.20 300.13 o
-6 10 1 17893.99 18478.10 712.40 o
-4 10 1 25.31 -39.87 269.99 o
-2 10 1 15397.90 16596.94 727.31 o
0 10 1 3599.67 4091.68 232.27 o
2 10 1 4885.89 4802.41 309.21 o
4 10 1 1772.35 2100.59 306.29 o
6 10 1 5978.45 5891.76 338.38 o
8 10 1 2822.10 3318.29 341.94 o
10 10 1 2744.90 1643.91 401.25 o
-9 11 1 2035.82 1862.69 346.15 o
-7 11 1 73.90 -287.17 287.17 o
-5 11 1 4019.07 4423.19 302.07 o
-3 11 1 2079.19 1933.99 287.17 o
-1 11 1 3430.85 3794.82 223.58 o
1 11 1 10027.53 10952.02 425.84 o
3 11 1 1737.91 1822.82 301.10 o
5 11 1 5944.63 5806.84 360.42 o
7 11 1 628.27 1148.34 325.74 o
9 11 1 3434.11 3154.28 416.81 o
-8 12 1 5239.61 5602.97 382.78 o
-6 12 1 23905.72 23245.83 1039.76 o
-4 12 1 1110.10 1312.99 317.96 o
-2 12 1 36142.45 38295.12 1449.76 o
0 12 1 1734.93 1702.00 225.13 o
2 12 1 30840.98 35608.21 1375.22 o
4 12 1 11519.36 11560.20 477.10 o
6 12 1 10277.03 11614.32 571.09 o
8 12 1 13074.68 12761.04 531.87 o
-7 13 1 1933.20 2428.92 341.62 o
-5 13 1 10914.06 10496.78 415.51 o
-3 13 1 9494.54 9610.97 550.99 o
-1 13 1 10328.82 11168.99 628.13 o
1 13 1 16007.49 16318.67 485.47 o
3 13 1 2503.92 2656.12 355.55 o
5 13 1 17116.48 17501.54 811.91 o
-4 14 1 49.25 -231.42 336.11 o
-2 14 1 331.27 96.91 327.03 o
0 14 1 231.19 148.00 239.66 o
2 14 1 12.95 -357.50 357.50 o
4 14 1 62.41 -22.69 366.90 o
-14 0 2 14202.92 15270.01 752.59 o
-12 0 2 44655.14 46982.36 1738.55 o
-10 0 2 9080.58 9661.86 440.47 o
-8 0 2 140377.92 150714.61 2885.92 o
-6 0 2 3946.73 4160.98 179.88 o
-4 0 2 106078.95 112770.83 1603.40 o
-2 0 2 65644.70 71075.42 912.71 o
2 0 2 18324.21 18066.80 653.09 o
4 0 2 203525.23 189222.67 2958.84 o
6 0 2 120706.71 122382.45 2978.29 o
8 0 2 10648.54 12781.14 543.54 o
10 0 2 102806.37 104059.27 3721.48 o
12 0 2 2426.73 2288.90 455.38 o
-15 1 2 13574.78 14236.46 513.44 o
-13 1 2 2550.31 3031.21 249.51 o
-11 1 2 12204.73 12736.14 397.29 o
-9 1 2 7203.68 7327.16 226.39 o
-7 1 2 25246.06 27723.98 906.34 o
-5 1 2 9006.99 9586.53 285.91 o
-3 1 2 79573.52 80625.81 1041.22 o
-1 1 2 112628.84 99221.08 3222.20 o
1 1 2 7628.69 8082.80 249.91 o
3 1 2 149314.92 139437.11 1446.97 o
5 1 2 3052.51 3316.26 360.42 o
7 1 2 35989.12 34972.23 3851.13 o
9 1 2 7451.22 7172.52 1030.52 o
11 1 2 12519.94 11195.04 372.02 o
13 1 2 8009.06 7407.40 417.93 o
-14 2 2 115.29 -161.08 351.34 o
-12 2 2 727.33 664.11 282.95 o
-10 2 2 609.19 719.86 243.41 o
-8 2 2 2000.72 2085.35 213.59 o
-6 2 2 2496.47 2758.22 153.31 o
-4 2 2 26561.25 26610.46 834.92 o
-2 2 2 30627.12 29749.83 703.33 o
0 2 2 52957.00 54230.42 2037.55 o
2 2 2 26373.19 28159.73 935.72 o
4 2 2 1688.48 1591.73 129.00 o
6 2 2 1151.92 1200.84 193.50 o
8 2 2 408.34 700.41 255.08 o
10 2 2 487.74 428.48 308.56 o
12 2 2 428.54 545.16 401.25 o
-15 3 2 17162.90 17048.11 749.68 o
-13 3 2 115.37 61.26 294.30 o
-11 3 2 55751.01 58307.90 2305.75 o
-9 3 2 20038.87 20910.58 825.84 o
-7 3 2 89646.38 85625.26 1896.72 o
-5 3 2 92786.49 85143.62 1516.53 o
-3 3 2 23597.69 21544.55 770.42 o
-1 3 2 142393.22 133463.77 4450.25 o
1 3 2 3244.72 3915.70 210.84 o
3 3 2 192667.02 184078.97 2330.38 o
5 3 2 106.95 172.10 156.22 o
7 3 2 76372.51 74092.61 2190.37 o
9 3 2 23547.65 22925.28 946.41 o
11 3 2 17372.18 16572.63 731.53 o
-14 4 2 10881.00 11226.36 499.78 o
-12 4 2 30365.35 30323.84 1195.98 o
-10 4 2 5624.26 5424.71 270.31 o
-8 4 2 81099.48 78841.86 2084.06 o
-6 4 2 4305.34 4337.63 230.77 o
-4 4 2 158181.61 137914.67 1884.40 o
-2 4 2 9923.26 10273.46 413.25 o
0 4 2 197955.44 202187.64 6236.62 o
2 4 2 77900.25 81727.78 1740.82 o
4 4 2 64728.98 62892.50 1683.45 o
6 4 2 58110.41 54742.31 1816.34 o
8 4 2 4888.02 4258.22 270.31 o
10 4 2 41631.51 37887.70 1391.10 o
12 4 2 3.88 399.96 379.54 o
-13 5 2 450.15 634.62 309.21 o
-11 5 2 2844.74 2508.00 273.55 o
-9 5 2 2265.59 2326.49 238.55 o
-7 5 2 945.38 879.97 190.58 o
-5 5 2 5892.11 5801.33 250.54 o
-3 5 2 3493.14 3420.06 162.38 o
-1 5 2 1680.05 2018.82 126.31 o
1 5 2 6999.88 7856.66 512.91 o
3 5 2 9469.96 10333.42 488.76 o
5 5 2 319.74 444.69 207.11 o
7 5 2 18402.32 17052.32 767.50 o
9 5 2 1124.24 1789.76 275.17 o
11 5 2 1204.38 896.50 352.64 o
-14 6 2 3926.88 3716.62 398.66 o
-12 6 2 5725.09 5635.71 335.13 o
-10 6 2 7735.12 8290.53 440.80 o
-8 6 2 41105.82 37724.03 1701.28 o
-6 6 2 1992.91 2297.00 201.92 o
-4 6 2 73321.75 70980.13 1734.99 o
-2 6 2 20049.93 19269.91 687.12 o
0 6 2 61102.14 66197.08 1297.50 o
2 6 2 26000.76 27872.56 976.56 o
4 6 2 10728.83 11116.81 433.34 o
6 6 2 11083.95 11734.25 524.74 o
8 6 2 60.53 340.00 252.81 o
10 6 2 10029.90 9540.96 481.31 o
12 6 2 17.37 351.66 396.72 o
-13 7 2 17.37 -194.47 341.94 o
-11 7 2 45828.72 47073.76 2283.71 o
-9 7 2 11249.82 10382.69 449.87 o
-7 7 2 64916.29 62024.85 2024.10 o
-5 7 2 80581.62 74339.91 2053.27 o
-3 7 2 29643.25 29302.88 1290.30 o
-1 7 2 127356.55 126246.12 3299.32 o
1 7 2 123.42 65.78 173.08 o
3 7 2 96122.92 101209.01 2531.01 o
5 7 2 5693.11 6222.68 328.65 o
7 7 2 57372.64 52103.38 2355.99 o
9 7 2 7521.42 7591.41 463.81 o
11 7 2 15232.73 14384.21 744.82 o
-12 8 2 6795.17 6250.55 376.62 o
-10 8 2 4387.57 4148.99 300.45 o
-8 8 2 24613.73 25937.27 1020.64 o
-6 8 2 1025.97 1098.10 234.01 o
-4 8 2 57318.28 53062.43 1838.38 o
-2 8 2 8524.33 9272.27 351.34 o
0 8 2 33050.46 33228.83 893.91 o
2 8 2 40897.96 45003.32 1958.30 o
4 8 2 6367.60 6926.65 334.49 o
6 8 2 25157.66 26399.79 1138.94 o
8 8 2 2185.68 1911.30 314.72 o
10 8 2 8471.49 7305.22 432.04 o
-11 9 2 130.72 -301.43 301.43 o
-9 9 2 158.90 279.39 271.61 o
-7 9 2 733.39 1346.70 242.11 o
-5 9 2 119.51 -31.44 238.22 o
-3 9 2 1806.13 1745.36 259.62 o
-1 9 2 3126.01 3057.76 216.60 o
1 9 2 29.42 -205.54 205.54 o
3 9 2 3983.52 4645.86 309.53 o
5 9 2 1422.73 1528.20 288.79 o
7 9 2 555.71 418.76 300.78 o
9 9 2 276.19 439.82 361.39 o
-10 10 2 4641.66 4644.89 341.94 o
-8 10 2 33980.72 35845.46 1327.25 o
-6 10 2 8.02 -248.27 248.27 o
-4 10 2 33195.14 35001.14 1264.05 o
-2 10 2 6633.11 6590.55 315.04 o
0 10 2 27006.11 26780.96 1847.29 o
2 10 2 15809.44 17704.44 759.40 o
4 10 2 21863.47 23782.24 953.55 o
6 10 2 25721.19 25950.24 1161.63 o
8 10 2 2810.51 1751.19 381.16 o
-9 11 2 3415.95 3634.62 332.87 o
-7 11 2 21829.05 23300.28 1052.40 o
-5 11 2 21424.25 22195.70 986.28 o
-3 11 2 24141.26 24652.48 1061.15 o
-1 11 2 49003.64 52793.59 5385.17 o
1 11 2 471.33 697.79 211.86 o
3 11 2 39507.22 42294.70 1582.98 o
5 11 2 2761.84 2855.77 342.59 o
7 11 2 15584.85 16336.67 868.95 o
-8 12 2 4457.89 4320.45 360.74 o
-6 12 2 472.89 765.56 281.66 o
-4 12 2 4541.37 4396.94 323.14 o
-2 12 2 1127.01 1048.51 298.19 o
0 12 2 1586.78 1876.20 228.37 o
2 12 2 167.69 357.17 321.20 o
4 12 2 1474.78 1284.14 377.92 o
6 12 2 1826.82 2306.72 375.65 o
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