#------------------------------------------------------------------------------
#$Date: 2009-12-10 09:06:56 +0200 (Thu, 10 Dec 2009) $
#$Revision: 927 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2223738.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_2223738_Fobs
loop_
_publ_author_name
'Slawin, Alexandra M. Z.'
'Waddell, Paul G.'
'Woollins, J. Derek'
_publ_section_title
;
 <i>cis</i>-Dichloridobis(trimethoxyphosphine)palladium(II) at 125K
;
_journal_issue                   11
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1391
_journal_volume                  65
_journal_year                    2009
_space_group_IT_number           9
_symmetry_space_group_name_Hall  'C -2yc'
_symmetry_space_group_name_H-M   'C 1 c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 100.086
_cell_angle_gamma                90.000
_cell_length_a                   6.8059
_cell_length_b                   16.8966
_cell_length_c                   13.3741
_exptl_crystal_F_000             848.00
_reflns_d_resolution_high        0.8411
_[local]_cod_data_source_file    fi2085Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     '  paul10_in_Cc'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            279.56
_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'
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 1 -15 2823.09 2864.59 553.95 o
1 1 -15 1402.03 1278.48 361.31 o
3 1 -15 2716.97 3298.35 551.23 o
0 2 -15 4131.94 4077.30 585.07 o
2 2 -15 3015.71 3012.41 526.64 o
-1 3 -15 3757.42 3626.43 592.96 o
1 3 -15 811.98 1329.36 1161.26 o
3 3 -15 3084.94 3529.90 878.50 o
0 4 -15 1344.00 1029.12 381.48 o
2 4 -15 145.68 72.20 364.08 o
1 5 -15 306.35 616.20 913.88 o
3 5 -15 981.91 698.23 763.29 o
2 6 -15 1677.55 1664.06 469.81 o
-2 0 -14 9060.04 8712.91 1355.70 o
0 0 -14 5835.02 5753.44 820.39 o
2 0 -14 5605.35 5316.86 818.95 o
4 0 -14 490.07 779.82 431.76 o
-1 1 -14 4505.67 4685.05 611.01 o
1 1 -14 702.84 758.20 305.40 o
3 1 -14 3463.03 4411.82 1170.26 o
5 1 -14 349.55 1254.63 428.30 o
-2 2 -14 870.52 1318.04 447.99 o
0 2 -14 221.77 896.15 398.33 o
2 2 -14 1635.37 1521.65 385.42 o
4 2 -14 21.79 371.57 328.76 o
-1 3 -14 703.84 1022.52 384.29 o
1 3 -14 1313.31 1453.97 378.39 o
3 3 -14 986.00 1459.96 382.27 o
-2 4 -14 1105.38 1730.21 446.46 o
0 4 -14 965.81 1253.86 335.60 o
2 4 -14 4107.09 4188.55 563.01 o
4 4 -14 1830.13 1583.71 487.54 o
-1 5 -14 2312.05 2398.32 494.53 o
1 5 -14 2202.42 2826.99 488.27 o
3 5 -14 4712.55 4879.59 612.02 o
0 6 -14 6080.09 6293.64 1241.30 o
2 6 -14 1139.45 1543.34 440.36 o
4 6 -14 2288.53 2273.16 472.23 o
-1 7 -14 773.45 491.01 421.56 o
1 7 -14 18.60 831.04 806.27 o
3 7 -14 566.27 1146.06 412.23 o
0 8 -14 2354.22 2413.21 442.15 o
2 8 -14 1898.93 2349.78 506.35 o
1 9 -14 5060.95 5940.32 751.35 o
-3 1 -13 2292.13 2462.65 498.40 o
-1 1 -13 2817.20 3174.02 547.07 o
1 1 -13 1238.77 1005.11 320.97 o
3 1 -13 1462.19 1565.47 368.60 o
5 1 -13 482.74 723.47 828.95 o
-2 2 -13 8026.19 8720.02 806.32 o
0 2 -13 2016.13 2699.71 378.37 o
2 2 -13 10346.80 10547.46 1151.09 o
4 2 -13 887.06 2310.00 470.52 o
-3 3 -13 194.54 1574.44 443.39 o
-1 3 -13 3440.70 4461.48 914.25 o
1 3 -13 2605.03 2762.41 404.14 o
3 3 -13 5624.52 5089.43 581.53 o
5 3 -13 3899.09 3605.22 515.27 o
-2 4 -13 748.59 1378.58 377.37 o
0 4 -13 455.88 777.03 393.62 o
2 4 -13 2772.12 3011.31 520.70 o
4 4 -13 299.63 545.98 529.86 o
-1 5 -13 1763.62 1777.42 439.52 o
1 5 -13 879.21 1065.13 324.89 o
3 5 -13 1837.37 2270.31 414.33 o
5 5 -13 886.43 1174.26 399.15 o
-2 6 -13 1462.59 1875.04 431.71 o
0 6 -13 2117.13 2228.37 489.96 o
2 6 -13 2418.57 2405.69 458.06 o
4 6 -13 1508.55 1126.33 453.23 o
-1 7 -13 2199.00 2269.94 389.37 o
1 7 -13 4194.35 4735.41 1072.98 o
3 7 -13 2368.00 1859.09 415.89 o
-2 8 -13 2128.41 2125.16 506.08 o
0 8 -13 4976.02 5405.79 485.57 o
2 8 -13 1394.29 1564.27 430.96 o
4 8 -13 1185.45 1082.92 409.06 o
-1 9 -13 185.70 113.28 252.97 o
1 9 -13 1038.18 2327.02 457.95 o
3 9 -13 236.08 -18.30 224.94 o
0 10 -13 2707.96 2134.78 407.92 o
2 10 -13 390.08 1329.34 415.72 o
1 11 -13 2950.12 3712.78 466.88 o
-4 0 -12 1906.71 2624.18 675.49 o
-2 0 -12 15495.82 13108.25 1287.99 o
0 0 -12 1634.51 1338.19 408.77 o
2 0 -12 4063.10 4326.87 708.86 o
4 0 -12 352.72 86.23 294.03 o
6 0 -12 1903.88 2003.59 574.36 o
-3 1 -12 4378.48 4465.47 524.28 o
-1 1 -12 2390.68 2132.11 384.59 o
1 1 -12 3839.72 3226.51 395.72 o
3 1 -12 245.54 499.57 279.63 o
5 1 -12 1847.99 2513.62 414.44 o
-4 2 -12 282.43 489.98 271.46 o
-2 2 -12 165.57 167.61 258.37 o
0 2 -12 1108.15 1293.09 281.91 o
2 2 -12 1482.28 1559.27 326.46 o
4 2 -12 288.28 783.70 280.11 o
6 2 -12 297.35 297.32 327.50 o
-3 3 -12 3255.05 2740.28 441.32 o
-1 3 -12 553.87 324.91 253.60 o
1 3 -12 3443.95 3755.74 401.13 o
3 3 -12 2006.26 2340.23 717.94 o
5 3 -12 1989.22 2194.56 394.58 o
-2 4 -12 3559.74 4106.09 483.65 o
0 4 -12 2211.39 2188.36 483.92 o
2 4 -12 9251.28 10387.81 1036.39 o
4 4 -12 7942.90 7434.89 648.29 o
6 4 -12 4929.19 5196.03 635.89 o
-3 5 -12 2032.35 1998.01 391.92 o
-1 5 -12 5792.54 6004.13 495.58 o
1 5 -12 6201.21 5869.50 568.61 o
3 5 -12 4737.29 5205.62 584.44 o
5 5 -12 6724.11 6714.89 1352.86 o
-2 6 -12 2735.04 2731.22 366.38 o
0 6 -12 2976.12 3646.21 633.23 o
2 6 -12 1947.17 2511.38 422.79 o
4 6 -12 2192.55 2219.35 427.25 o
-3 7 -12 175.71 902.37 759.02 o
-1 7 -12 4263.96 3885.92 405.75 o
1 7 -12 384.19 766.49 575.89 o
3 7 -12 711.39 966.35 314.06 o
5 7 -12 569.89 568.27 318.58 o
-2 8 -12 877.74 815.63 304.00 o
0 8 -12 3031.91 2902.74 335.75 o
2 8 -12 152.26 384.54 494.66 o
4 8 -12 249.27 280.31 317.80 o
-1 9 -12 4942.39 3995.72 437.79 o
1 9 -12 1137.59 1796.45 303.33 o
3 9 -12 3390.30 3823.49 497.95 o
-2 10 -12 831.56 286.76 344.90 o
0 10 -12 5854.33 6427.92 491.09 o
2 10 -12 1470.64 1374.13 383.47 o
4 10 -12 4588.44 4930.85 648.08 o
-1 11 -12 1584.51 1543.23 461.00 o
1 11 -12 103.14 95.65 200.18 o
3 11 -12 708.68 1233.44 369.51 o
0 12 -12 803.98 907.56 350.97 o
2 12 -12 469.73 568.43 270.43 o
1 13 -12 1841.05 2096.61 463.81 o
-3 1 -11 5569.01 5242.23 538.67 o
-1 1 -11 961.81 1523.37 315.80 o
1 1 -11 3209.65 3550.41 500.52 o
3 1 -11 184.33 516.23 361.52 o
5 1 -11 1649.99 1242.54 323.64 o
-4 2 -11 1662.57 1856.79 444.41 o
-2 2 -11 5689.55 6621.01 568.87 o
0 2 -11 3523.83 3411.89 355.10 o
2 2 -11 12005.83 12050.39 703.94 o
4 2 -11 3642.51 3460.59 551.88 o
6 2 -11 2612.75 3168.42 509.06 o
-3 3 -11 3084.12 3171.83 375.68 o
-1 3 -11 6323.71 6377.23 541.99 o
1 3 -11 16550.08 16973.59 1145.17 o
3 3 -11 5280.43 5363.37 494.39 o
5 3 -11 4209.65 4380.06 919.39 o
-4 4 -11 271.21 1073.19 348.35 o
-2 4 -11 2632.03 2782.61 335.22 o
0 4 -11 2429.47 2552.89 367.16 o
2 4 -11 4777.27 4706.44 472.62 o
4 4 -11 2537.13 3089.92 443.30 o
6 4 -11 1048.98 1415.13 431.07 o
-3 5 -11 579.80 774.32 302.28 o
-1 5 -11 1557.21 1369.97 268.91 o
1 5 -11 2672.46 2857.76 383.47 o
3 5 -11 346.51 730.20 305.87 o
5 5 -11 571.78 1233.03 317.46 o
-4 6 -11 2569.57 3241.07 520.50 o
-2 6 -11 1788.00 1995.49 325.12 o
0 6 -11 4133.99 4194.71 361.26 o
2 6 -11 3025.61 3200.51 402.10 o
4 6 -11 3756.80 3202.05 471.57 o
6 6 -11 1509.65 1744.49 427.47 o
-3 7 -11 2996.04 3218.18 464.29 o
-1 7 -11 7379.01 7133.68 571.72 o
1 7 -11 1203.51 1138.09 315.84 o
3 7 -11 1346.59 1308.94 344.64 o
5 7 -11 1042.42 572.75 347.65 o
-2 8 -11 1907.30 1870.07 392.67 o
0 8 -11 4857.53 4942.07 382.73 o
2 8 -11 1584.25 1875.57 337.64 o
4 8 -11 440.29 -13.83 268.31 o
-3 9 -11 524.86 918.56 801.81 o
-1 9 -11 1663.47 1766.03 334.93 o
1 9 -11 854.01 877.66 230.59 o
3 9 -11 133.73 680.69 929.60 o
5 9 -11 309.59 596.82 904.77 o
-2 10 -11 560.16 1231.69 338.30 o
0 10 -11 4101.69 4116.85 404.02 o
2 10 -11 508.24 1001.72 288.52 o
4 10 -11 1601.16 1324.92 372.01 o
-1 11 -11 7795.16 8187.91 687.27 o
1 11 -11 3256.01 3062.99 404.90 o
3 11 -11 8999.20 9577.88 1200.75 o
-2 12 -11 720.45 862.99 373.95 o
0 12 -11 5105.76 5321.35 973.06 o
2 12 -11 4794.03 4702.83 476.31 o
4 12 -11 7324.80 6994.21 748.99 o
-1 13 -11 1537.49 1363.66 434.63 o
1 13 -11 2012.04 2466.77 397.77 o
3 13 -11 1920.62 2469.92 534.65 o
0 14 -11 1504.83 1726.20 461.71 o
2 14 -11 75.03 949.67 472.41 o
-4 0 -10 6897.64 7169.95 855.80 o
-2 0 -10 1408.97 1428.17 378.68 o
0 0 -10 7242.58 7848.36 735.64 o
2 0 -10 393.27 398.96 262.80 o
4 0 -10 4329.40 4798.21 607.06 o
6 0 -10 1716.16 2259.17 565.29 o
-5 1 -10 804.81 853.84 375.34 o
-3 1 -10 12273.72 11633.44 718.02 o
-1 1 -10 416.69 615.17 249.82 o
1 1 -10 8576.45 8656.32 594.74 o
3 1 -10 601.01 916.10 244.65 o
5 1 -10 5814.48 5492.41 521.38 o
7 1 -10 966.73 534.29 347.82 o
-4 2 -10 2070.47 1869.97 320.84 o
-2 2 -10 1463.77 1427.79 232.81 o
0 2 -10 2853.61 3043.91 319.98 o
2 2 -10 579.41 747.46 229.65 o
4 2 -10 433.38 1277.21 262.91 o
6 2 -10 1592.79 1670.44 368.57 o
-5 3 -10 534.77 666.89 366.82 o
-3 3 -10 1474.67 1864.67 268.64 o
-1 3 -10 2825.66 2968.06 289.83 o
1 3 -10 5333.71 5814.23 481.59 o
3 3 -10 2007.31 2358.38 317.32 o
5 3 -10 2420.73 2031.49 371.30 o
-4 4 -10 3112.51 2935.75 350.02 o
-2 4 -10 4286.56 4381.66 344.55 o
0 4 -10 12610.28 13310.51 1484.91 o
2 4 -10 11371.44 11184.20 622.18 o
4 4 -10 10383.15 10507.65 1033.95 o
6 4 -10 2244.54 2763.94 888.96 o
-3 5 -10 5660.17 5266.95 440.11 o
-1 5 -10 8037.70 7838.10 452.66 o
1 5 -10 17857.74 17724.62 1072.92 o
3 5 -10 8789.30 8678.39 601.18 o
5 5 -10 4911.68 5229.74 522.88 o
-4 6 -10 604.91 1390.04 367.89 o
-2 6 -10 6952.91 7098.58 435.22 o
0 6 -10 1795.96 1763.29 242.92 o
2 6 -10 4969.19 4364.19 423.84 o
4 6 -10 5252.36 4972.45 515.23 o
6 6 -10 1329.74 1470.93 422.00 o
-3 7 -10 204.47 472.38 524.25 o
-1 7 -10 1791.83 1882.89 268.28 o
1 7 -10 1142.50 1350.76 244.37 o
3 7 -10 1911.99 2188.57 362.69 o
5 7 -10 141.04 92.33 287.24 o
-4 8 -10 1557.51 1115.89 348.72 o
-2 8 -10 1160.50 1052.29 221.65 o
0 8 -10 556.41 754.48 214.85 o
2 8 -10 1721.06 1943.20 439.55 o
4 8 -10 417.31 565.85 236.86 o
6 8 -10 677.36 1985.25 912.96 o
-3 9 -10 1917.60 2003.91 489.55 o
-1 9 -10 9543.71 9114.41 490.24 o
1 9 -10 290.87 489.63 338.79 o
3 9 -10 6201.43 5404.00 636.28 o
5 9 -10 283.05 683.69 548.76 o
-2 10 -10 4166.19 3718.24 471.66 o
0 10 -10 1878.87 2012.02 288.05 o
2 10 -10 6227.94 6432.99 612.55 o
4 10 -10 1028.45 1205.72 274.84 o
-3 11 -10 627.22 754.05 508.89 o
-1 11 -10 2333.66 2190.43 512.32 o
1 11 -10 1687.60 1438.73 283.81 o
3 11 -10 1471.93 2492.11 844.25 o
5 11 -10 451.94 772.41 316.61 o
-2 12 -10 714.49 1057.44 623.32 o
0 12 -10 1046.53 1155.32 274.73 o
2 12 -10 1613.00 1626.75 391.05 o
4 12 -10 202.94 1327.31 485.82 o
-1 13 -10 7216.07 5891.80 628.62 o
1 13 -10 2539.68 2380.81 464.20 o
3 13 -10 6796.65 7445.56 824.53 o
0 14 -10 2245.35 2915.65 449.84 o
2 14 -10 5134.41 5642.30 469.18 o
1 15 -10 115.55 495.01 646.56 o
-5 1 -9 1354.27 1330.17 310.01 o
-3 1 -9 2597.29 2316.56 313.73 o
-1 1 -9 2824.33 3046.41 442.30 o
1 1 -9 1531.40 1696.52 218.72 o
3 1 -9 1293.83 941.86 261.74 o
5 1 -9 2931.23 2673.92 390.02 o
7 1 -9 561.89 1107.33 399.86 o
-4 2 -9 6550.97 6875.39 483.79 o
-2 2 -9 4354.16 4120.96 295.44 o
0 2 -9 20148.13 21821.88 1312.25 o
2 2 -9 3337.20 3299.11 329.17 o
4 2 -9 11367.43 11172.14 637.16 o
6 2 -9 623.04 623.10 308.93 o
-5 3 -9 957.24 1431.77 399.49 o
-3 3 -9 6728.64 6931.14 421.35 o
-1 3 -9 12279.48 13100.19 529.60 o
1 3 -9 19841.72 18923.42 788.30 o
3 3 -9 20125.32 19562.51 1353.83 o
5 3 -9 2726.61 2537.42 429.94 o
7 3 -9 1323.94 2012.81 464.86 o
-4 4 -9 495.99 1135.61 241.77 o
-2 4 -9 4206.55 3907.67 306.13 o
0 4 -9 2563.99 2262.42 221.59 o
2 4 -9 4540.88 4090.99 382.64 o
4 4 -9 2661.39 2317.79 352.70 o
6 4 -9 173.03 430.50 326.59 o
-5 5 -9 880.98 967.07 346.25 o
-3 5 -9 6042.74 5300.08 377.71 o
-1 5 -9 1503.82 1572.19 217.78 o
1 5 -9 4283.53 4907.82 417.50 o
3 5 -9 6183.77 6228.44 486.82 o
5 5 -9 1518.45 2490.62 752.24 o
7 5 -9 748.03 1081.89 398.18 o
-4 6 -9 3332.83 3299.85 652.17 o
-2 6 -9 6130.84 5470.58 338.23 o
0 6 -9 3128.18 3327.02 285.02 o
2 6 -9 2551.02 2020.03 195.92 o
4 6 -9 3221.36 3178.53 415.74 o
6 6 -9 2372.67 2041.15 478.79 o
-5 7 -9 3452.52 3413.33 541.06 o
-3 7 -9 4324.23 3753.46 482.41 o
-1 7 -9 2611.43 2547.60 259.52 o
1 7 -9 1542.70 1648.71 210.82 o
3 7 -9 4317.20 3980.09 287.04 o
5 7 -9 3337.00 3606.34 634.74 o
-4 8 -9 1722.28 1738.00 517.45 o
-2 8 -9 3454.36 3344.15 271.00 o
0 8 -9 308.32 671.86 163.18 o
2 8 -9 4181.06 4201.02 312.22 o
4 8 -9 798.11 1159.79 254.67 o
6 8 -9 2316.41 3068.07 549.76 o
-3 9 -9 173.65 199.79 265.61 o
-1 9 -9 4484.55 4571.98 335.20 o
1 9 -9 471.09 812.01 228.69 o
3 9 -9 1649.44 1580.87 245.73 o
5 9 -9 2377.68 2674.72 411.29 o
-4 10 -9 1600.18 1846.40 423.20 o
-2 10 -9 2324.67 2149.12 367.46 o
0 10 -9 1816.39 2015.86 405.74 o
2 10 -9 5812.32 5683.19 383.49 o
4 10 -9 535.49 1201.96 467.89 o
6 10 -9 795.93 1227.16 390.05 o
-3 11 -9 1992.81 1762.75 392.86 o
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1 11 -9 8720.92 8513.45 496.30 o
3 11 -9 5850.20 6147.73 759.86 o
5 11 -9 3403.28 3320.91 433.13 o
-2 12 -9 10985.03 10520.31 820.77 o
0 12 -9 6279.37 5994.15 424.78 o
2 12 -9 12236.31 12661.01 632.27 o
4 12 -9 1983.46 2208.34 340.86 o
-3 13 -9 411.08 453.47 481.01 o
-1 13 -9 4391.65 3900.52 506.54 o
1 13 -9 4552.46 4184.07 355.03 o
3 13 -9 1698.47 1878.02 438.69 o
-2 14 -9 322.25 828.97 347.59 o
0 14 -9 555.88 551.22 646.36 o
2 14 -9 396.07 325.77 203.54 o
4 14 -9 119.20 -262.93 389.77 o
-1 15 -9 896.34 902.52 378.24 o
1 15 -9 436.19 507.50 330.69 o
3 15 -9 376.52 1203.45 754.32 o
0 16 -9 440.62 642.68 306.71 o
2 16 -9 1092.99 607.59 458.99 o
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-2 0 -8 307.23 333.65 253.21 o
0 0 -8 12156.71 12600.35 758.95 o
2 0 -8 497.76 905.58 271.01 o
4 0 -8 14788.18 14073.85 1009.59 o
6 0 -8 2132.25 1527.56 544.18 o
-5 1 -8 1710.24 2200.96 338.50 o
-3 1 -8 2455.13 2874.27 378.57 o
-1 1 -8 1566.50 1960.59 229.76 o
1 1 -8 2788.96 2705.07 261.02 o
3 1 -8 5191.43 4741.88 353.14 o
5 1 -8 5592.45 5392.45 478.77 o
7 1 -8 3182.63 2829.58 514.01 o
-6 2 -8 299.01 597.39 700.22 o
-4 2 -8 2912.22 2933.11 327.44 o
-2 2 -8 2328.97 2114.65 218.44 o
0 2 -8 6503.28 7042.22 385.45 o
2 2 -8 1086.65 713.21 195.77 o
4 2 -8 2316.15 2318.66 292.60 o
6 2 -8 1102.68 843.10 458.65 o
-5 3 -8 2028.60 2440.90 354.25 o
-3 3 -8 788.81 781.69 195.00 o
-1 3 -8 11387.96 11974.76 461.55 o
1 3 -8 4482.00 5403.08 588.03 o
3 3 -8 3564.44 3727.11 413.52 o
5 3 -8 3128.78 3467.58 382.79 o
7 3 -8 287.91 458.44 453.46 o
-4 4 -8 6437.46 5337.76 378.58 o
-2 4 -8 16345.36 14720.94 549.92 o
0 4 -8 31400.11 33745.18 1117.85 o
2 4 -8 5425.92 5397.33 362.31 o
4 4 -8 7834.28 7347.02 539.12 o
6 4 -8 1727.30 2037.19 425.15 o
-5 5 -8 2399.44 2468.32 470.59 o
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1 5 -8 23472.64 24678.58 856.30 o
3 5 -8 10349.49 10903.28 731.71 o
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