#------------------------------------------------------------------------------
#$Date: 2009-10-12 18:56:40 +0300 (Mon, 12 Oct 2009) $
#$Revision: 830 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2017292.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_2017292_Fobs
loop_
_publ_author_name
'Wang, Guan-Hua'
'Li, Zhi-Gang'
'Jia, Heng-Qing'
'Hu, Ning-Hai'
'Xu, Jing-Wei'
_publ_section_title
;
 Constructing mixed-metal coordination polymers from
 copper(II)--pyridinedicarboxylate metalloligands
;
_journal_coeditor_code           FN3027
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m333
_journal_page_last               m336
_journal_volume                  65
_journal_year                    2009
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                74.685
_cell_angle_beta                 85.084
_cell_angle_gamma                88.818
_cell_length_a                   7.4307
_cell_length_b                   10.8485
_cell_length_c                   13.5487
_exptl_crystal_F_000             702.00
_reflns_d_resolution_high        0.8255
_[local]_cod_data_source_file    fn3027Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' W024 in P-1'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            293.88
_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 5855.46 6050.01 87.61 o
2 0 0 3277.24 3592.93 66.01 o
3 0 0 1712.66 1599.55 44.00 o
4 0 0 1145.14 1055.12 40.88 o
5 0 0 6726.88 6871.47 133.52 o
6 0 0 3287.05 3381.93 91.47 o
7 0 0 788.73 881.54 53.44 o
8 0 0 365.72 401.99 63.12 o
-8 1 0 273.96 307.21 58.94 o
-7 1 0 186.80 158.51 31.10 o
-6 1 0 6.81 0.00 32.95 o
-5 1 0 96.85 121.01 24.38 o
-4 1 0 122.17 125.52 21.28 o
-3 1 0 749.68 688.06 31.56 o
-2 1 0 294.68 274.35 18.64 o
-1 1 0 6382.06 6481.44 96.25 o
0 1 0 4058.93 4544.76 66.84 o
1 1 0 40.08 15.30 5.82 o
2 1 0 3684.93 3939.41 54.75 o
3 1 0 3391.20 3743.61 73.19 o
4 1 0 10.98 18.75 20.70 o
5 1 0 52.97 32.60 16.34 o
6 1 0 879.47 836.21 150.92 o
7 1 0 351.80 408.50 38.92 o
8 1 0 10.98 12.81 34.44 o
-8 2 0 258.03 305.00 42.35 o
-7 2 0 1668.57 1691.85 71.58 o
-6 2 0 621.83 567.40 49.61 o
-5 2 0 5099.15 4915.70 144.01 o
-4 2 0 2371.67 2557.22 68.66 o
-3 2 0 11961.68 12418.16 193.07 o
-2 2 0 24966.51 25834.88 361.25 o
-1 2 0 15.47 21.19 11.05 o
0 2 0 5.98 0.00 6.01 o
1 2 0 9553.46 10606.30 153.87 o
2 2 0 9031.75 9420.26 113.65 o
3 2 0 8221.31 8796.46 112.22 o
4 2 0 2189.29 2074.91 43.78 o
5 2 0 6851.19 6666.29 100.45 o
6 2 0 267.67 271.39 30.62 o
7 2 0 461.48 374.70 53.09 o
8 2 0 25.68 41.95 36.94 o
-8 3 0 115.96 146.12 35.10 o
-7 3 0 719.10 727.71 67.43 o
-6 3 0 55.87 52.33 30.77 o
-5 3 0 1489.48 1416.46 57.60 o
-4 3 0 13.47 4.71 16.27 o
-3 3 0 2124.39 1833.69 53.19 o
-2 3 0 1772.15 1610.65 44.66 o
-1 3 0 6647.67 6760.11 203.04 o
0 3 0 6183.97 6102.32 82.56 o
1 3 0 89.56 89.36 23.20 o
2 3 0 921.28 838.35 51.05 o
3 3 0 2419.96 2367.89 57.96 o
4 3 0 4338.16 3994.22 66.53 o
5 3 0 520.05 508.76 25.75 o
6 3 0 973.12 899.59 68.50 o
7 3 0 943.39 1101.37 77.41 o
8 3 0 439.82 327.27 57.18 o
-8 4 0 613.97 671.46 59.82 o
-7 4 0 3748.43 3849.12 114.55 o
-6 4 0 460.97 408.36 40.56 o
-5 4 0 3870.18 4127.10 128.18 o
-4 4 0 6866.14 7229.07 139.93 o
-3 4 0 2167.62 2036.98 58.48 o
-2 4 0 303.72 394.04 46.41 o
-1 4 0 4728.57 4736.10 86.01 o
0 4 0 16994.05 17550.48 205.00 o
1 4 0 9763.74 10619.50 578.62 o
2 4 0 2032.37 2171.87 57.56 o
3 4 0 2610.80 2574.93 64.42 o
4 4 0 5638.00 5666.05 128.60 o
5 4 0 744.05 666.19 38.17 o
6 4 0 565.73 540.29 57.73 o
7 4 0 2342.02 2237.27 112.68 o
8 4 0 32.16 56.06 35.55 o
-8 5 0 46.68 46.09 27.33 o
-7 5 0 622.41 720.72 54.29 o
-6 5 0 974.72 984.76 56.73 o
-5 5 0 2139.58 2332.29 80.02 o
-4 5 0 72.38 57.23 34.39 o
-3 5 0 3792.79 3840.79 88.53 o
-2 5 0 400.68 365.17 25.76 o
-1 5 0 858.16 763.55 32.06 o
0 5 0 19.66 28.11 10.50 o
1 5 0 5984.35 5995.55 117.88 o
2 5 0 6021.72 5543.14 110.52 o
3 5 0 98.51 81.32 20.25 o
4 5 0 109.01 110.43 22.82 o
5 5 0 26.33 28.36 24.97 o
6 5 0 2720.34 2443.24 113.52 o
7 5 0 533.13 442.55 59.40 o
8 5 0 713.04 684.16 76.30 o
-7 6 0 918.81 892.83 67.85 o
-6 6 0 8.46 5.94 23.06 o
-5 6 0 2141.39 2310.06 80.09 o
-4 6 0 1253.73 1294.56 141.55 o
-3 6 0 4637.20 4445.79 100.88 o
-2 6 0 6591.77 6369.54 121.13 o
-1 6 0 979.17 1220.06 42.74 o
0 6 0 239.52 214.72 16.60 o
1 6 0 30.46 29.97 19.50 o
2 6 0 11403.60 10910.08 502.19 o
3 6 0 103.44 73.83 22.23 o
4 6 0 152.56 168.47 28.89 o
5 6 0 557.84 567.25 41.81 o
6 6 0 98.43 65.07 36.11 o
7 6 0 244.20 185.17 48.08 o
-7 7 0 515.89 563.09 54.14 o
-6 7 0 203.20 245.34 38.29 o
-5 7 0 1899.65 1906.76 82.56 o
-4 7 0 203.46 272.96 40.38 o
-3 7 0 1641.37 1615.25 60.97 o
-2 7 0 1477.52 1456.44 91.84 o
-1 7 0 5917.81 5629.79 188.14 o
0 7 0 3887.37 3676.75 93.82 o
1 7 0 95.71 91.94 25.61 o
2 7 0 58.30 92.32 27.71 o
3 7 0 2661.41 2456.37 273.53 o
4 7 0 4934.20 4898.39 217.89 o
5 7 0 249.78 246.74 34.47 o
6 7 0 620.62 555.79 64.42 o
7 7 0 259.14 236.22 53.09 o
-6 8 0 256.39 235.11 38.87 o
-5 8 0 1469.86 1549.12 149.90 o
-4 8 0 332.39 338.22 38.16 o
-3 8 0 21.36 67.52 23.71 o
-2 8 0 128.97 180.58 61.72 o
-1 8 0 531.38 488.03 55.41 o
0 8 0 4525.27 4375.90 109.84 o
1 8 0 15.12 6.44 25.11 o
2 8 0 595.56 564.51 45.19 o
3 8 0 1576.22 1615.30 106.97 o
4 8 0 1799.03 1832.49 71.55 o
5 8 0 0.52 0.00 20.79 o
6 8 0 5.21 8.82 32.21 o
-6 9 0 864.90 1127.50 81.17 o
-5 9 0 1517.42 1717.60 76.66 o
-4 9 0 1180.75 1285.11 62.44 o
-3 9 0 1125.35 1254.65 100.71 o
-2 9 0 5.17 38.52 30.17 o
-1 9 0 866.12 987.21 78.43 o
0 9 0 1435.16 1414.73 96.07 o
1 9 0 6417.15 6693.36 381.16 o
2 9 0 4013.44 3764.39 176.35 o
3 9 0 260.10 181.89 69.43 o
4 9 0 2036.91 1947.32 79.34 o
5 9 0 0.66 35.29 27.59 o
6 9 0 934.38 1150.84 92.26 o
-5 10 0 817.72 729.06 56.31 o
-4 10 0 430.73 379.16 61.54 o
-3 10 0 605.86 562.29 66.27 o
-2 10 0 1420.32 1185.74 87.43 o
-1 10 0 14.34 2.51 33.51 o
0 10 0 215.80 209.95 51.61 o
1 10 0 22.34 34.62 25.72 o
2 10 0 280.23 274.43 39.26 o
3 10 0 25.21 26.24 33.97 o
4 10 0 36.87 27.75 26.27 o
5 10 0 183.31 250.84 41.34 o
-4 11 0 162.32 169.11 50.68 o
-3 11 0 837.77 886.41 85.95 o
-2 11 0 25.69 106.09 43.62 o
-1 11 0 2641.46 2847.92 143.03 o
0 11 0 720.29 847.80 89.10 o
1 11 0 5.52 0.00 31.09 o
2 11 0 40.95 42.58 28.55 o
3 11 0 745.89 765.67 58.85 o
4 11 0 1846.56 1948.97 86.33 o
-2 12 0 347.69 403.57 68.87 o
-1 12 0 98.55 106.18 48.08 o
0 12 0 112.36 98.57 50.40 o
1 12 0 671.60 843.34 90.40 o
2 12 0 196.05 147.12 54.67 o
-2 -12 1 25.18 38.24 45.29 o
-1 -12 1 69.40 46.87 44.09 o
0 -12 1 461.17 546.88 82.24 o
1 -12 1 96.71 135.14 49.66 o
2 -12 1 2.71 69.80 42.79 o
-4 -11 1 721.14 854.29 104.33 o
-3 -11 1 1143.38 1189.36 104.88 o
-2 -11 1 363.53 358.18 69.61 o
-1 -11 1 1521.65 1486.75 108.41 o
0 -11 1 10.96 27.57 42.42 o
1 -11 1 876.12 633.48 78.71 o
2 -11 1 4548.43 4913.58 194.64 o
3 -11 1 159.71 225.55 55.32 o
4 -11 1 104.18 154.91 50.40 o
-5 -10 1 114.87 79.28 37.78 o
-4 -10 1 47.13 11.07 25.76 o
-3 -10 1 382.21 455.36 79.78 o
-2 -10 1 1080.22 1181.94 94.95 o
-1 -10 1 14.28 0.00 32.49 o
0 -10 1 157.07 117.88 45.02 o
1 -10 1 1908.10 1932.46 113.89 o
2 -10 1 1936.88 1902.57 110.82 o
3 -10 1 50.41 53.65 36.38 o
4 -10 1 102.74 81.68 44.00 o
5 -10 1 46.53 66.64 38.80 o
-6 -9 1 79.31 27.38 35.18 o
-5 -9 1 959.40 850.29 85.02 o
-4 -9 1 87.18 78.80 29.98 o
-3 -9 1 3056.13 2943.04 234.50 o
-2 -9 1 361.86 340.72 40.41 o
-1 -9 1 4073.07 4437.98 178.30 o
0 -9 1 2149.93 2026.67 113.70 o
1 -9 1 7.02 7.15 31.00 o
2 -9 1 64.15 60.15 35.09 o
3 -9 1 883.47 850.21 74.16 o
4 -9 1 3235.23 3336.13 113.61 o
5 -9 1 362.35 311.96 59.68 o
6 -9 1 504.63 671.26 84.56 o
-6 -8 1 239.49 348.90 61.17 o
-5 -8 1 1.12 17.22 25.37 o
-4 -8 1 1700.24 1726.33 71.67 o
-3 -8 1 931.70 909.19 55.29 o
-2 -8 1 116.35 125.34 30.59 o
-1 -8 1 710.21 617.56 99.27 o
0 -8 1 136.56 159.74 44.37 o
1 -8 1 663.82 540.11 59.59 o
2 -8 1 35.79 24.94 19.71 o
3 -8 1 3.57 0.00 28.63 o
4 -8 1 21.11 33.38 22.82 o
5 -8 1 31.96 27.27 42.23 o
6 -8 1 394.09 477.11 48.30 o
-7 -7 1 105.43 75.92 40.84 o
-6 -7 1 1076.28 1222.41 88.73 o
-5 -7 1 3560.86 3675.77 102.97 o
-4 -7 1 1431.79 1308.97 59.42 o
-3 -7 1 4649.96 4510.90 112.62 o
-2 -7 1 919.14 969.39 52.91 o
-1 -7 1 2747.09 2779.47 87.76 o
0 -7 1 1234.36 1309.01 81.49 o
1 -7 1 6591.05 6205.41 184.99 o
2 -7 1 9179.27 9205.14 165.19 o
3 -7 1 489.14 523.28 39.25 o
4 -7 1 1270.71 1352.99 137.18 o
5 -7 1 15.84 13.84 45.11 o
6 -7 1 1550.76 1671.07 74.88 o
7 -7 1 117.79 187.12 47.89 o
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-3 -6 1 299.99 244.89 30.34 o
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0 -6 1 549.08 486.55 49.29 o
1 -6 1 1148.83 1070.15 42.84 o
2 -6 1 76.04 41.63 18.80 o
3 -6 1 432.30 448.57 35.31 o
4 -6 1 983.59 961.67 50.87 o
5 -6 1 6.60 0.00 30.26 o
6 -6 1 1100.49 1036.91 98.99 o
7 -6 1 116.14 175.49 82.00 o
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-4 -5 1 307.45 273.24 30.53 o
-3 -5 1 2701.47 2417.52 108.04 o
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-1 -5 1 15577.07 15994.74 250.88 o
0 -5 1 4951.16 4816.77 145.82 o
1 -5 1 7017.97 7681.83 129.70 o
2 -5 1 989.25 1072.58 68.78 o
3 -5 1 2252.66 2155.66 64.66 o
4 -5 1 10959.74 11388.53 201.08 o
5 -5 1 2314.18 2308.25 95.00 o
6 -5 1 791.88 695.88 50.22 o
7 -5 1 515.42 482.78 47.46 o
8 -5 1 4.70 0.00 23.81 o
-8 -4 1 10.12 37.22 34.44 o
-7 -4 1 130.19 82.51 37.87 o
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-4 -4 1 17.08 20.03 17.25 o
-3 -4 1 78.98 60.73 10.34 o
-2 -4 1 1169.13 1064.24 42.69 o
-1 -4 1 3861.05 4043.13 92.54 o
0 -4 1 316.50 504.00 41.12 o
1 -4 1 25838.67 27336.21 378.18 o
2 -4 1 1890.63 1668.84 48.84 o
3 -4 1 225.22 222.24 24.26 o
4 -4 1 1238.03 1219.88 52.04 o
5 -4 1 3365.32 3598.72 96.81 o
6 -4 1 2910.49 3192.77 214.27 o
7 -4 1 1278.86 1203.67 147.81 o
8 -4 1 70.42 32.33 40.79 o
-8 -3 1 29.78 51.51 34.90 o
-7 -3 1 395.77 376.75 55.69 o
-6 -3 1 1165.80 1179.90 78.06 o
-5 -3 1 2208.34 2206.48 51.04 o
-4 -3 1 3361.78 3120.77 57.60 o
-3 -3 1 21572.12 21420.61 247.83 o
-2 -3 1 1893.18 1923.51 34.74 o
-1 -3 1 1695.50 1574.54 102.47 o
0 -3 1 472.95 500.19 38.43 o
1 -3 1 11853.68 11638.50 172.06 o
2 -3 1 15983.95 16463.76 346.86 o
3 -3 1 497.36 410.59 27.71 o
4 -3 1 2574.58 2576.65 71.28 o
5 -3 1 0.24 5.80 19.28 o
6 -3 1 2686.67 2714.05 104.33 o
7 -3 1 229.17 253.85 44.46 o
8 -3 1 277.95 334.37 43.11 o
-8 -2 1 1256.77 1316.80 93.00 o
-7 -2 1 42.06 38.52 31.37 o
-6 -2 1 190.87 201.01 28.55 o
-5 -2 1 111.07 142.35 28.31 o
-4 -2 1 7282.99 6809.75 96.82 o
-3 -2 1 8785.00 8833.39 113.37 o
-2 -2 1 21596.76 24125.73 269.26 o
-1 -2 1 4069.64 3930.82 77.13 o
0 -2 1 460.19 472.35 33.04 o
1 -2 1 3497.58 3546.29 63.13 o
2 -2 1 9928.03 10542.17 169.25 o
3 -2 1 18202.44 18335.25 269.57 o
4 -2 1 5135.30 5430.61 110.91 o
5 -2 1 91.35 129.14 25.78 o
6 -2 1 952.85 943.81 52.92 o
7 -2 1 537.99 542.78 46.53 o
8 -2 1 1639.13 2009.41 116.76 o
-8 -1 1 1211.87 1153.26 61.47 o
-7 -1 1 539.99 440.44 40.08 o
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-5 -1 1 3944.15 3810.32 101.40 o
-4 -1 1 862.24 833.11 35.49 o
-3 -1 1 8677.81 9270.52 116.65 o
-2 -1 1 8797.00 9670.72 115.60 o
-1 -1 1 23397.00 25769.00 280.92 o
0 -1 1 6787.76 7282.11 215.85 o
1 -1 1 40.28 18.85 10.49 o
2 -1 1 5037.96 4968.12 85.54 o
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4 -1 1 4970.61 4826.13 99.37 o
5 -1 1 472.90 481.81 35.68 o
6 -1 1 124.19 60.54 35.87 o
7 -1 1 134.93 134.42 28.95 o
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-8 0 1 48.31 3.76 23.82 o
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-5 0 1 3069.87 2876.81 76.98 o
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-3 0 1 5290.49 5302.09 95.95 o
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3 0 1 624.75 648.39 30.06 o
4 0 1 137.00 151.42 20.65 o
5 0 1 2944.03 3123.45 80.82 o
6 0 1 6771.73 6702.88 203.69 o
7 0 1 2387.36 2300.95 115.65 o
8 0 1 1428.37 1670.25 109.43 o
-8 1 1 146.67 153.74 58.75 o
-7 1 1 835.51 669.31 68.87 o
-6 1 1 1321.70 1277.19 57.29 o
-5 1 1 48.25 60.81 22.03 o
-4 1 1 34.55 20.25 16.28 o
-3 1 1 2756.21 2997.22 66.47 o
-2 1 1 13.86 6.63 11.98 o
-1 1 1 4761.39 5450.75 90.78 o
0 1 1 11.70 10.89 3.47 o
1 1 1 3927.02 4537.48 94.95 o
2 1 1 3509.41 3701.84 91.80 o
3 1 1 1124.35 875.59 32.32 o
4 1 1 3388.45 3482.23 77.34 o
5 1 1 171.89 141.87 34.48 o
6 1 1 378.51 378.68 34.62 o
7 1 1 438.55 460.75 56.25 o
8 1 1 19.48 11.32 32.58 o
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-7 2 1 3.32 0.00 21.60 o
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3 2 1 21486.03 24122.19 335.77 o
4 2 1 4814.46 4996.86 94.71 o
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7 2 1 2861.26 2790.93 122.52 o
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0 3 1 24.03 28.21 10.66 o
1 3 1 6979.75 7133.13 89.18 o
2 3 1 9.23 8.58 7.27 o
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4 3 1 81.97 125.79 18.72 o
5 3 1 2636.21 2603.24 68.51 o
6 3 1 39.86 51.89 29.05 o
7 3 1 10.92 0.00 27.38 o
8 3 1 146.10 183.87 47.24 o
-8 4 1 4.00 48.55 46.08 o
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-6 4 1 6639.74 6756.72 150.33 o
-5 4 1 1121.93 1128.09 53.49 o
-4 4 1 3415.33 3259.27 84.70 o
-3 4 1 10054.96 11243.20 184.40 o
-2 4 1 7932.86 7791.41 131.17 o
-1 4 1 8371.17 7972.13 104.76 o
0 4 1 18516.42 19478.36 224.56 o
1 4 1 6787.69 6336.67 140.48 o
2 4 1 814.49 851.55 23.51 o
3 4 1 10.32 31.09 14.91 o
4 4 1 524.34 607.41 34.02 o
5 4 1 11815.12 12176.91 202.95 o
6 4 1 2677.97 2438.87 106.00 o
7 4 1 363.63 362.45 53.28 o
8 4 1 1263.06 1347.06 93.93 o
-8 5 1 0.16 19.81 30.68 o
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-6 5 1 514.43 555.40 46.46 o
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-4 5 1 1615.48 1571.82 60.37 o
-3 5 1 5704.81 6022.68 118.58 o
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4 5 1 1908.64 1950.71 61.43 o
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