#------------------------------------------------------------------------------
#$Date: 2016-04-03 06:24:07 +0300 (Sun, 03 Apr 2016) $
#$Revision: 181231 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/09/2230966.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_2230966_Fobs
loop_
_publ_author_name
'Zebret, Soumaila'
'Besnard, C\'eline'
'Hamacek, Josef'
_publ_section_title
;
 Tris(6-carboxypyridine-2-carboxylato)terbium(III) 2.75-hydrate
;
_journal_coeditor_code           ZS2104
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m968
_journal_page_last               m969
_journal_volume                  67
_journal_year                    2011
_space_group_IT_number           159
_symmetry_space_group_name_Hall  'P 3 -2c'
_symmetry_space_group_name_H-M   'P 3 1 c'
_audit_creation_date             11-04-29
_audit_creation_method           CRYSTALS
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   13.0115(15)
_cell_length_b                   13.0115(15)
_cell_length_c                   9.4142(13)
_cod_data_source_file            zs2104Isup2.hkl
_cod_data_source_block           I
loop_
_refln_index_h
_refln_index_k
_refln_index_l
_refln_F_squared_meas
_refln_F_squared_calc
_refln_F_squared_sigma
_refln_observed_status
2 5 -10 479.83 662.84 41.28 o
1 6 -10 86.56 96.56 49.31 o
2 4 -9 1114.73 1107.30 51.12 o
3 4 -9 665.20 688.49 36.45 o
0 5 -9 835.92 935.36 44.26 o
1 5 -9 623.35 778.87 49.99 o
2 5 -9 -69.92 28.62 49.24 o
3 5 -9 357.28 312.05 33.39 o
4 5 -9 417.50 374.89 36.10 o
-1 6 -9 798.89 719.67 49.93 o
0 6 -9 119.96 30.20 49.02 o
1 6 -9 503.33 539.24 52.84 o
2 6 -9 459.42 517.51 35.34 o
3 6 -9 31.29 26.24 117.27 o
-2 7 -9 67.96 21.59 47.57 o
-1 7 -9 348.43 453.63 50.56 o
0 7 -9 500.69 507.72 42.16 o
1 7 -9 -116.12 27.31 41.88 o
2 7 -9 461.94 567.65 37.97 o
-3 8 -9 391.45 376.94 51.26 o
-2 8 -9 444.39 472.50 42.21 o
-1 8 -9 99.03 44.38 49.22 o
0 8 -9 474.69 524.14 51.32 o
1 8 -9 535.53 642.09 54.51 o
-4 9 -9 297.67 232.09 40.64 o
-3 9 -9 170.89 60.61 49.26 o
-2 9 -9 574.37 719.74 53.63 o
-1 9 -9 446.88 580.38 52.28 o
2 3 -8 492.82 419.01 33.99 o
3 3 -8 1533.37 1617.15 55.34 o
0 4 -8 1442.52 1390.97 44.73 o
1 4 -8 1822.55 1836.61 55.30 o
2 4 -8 439.44 435.62 37.03 o
3 4 -8 331.07 346.50 36.43 o
4 4 -8 1248.26 1270.98 58.25 o
-1 5 -8 1976.50 1966.70 57.59 o
0 5 -8 249.04 149.01 52.04 o
1 5 -8 597.17 505.17 51.80 o
2 5 -8 1064.20 1071.88 38.42 o
3 5 -8 291.61 398.87 38.21 o
4 5 -8 218.45 226.30 36.55 o
5 5 -8 683.55 736.53 52.34 o
-2 6 -8 859.93 834.37 51.80 o
-1 6 -8 243.50 316.16 51.46 o
0 6 -8 1315.72 1366.92 55.53 o
1 6 -8 234.40 192.11 36.06 o
2 6 -8 214.98 182.69 36.26 o
3 6 -8 835.92 800.72 37.45 o
4 6 -8 198.06 220.69 36.46 o
5 6 -8 238.02 223.99 36.34 o
-3 7 -8 211.54 357.29 51.39 o
-2 7 -8 1505.82 1520.30 54.84 o
-1 7 -8 449.37 489.75 52.43 o
0 7 -8 391.45 366.90 51.26 o
1 7 -8 1052.70 1164.19 38.21 o
2 7 -8 344.05 403.35 37.14 o
3 7 -8 216.71 173.21 36.41 o
4 7 -8 727.33 858.08 38.11 o
-4 8 -8 1608.04 1471.04 56.67 o
-3 8 -8 492.82 295.76 54.90 o
-2 8 -8 324.67 330.85 50.93 o
-1 8 -8 962.99 1028.82 54.82 o
0 8 -8 277.70 446.19 52.99 o
1 8 -8 82.23 91.13 35.24 o
2 8 -8 665.20 809.27 33.41 o
3 8 -8 130.50 129.78 33.63 o
-4 9 -8 152.91 203.96 32.04 o
-3 9 -8 653.10 772.46 54.17 o
-2 9 -8 88.77 107.22 51.04 o
-1 9 -8 185.02 267.39 51.26 o
0 9 -8 705.27 932.53 53.17 o
1 9 -8 193.12 297.87 32.73 o
-5 10 -8 239.84 389.66 51.07 o
-4 10 -8 223.70 158.43 35.23 o
-3 10 -8 250.90 324.28 50.37 o
-2 10 -8 788.93 993.67 56.23 o
-1 10 -8 326.80 216.59 51.10 o
-5 11 -8 167.82 216.83 33.56 o
-4 11 -8 870.32 1030.80 34.74 o
-3 11 -8 204.75 302.74 52.24 o
0 3 -7 108.63 109.63 55.24 o
1 3 -7 2002.76 1937.43 57.97 o
2 3 -7 2558.52 2528.10 41.70 o
-1 4 -7 1684.49 1662.15 48.34 o
0 4 -7 1354.45 1348.85 56.35 o
1 4 -7 116.12 81.49 35.53 o
2 4 -7 1202.91 1202.71 40.85 o
3 4 -7 1919.32 2018.17 41.28 o
-2 5 -7 1728.27 1739.80 48.96 o
-1 5 -7 45.86 47.54 55.03 o
0 5 -7 1847.77 1900.68 50.62 o
1 5 -7 2546.62 2536.51 47.54 o
2 5 -7 97.86 57.86 34.95 o
3 5 -7 1646.04 1689.24 43.00 o
4 5 -7 702.15 794.07 40.57 o
-2 6 -7 2291.84 2259.15 62.02 o
-1 6 -7 2703.49 2622.57 61.23 o
0 6 -7 225.47 148.95 38.90 o
1 6 -7 1060.36 1058.12 42.18 o
2 6 -7 1083.49 920.20 38.77 o
3 6 -7 -14.20 22.75 61.25 o
4 6 -7 568.74 718.45 39.32 o
5 6 -7 492.82 687.15 36.60 o
-3 7 -7 1812.51 1655.60 40.11 o
-2 7 -7 220.19 172.29 54.17 o
-1 7 -7 1328.57 1502.28 47.22 o
0 7 -7 736.89 676.31 38.36 o
1 7 -7 135.94 75.61 37.07 o
2 7 -7 1037.47 1222.32 41.73 o
3 7 -7 941.19 942.02 36.13 o
4 7 -7 43.49 54.34 49.71 o
5 7 -7 503.33 682.62 39.63 o
-3 8 -7 1099.05 1011.42 35.14 o
-2 8 -7 973.99 1018.97 47.78 o
-1 8 -7 -19.50 67.38 122.23 o
0 8 -7 1487.60 1591.04 36.34 o
1 8 -7 1068.04 1149.54 34.64 o
2 8 -7 135.94 6.66 35.70 o
3 8 -7 549.25 646.73 38.64 o
4 8 -7 451.87 693.82 40.06 o
-4 9 -7 1018.59 1010.52 37.59 o
-3 9 -7 173.98 85.29 35.73 o
-2 9 -7 1198.83 1247.42 57.09 o
-1 9 -7 1227.54 1309.04 53.64 o
0 9 -7 75.95 62.06 32.84 o
1 9 -7 736.89 819.23 38.36 o
2 9 -7 467.02 730.01 40.72 o
3 9 -7 78.02 26.16 40.57 o
-4 10 -7 1110.80 1141.07 39.25 o
-3 10 -7 970.32 932.78 36.68 o
-2 10 -7 16.99 0.49 101.46 o
-1 10 -7 535.53 549.60 38.16 o
0 10 -7 877.28 840.22 38.37 o
1 10 -7 82.23 30.88 35.24 o
-5 11 -7 1011.09 1027.92 37.45 o
-4 11 -7 95.55 82.59 35.69 o
-3 11 -7 752.96 790.67 54.94 o
-2 11 -7 258.42 422.45 54.90 o
-1 11 -7 99.03 7.57 37.50 o
-5 12 -7 500.69 595.71 36.89 o
-4 12 -7 629.25 687.93 35.45 o
-3 12 -7 45.86 5.76 51.04 o
1 2 -6 535.53 535.89 38.16 o
2 2 -6 2534.75 2536.04 59.29 o
-1 3 -6 505.98 455.55 55.63 o
0 3 -6 2458.25 2450.24 58.39 o
1 3 -6 1367.48 1331.13 39.20 o
2 3 -6 952.06 947.98 39.97 o
3 3 -6 3419.02 3559.28 61.98 o
-2 4 -6 1945.21 1813.11 57.14 o
-1 4 -6 756.20 812.49 45.34 o
0 4 -6 208.13 216.41 40.78 o
1 4 -6 4310.75 4113.14 46.39 o
2 4 -6 721.00 658.15 41.11 o
3 4 -6 1252.42 1283.81 41.68 o
4 4 -6 3764.77 3813.37 65.03 o
-2 5 -6 412.71 372.28 35.89 o
-1 5 -6 3940.19 3695.69 59.14 o
0 5 -6 1337.17 1336.71 43.06 o
1 5 -6 223.70 234.95 36.99 o
2 5 -6 2331.47 2377.88 45.49 o
3 5 -6 825.74 659.97 43.99 o
4 5 -6 1315.72 1402.02 42.72 o
5 5 -6 1332.86 1505.89 64.49 o
-3 6 -6 3336.88 3109.79 61.23 o
-2 6 -6 2230.24 2215.23 44.49 o
-1 6 -6 970.32 1037.33 44.02 o
0 6 -6 1898.74 1895.28 41.05 o
1 6 -6 765.95 763.32 42.37 o
2 6 -6 835.92 834.28 40.86 o
3 6 -6 3155.73 3184.53 46.31 o
4 6 -6 549.25 507.71 38.64 o
5 6 -6 151.46 141.76 40.58 o
6 6 -6 702.15 766.06 56.17 o
-3 7 -6 434.52 373.40 39.28 o
-2 7 -6 5160.86 4826.67 50.76 o
-1 7 -6 802.22 796.99 40.03 o
0 7 -6 611.65 626.54 40.78 o
1 7 -6 1934.83 1834.26 41.44 o
2 7 -6 363.99 476.10 40.44 o
3 7 -6 469.57 542.65 35.73 o
4 7 -6 898.33 919.65 42.36 o
5 7 -6 223.70 292.17 40.51 o
6 7 -6 266.05 240.14 36.50 o
-4 8 -6 1797.49 1746.79 59.92 o
-3 8 -6 1487.60 1384.02 40.88 o
-2 8 -6 926.80 888.74 39.44 o
-1 8 -6 2320.11 2303.37 45.38 o
0 8 -6 377.60 341.81 38.90 o
1 8 -6 546.49 614.90 41.30 o
2 8 -6 1650.82 1742.50 43.06 o
3 8 -6 147.14 290.13 40.00 o
4 8 -6 267.97 253.78 38.56 o
5 8 -6 727.33 869.66 41.29 o
-4 9 -6 410.32 370.57 40.55 o
-3 9 -6 2241.38 2048.14 39.03 o
-2 9 -6 75.95 117.14 33.87 o
-1 9 -6 1052.70 1066.47 42.03 o
0 9 -6 1455.97 1400.26 44.94 o
1 9 -6 464.48 518.38 40.61 o
2 9 -6 193.12 227.65 37.64 o
3 9 -6 877.28 999.54 38.37 o
4 9 -6 173.98 277.26 35.73 o
-5 10 -6 2002.76 2034.52 57.97 o
-4 10 -6 287.60 247.71 33.95 o
-3 10 -6 702.15 736.77 37.45 o
-2 10 -6 1733.17 1709.13 39.22 o
-1 10 -6 337.53 400.91 36.78 o
0 10 -6 131.85 125.01 36.51 o
1 10 -6 887.78 965.56 42.11 o
2 10 -6 150.01 255.21 37.50 o
3 10 -6 133.20 184.29 38.06 o
-5 11 -6 588.57 599.06 37.14 o
-4 11 -6 1328.57 1395.17 34.34 o
-3 11 -6 377.60 384.40 36.62 o
-2 11 -6 170.89 104.25 53.88 o
-1 11 -6 815.62 737.24 37.00 o
0 11 -6 281.64 312.12 39.53 o
1 11 -6 181.83 169.68 38.11 o
-6 12 -6 765.95 861.77 55.41 o
-5 12 -6 316.24 276.69 37.70 o
-4 12 -6 227.24 265.81 35.51 o
-3 12 -6 832.52 871.29 33.98 o
-2 12 -6 247.19 240.33 51.84 o
-1 12 -6 173.98 173.08 40.39 o
-6 13 -6 167.82 145.32 36.62 o
-5 13 -6 853.03 1004.11 34.40 o
-4 13 -6 260.32 306.58 36.10 o
-3 13 -6 140.09 135.82 41.82 o
0 2 -5 5654.37 5663.18 79.70 o
1 2 -5 2055.81 2220.19 48.06 o
-1 3 -5 3822.80 3691.80 50.97 o
0 3 -5 152.91 168.19 40.78 o
1 3 -5 988.75 1008.56 44.44 o
2 3 -5 2909.33 2882.59 44.47 o
-1 4 -5 4673.77 4671.61 48.31 o
0 4 -5 3607.47 3570.77 49.51 o
1 4 -5 41.96 28.06 41.19 o
2 4 -5 4256.79 4265.68 46.10 o
3 4 -5 4754.63 4791.06 48.72 o
-2 5 -5 4649.64 4504.58 48.18 o
-1 5 -5 89.88 94.67 33.49 o
0 5 -5 2331.47 2291.99 45.49 o
1 5 -5 3793.73 3933.68 43.52 o
2 5 -5 93.26 69.93 42.08 o
3 5 -5 1598.61 1621.52 47.09 o
4 5 -5 2286.20 2260.31 45.05 o
-2 6 -5 3614.55 3558.71 42.48 o
-1 6 -5 3116.16 2958.97 39.45 o
0 6 -5 239.84 129.81 41.95 o
1 6 -5 2061.16 1959.65 42.77 o
2 6 -5 1455.97 1454.27 44.94 o
3 6 -5 194.76 163.16 37.80 o
4 6 -5 2469.95 2548.07 46.82 o
5 6 -5 1269.15 1434.10 37.76 o
-3 7 -5 3076.84 2988.27 45.73 o
-2 7 -5 57.70 49.72 37.57 o
-1 7 -5 2377.19 2197.19 40.19 o
0 7 -5 1914.17 1893.54 46.37 o
1 7 -5 80.11 17.30 41.11 o
2 7 -5 3446.62 3551.15 48.40 o
3 7 -5 1832.62 1776.10 45.37 o
4 7 -5 66.03 10.94 44.98 o
5 7 -5 689.72 696.78 37.11 o
6 7 -5 600.05 755.78 40.39 o
-3 8 -5 3063.78 2853.11 45.63 o
-2 8 -5 3391.53 3288.12 41.15 o
-1 8 -5 15.57 50.44 43.68 o
0 8 -5 2230.24 2056.34 50.06 o
1 8 -5 2365.72 2230.42 45.83 o
2 8 -5 31.29 4.31 92.89 o
3 8 -5 908.96 1110.33 42.61 o
4 8 -5 996.17 1011.40 40.89 o
5 8 -5 2.53 13.64 27.52 o
6 8 -5 368.50 646.91 38.43 o
-4 9 -5 1832.62 1765.59 45.37 o
-3 9 -5 498.06 480.53 36.80 o
-2 9 -5 2594.39 2462.79 35.99 o
-1 9 -5 1464.97 1353.60 45.08 o
0 9 -5 180.25 114.93 42.69 o
1 9 -5 1037.47 1137.02 45.52 o
2 9 -5 996.17 979.35 40.89 o
3 9 -5 100.21 41.14 38.90 o
4 9 -5 588.57 812.43 40.00 o
5 9 -5 505.98 734.33 39.74 o
-4 10 -5 1483.06 1457.91 40.82 o
-3 10 -5 2308.78 2256.66 39.61 o
-2 10 -5 163.28 131.10 33.11 o
-1 10 -5 1102.96 1143.49 39.11 o
0 10 -5 1014.84 1054.42 41.27 o
1 10 -5 41.96 6.01 37.38 o
2 10 -5 377.60 576.04 36.62 o
3 10 -5 519.31 669.40 42.94 o
-5 11 -5 1294.45 1190.16 38.13 o
-4 11 -5 85.47 27.03 37.02 o
-3 11 -5 1290.22 1381.86 38.07 o
-2 11 -5 1451.48 1352.76 35.89 o
-1 11 -5 4.75 23.62 46.19 o
0 11 -5 842.75 905.18 41.03 o
1 11 -5 798.89 748.46 39.94 o
2 11 -5 23.89 12.92 59.29 o
-5 12 -5 973.99 1009.95 36.75 o
-4 12 -5 959.34 871.14 36.48 o
-3 12 -5 66.03 21.16 60.29 o
-2 12 -5 717.84 733.38 41.02 o
-1 12 -5 959.34 1062.40 43.77 o
0 12 -5 60.42 3.09 38.45 o
-6 13 -5 779.04 798.01 39.45 o
-5 13 -5 17.48 39.32 67.95 o
-4 13 -5 880.77 921.25 38.45 o
-3 13 -5 549.25 635.30 35.88 o
-2 13 -5 45.06 19.96 49.02 o
-6 14 -5 662.16 745.74 39.40 o
-5 14 -5 818.98 910.92 37.07 o
0 1 -4 1244.10 1120.99 87.23 o
1 1 -4 6207.47 6220.69 92.79 o
-1 2 -4 7780.84 7512.30 103.88 o
0 2 -4 2624.47 2620.89 60.33 o
1 2 -4 3851.98 3671.98 58.47 o
2 2 -4 12596.46 12684.47 92.52 o
-1 3 -4 2169.48 2227.07 60.34 o
0 3 -4 6319.32 6289.43 56.17 o
1 3 -4 1211.09 1155.20 57.38 o
2 3 -4 4910.17 4650.36 57.77 o
3 3 -4 11221.86 11811.21 87.33 o
-2 4 -4 11700.95 11481.70 89.17 o
-1 4 -4 829.13 1007.90 44.08 o
0 4 -4 3815.52 3785.95 58.20 o
1 4 -4 4142.31 4051.74 53.06 o
2 4 -4 1146.41 1079.51 47.85 o
3 4 -4 2120.39 2074.60 48.81 o
4 4 -4 1842.71 1834.13 65.72 o
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0 5 -4 1451.48 1533.25 49.35 o
1 5 -4 1380.58 1399.46 48.13 o
2 5 -4 4044.36 4005.86 52.43 o
3 5 -4 588.57 530.05 45.71 o
4 5 -4 653.10 603.12 36.12 o
5 5 -4 4333.97 4736.38 62.02 o
-3 6 -4 7021.22 7176.39 78.95 o
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0 6 -4 6641.63 6427.77 47.99 o
1 6 -4 1095.15 1010.65 42.87 o
2 6 -4 577.20 613.16 45.27 o
3 6 -4 3202.21 3073.43 46.65 o
4 6 -4 1337.17 1511.91 47.37 o
5 6 -4 743.30 839.87 41.74 o
6 6 -4 1384.96 1840.22 61.36 o
-3 7 -4 1219.30 1124.84 41.12 o
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-1 7 -4 2131.25 2146.38 38.06 o
0 7 -4 818.98 790.15 43.81 o
1 7 -4 2721.89 2621.23 49.15 o
2 7 -4 1003.62 979.57 44.77 o
3 7 -4 752.96 693.98 48.47 o
4 7 -4 2564.48 2793.40 47.71 o
5 7 -4 524.69 489.22 40.46 o
6 7 -4 267.97 313.00 38.56 o
7 7 -4 1060.36 1295.23 57.52 o
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1 8 -4 842.75 791.29 44.44 o
2 8 -4 3391.53 3346.60 48.01 o
3 8 -4 665.20 550.78 42.52 o
4 8 -4 193.12 146.45 40.92 o
5 8 -4 808.90 1000.14 40.19 o
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4 9 -4 503.33 522.52 39.63 o
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0 10 -4 377.60 415.65 38.90 o
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2 10 -4 161.77 77.73 38.95 o
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-4 11 -4 2909.33 2716.71 44.47 o
-3 11 -4 656.12 666.16 39.22 o
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-1 11 -4 1873.17 1838.71 50.97 o
0 11 -4 568.74 502.87 39.32 o
1 11 -4 391.45 469.57 41.94 o
2 11 -4 970.32 1073.85 44.02 o
3 11 -4 42.72 119.58 43.11 o
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-5 12 -4 516.63 520.25 37.48 o
-4 12 -4 749.74 698.26 38.70 o
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-2 12 -4 403.19 410.08 33.11 o
-1 12 -4 363.99 354.79 35.95 o
0 12 -4 1186.63 1364.09 40.57 o
1 12 -4 170.89 158.78 35.41 o
-6 13 -4 689.72 618.42 40.21 o
-5 13 -4 2055.81 1924.58 42.72 o
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-2 13 -4 1186.63 1142.70 44.63 o
-1 13 -4 341.87 316.03 41.37 o
-7 14 -4 1003.62 989.46 55.96 o
-6 14 -4 126.49 107.95 39.74 o
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0 2 -3 9462.87 9435.64 57.28 o
1 2 -3 6593.73 6582.44 66.94 o
-1 3 -3 10850.71 11157.43 61.34 o
0 3 -3 1290.22 1213.75 50.76 o
1 3 -3 16614.76 16647.67 75.90 o
2 3 -3 6786.38 6919.53 67.91 o
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