#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/58/2205827.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_2205827_Fobs
loop_
_publ_author_name
'Deng, Bin'
'Ibers, James A.'
_publ_section_title
;
 Dicerium disilicate, Ce~2~[Si~2~O~7~]
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i76
_journal_page_last               i78
_journal_volume                  61
_journal_year                    2005
_space_group_IT_number           76
_symmetry_space_group_name_Hall  'P 4w'
_symmetry_space_group_name_H-M   'P 41'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   6.7964
_cell_length_b                   6.7964
_cell_length_c                   24.7282
_exptl_crystal_F_000             1600.00
_reflns_d_resolution_high        0.7346
_[local]_cod_data_source_file    wm6067Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' Ce2Si2O7 in P4(1)'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            795.72
_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'
'-y, x, z+1/4'
'y, -x, z+3/4'
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
0 1 -31 3597.28 3970.53 251.84 o
1 1 -31 17302.92 18948.77 793.96 o
-1 2 -31 17693.98 17606.38 1003.47 o
0 2 -31 6588.90 6444.99 438.86 o
1 2 -31 15113.93 15262.77 1084.14 o
2 2 -31 2878.10 2786.44 438.42 o
-1 3 -31 3201.61 3013.82 460.21 o
0 3 -31 3021.63 3414.12 483.36 o
1 3 -31 6326.95 6385.05 592.96 o
0 1 -30 278.99 581.23 145.42 o
1 1 -30 27215.72 28802.12 689.71 o
-1 2 -30 706.53 629.89 154.76 o
0 2 -30 18342.88 19754.73 540.48 o
1 2 -30 3011.92 3239.66 238.25 o
2 2 -30 1103.71 885.38 161.88 o
-1 3 -30 13770.58 14125.69 710.06 o
0 3 -30 279.46 134.91 155.57 o
1 3 -30 2659.68 2565.70 258.41 o
2 3 -30 928.10 838.89 235.38 o
0 1 -29 2542.44 2440.60 202.52 o
1 1 -29 1000.78 984.98 149.14 o
-1 2 -29 7036.49 6955.01 300.76 o
0 2 -29 12004.44 12487.75 407.67 o
1 2 -29 13796.25 14081.61 436.53 o
2 2 -29 6374.65 6586.99 291.78 o
-2 3 -29 3831.40 4309.79 375.81 o
-1 3 -29 48.42 -3.68 156.63 o
0 3 -29 10147.17 10045.24 364.52 o
1 3 -29 16817.03 18481.84 513.95 o
2 3 -29 13080.64 13253.37 473.06 o
-2 4 -29 7357.46 9586.77 700.52 o
-1 4 -29 2501.08 2426.99 447.27 o
0 4 -29 214.89 168.15 295.46 o
1 4 -29 15850.28 16263.93 684.75 o
2 4 -29 7349.98 6910.47 439.58 o
0 0 -28 78201.99 85462.62 3100.28 o
0 1 -28 405.37 597.97 133.63 o
1 1 -28 4328.27 4396.67 242.48 o
-1 2 -28 4728.72 4827.98 258.18 o
0 2 -28 5319.23 5797.23 265.87 o
1 2 -28 486.95 493.92 142.31 o
2 2 -28 1981.46 1885.60 185.98 o
-2 3 -28 20827.23 22649.51 961.50 o
-1 3 -28 6080.34 6473.04 401.21 o
0 3 -28 2965.16 2833.16 218.11 o
1 3 -28 4289.83 4025.54 249.59 o
2 3 -28 17101.50 18972.74 518.21 o
3 3 -28 4473.81 4453.99 318.69 o
-2 4 -28 7857.18 8232.69 644.70 o
-1 4 -28 4813.81 4830.20 372.93 o
0 4 -28 158.58 58.17 157.69 o
1 4 -28 1462.98 1251.83 198.88 o
2 4 -28 6401.77 6214.88 331.17 o
3 4 -28 4346.44 4696.03 562.33 o
0 1 -27 2291.15 2102.86 179.16 o
1 1 -27 1203.27 1221.32 160.56 o
-1 2 -27 4490.18 4862.93 244.01 o
0 2 -27 3254.34 3294.20 221.71 o
1 2 -27 5153.46 5130.05 249.49 o
2 2 -27 33806.18 35816.86 790.22 o
-2 3 -27 5477.45 5379.31 321.51 o
-1 3 -27 5521.27 5198.93 258.19 o
0 3 -27 14051.31 15057.19 455.45 o
1 3 -27 3703.98 3531.16 232.47 o
2 3 -27 12351.06 12713.73 399.69 o
3 3 -27 2969.09 2713.50 249.02 o
-2 4 -27 727.78 797.39 182.07 o
-1 4 -27 8854.37 9284.37 451.03 o
0 4 -27 6632.81 6193.30 325.95 o
1 4 -27 9245.55 9486.74 770.07 o
2 4 -27 6898.63 6775.75 295.67 o
3 4 -27 3300.98 2720.15 325.08 o
1 5 -27 5516.04 4934.40 395.33 o
2 5 -27 8739.19 9494.86 718.91 o
0 1 -26 15353.69 16250.25 448.86 o
1 1 -26 11972.18 11903.98 495.29 o
-1 2 -26 176.66 124.53 106.50 o
0 2 -26 4093.88 3980.61 223.55 o
1 2 -26 8287.82 7886.74 297.79 o
2 2 -26 8023.16 7888.32 301.46 o
-2 3 -26 11618.25 11520.82 376.09 o
-1 3 -26 4745.26 4209.56 231.27 o
0 3 -26 257.87 424.12 120.73 o
1 3 -26 2001.13 2082.03 209.16 o
2 3 -26 6790.53 6616.73 335.27 o
3 3 -26 6390.18 6446.83 325.77 o
-3 4 -26 830.69 923.54 307.03 o
-2 4 -26 9985.99 10436.21 672.93 o
-1 4 -26 5180.88 4758.85 298.50 o
0 4 -26 9822.69 9831.97 732.22 o
1 4 -26 8325.74 8342.85 313.97 o
2 4 -26 2899.79 2747.58 213.96 o
3 4 -26 2189.93 2193.14 232.74 o
4 4 -26 4233.82 3919.94 522.16 o
0 5 -26 19932.63 20398.06 801.44 o
1 5 -26 47.32 47.25 150.49 o
2 5 -26 37241.29 39328.77 1744.16 o
0 1 -25 11806.70 12242.32 371.37 o
1 1 -25 21708.16 21852.52 542.10 o
-1 2 -25 7828.06 7879.75 295.56 o
0 2 -25 19542.53 21149.37 526.68 o
1 2 -25 832.93 626.55 223.03 o
2 2 -25 1399.22 1333.84 151.94 o
-2 3 -25 10863.96 10463.73 351.57 o
-1 3 -25 1397.32 1419.10 154.32 o
0 3 -25 21852.49 22338.40 582.01 o
1 3 -25 4159.25 4339.60 294.89 o
2 3 -25 2347.91 2093.05 219.71 o
3 3 -25 3552.50 3635.56 461.60 o
-3 4 -25 8048.13 7492.64 442.63 o
-2 4 -25 10603.97 11159.05 435.90 o
-1 4 -25 4291.02 4417.42 287.63 o
0 4 -25 6015.60 6264.96 314.02 o
1 4 -25 6727.81 6014.91 341.46 o
2 4 -25 2110.70 2054.89 190.27 o
3 4 -25 1637.82 1711.93 206.71 o
4 4 -25 11697.06 9891.08 737.97 o
-3 5 -25 13940.85 14259.66 914.97 o
-2 5 -25 5605.97 5508.39 395.79 o
-1 5 -25 5541.76 5354.85 494.25 o
0 5 -25 190.49 178.98 317.24 o
1 5 -25 1307.27 1862.50 402.57 o
2 5 -25 1051.15 1401.10 204.89 o
3 5 -25 961.75 1453.41 261.12 o
0 0 -24 1051.28 1202.94 268.91 o
0 1 -24 3189.74 3442.76 202.94 o
1 1 -24 1394.83 1246.56 135.53 o
-1 2 -24 5488.73 5658.24 241.56 o
0 2 -24 3495.73 3614.75 204.68 o
1 2 -24 4882.74 4453.31 219.97 o
2 2 -24 6896.10 6841.04 272.49 o
-2 3 -24 2633.13 2414.64 189.87 o
-1 3 -24 29818.14 31231.72 681.72 o
0 3 -24 50133.39 50610.30 1369.58 o
1 3 -24 9955.01 9577.56 326.42 o
2 3 -24 4389.61 4331.47 257.25 o
3 3 -24 13043.72 12935.40 391.47 o
-3 4 -24 654.66 858.28 177.44 o
-2 4 -24 20445.60 21062.15 775.88 o
-1 4 -24 53.77 6.42 122.61 o
0 4 -24 221.60 259.17 133.22 o
1 4 -24 18500.58 20065.59 520.59 o
2 4 -24 8213.17 8039.13 303.01 o
3 4 -24 12229.84 12801.39 573.00 o
4 4 -24 24201.62 27691.48 1326.16 o
-3 5 -24 633.46 989.57 311.12 o
-2 5 -24 3923.64 3029.58 322.53 o
-1 5 -24 3487.60 3526.63 348.33 o
0 5 -24 3279.82 2878.11 310.79 o
1 5 -24 163.05 -31.76 137.89 o
2 5 -24 3962.04 4305.78 299.64 o
3 5 -24 7634.87 7671.56 442.11 o
0 1 -23 2664.68 2629.50 179.55 o
1 1 -23 53910.81 56216.84 1064.87 o
-1 2 -23 15581.82 14778.24 411.76 o
0 2 -23 15045.57 14776.03 501.53 o
1 2 -23 14287.84 14501.98 405.14 o
2 2 -23 5642.05 5034.20 228.73 o
-2 3 -23 2121.90 2011.20 172.47 o
-1 3 -23 3125.67 3292.42 196.86 o
0 3 -23 5076.36 4613.95 244.87 o
1 3 -23 10030.69 9520.85 321.09 o
2 3 -23 8141.52 7855.99 385.19 o
3 3 -23 9141.80 9033.25 330.27 o
-3 4 -23 2393.16 2233.62 232.36 o
-2 4 -23 1178.93 1064.29 153.18 o
-1 4 -23 7614.20 7799.83 341.11 o
0 4 -23 4235.60 4242.14 255.39 o
1 4 -23 8756.33 8452.36 304.03 o
2 4 -23 2540.20 2182.31 182.91 o
3 4 -23 19948.34 20252.58 604.11 o
4 4 -23 16966.94 17449.31 855.63 o
-4 5 -23 2518.06 1910.27 402.34 o
-3 5 -23 13211.02 13377.47 554.10 o
-2 5 -23 16312.15 17102.62 810.18 o
-1 5 -23 4262.94 3575.19 490.16 o
0 5 -23 62.77 168.32 164.60 o
1 5 -23 6230.29 5939.44 392.26 o
2 5 -23 5772.72 5540.48 296.07 o
3 5 -23 12364.15 11883.50 560.97 o
4 5 -23 5761.55 6450.41 601.13 o
-3 6 -23 985.38 1211.79 386.00 o
-1 6 -23 11537.30 10381.24 782.22 o
0 6 -23 4157.86 4232.20 387.03 o
1 6 -23 8816.30 9010.94 496.79 o
2 6 -23 5391.01 4809.72 551.43 o
0 1 -22 9301.17 9089.82 297.96 o
1 1 -22 76793.66 80981.91 1442.29 o
-1 2 -22 53.10 166.47 90.86 o
0 2 -22 11078.76 10215.28 324.43 o
1 2 -22 8996.16 8484.12 294.08 o
2 2 -22 3510.19 3669.42 202.00 o
-2 3 -22 37730.55 39008.99 714.84 o
-1 3 -22 13257.28 13513.63 339.58 o
0 3 -22 361.96 319.67 102.32 o
1 3 -22 2570.21 2441.13 240.06 o
2 3 -22 12927.46 12726.42 372.02 o
3 3 -22 2274.76 1850.27 166.56 o
-3 4 -22 6518.96 6124.51 311.95 o
-2 4 -22 2075.19 1835.95 226.07 o
-1 4 -22 19307.44 19581.92 583.63 o
0 4 -22 3030.34 2533.76 189.04 o
1 4 -22 1453.35 1454.56 150.69 o
2 4 -22 1084.14 1085.80 138.89 o
3 4 -22 12330.97 12514.38 443.51 o
4 4 -22 2408.17 2618.20 300.49 o
-4 5 -22 533.44 419.51 169.46 o
-3 5 -22 3278.84 3123.83 260.89 o
-2 5 -22 1757.54 1891.35 211.21 o
-1 5 -22 9394.51 9160.34 476.33 o
0 5 -22 11447.98 11327.96 533.46 o
1 5 -22 517.00 505.77 152.17 o
2 5 -22 15789.10 16031.04 618.26 o
3 5 -22 4191.17 4199.78 514.67 o
4 5 -22 2632.13 2689.77 439.10 o
-3 6 -22 1741.78 1966.78 464.97 o
-2 6 -22 2469.36 2799.22 316.26 o
-1 6 -22 13768.17 13551.12 621.77 o
0 6 -22 3029.49 3094.88 639.59 o
1 6 -22 2053.22 2014.69 285.13 o
2 6 -22 9599.94 9538.79 502.72 o
0 1 -21 3104.24 3097.48 177.86 o
1 1 -21 20962.41 20791.71 495.74 o
-1 2 -21 3203.42 3039.54 201.14 o
0 2 -21 1798.77 1841.50 151.37 o
1 2 -21 13567.07 13921.01 446.80 o
2 2 -21 8599.79 8164.16 282.06 o
-2 3 -21 818.29 809.60 133.08 o
-1 3 -21 1263.58 1307.68 163.92 o
0 3 -21 14246.26 13945.50 384.42 o
1 3 -21 36860.32 38114.87 777.66 o
2 3 -21 32141.75 31934.71 691.83 o
3 3 -21 13676.50 13826.02 501.46 o
-3 4 -21 1251.21 1368.97 182.93 o
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0 4 -21 2163.20 2026.56 165.38 o
1 4 -21 38236.41 39412.78 934.28 o
2 4 -21 12010.60 11841.70 356.44 o
3 4 -21 5797.87 5720.39 304.45 o
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-2 5 -21 966.11 852.85 161.52 o
-1 5 -21 3852.28 3411.85 312.25 o
0 5 -21 27553.45 28713.81 1122.95 o
1 5 -21 4864.70 4632.01 266.26 o
2 5 -21 4579.08 4480.02 261.17 o
3 5 -21 553.35 299.96 183.63 o
4 5 -21 702.47 434.64 285.25 o
5 5 -21 9885.60 8828.38 676.02 o
-3 6 -21 1135.98 1563.94 398.26 o
-2 6 -21 14151.19 15596.85 542.79 o
-1 6 -21 5815.93 5793.46 403.47 o
0 6 -21 9408.89 9150.73 489.33 o
1 6 -21 2995.24 2755.05 311.30 o
2 6 -21 5374.51 5836.77 383.79 o
0 0 -20 160775.61 168754.92 5491.19 o
0 1 -20 1505.28 1525.56 131.09 o
1 1 -20 7294.76 7066.77 248.18 o
-1 2 -20 8261.99 8039.34 270.50 o
0 2 -20 8461.73 8453.62 277.63 o
1 2 -20 1032.23 1080.04 140.52 o
2 2 -20 921.78 980.03 249.40 o
-2 3 -20 28596.36 28589.71 617.21 o
-1 3 -20 15364.56 15327.21 447.74 o
0 3 -20 15077.83 14118.06 385.08 o
1 3 -20 12963.78 13075.01 361.92 o
2 3 -20 20418.52 20611.72 537.59 o
3 3 -20 6883.47 6718.74 227.69 o
-3 4 -20 19680.95 19293.96 587.33 o
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0 4 -20 508.76 467.65 107.69 o
1 4 -20 6885.61 6422.92 248.79 o
2 4 -20 3079.40 2825.06 247.09 o
3 4 -20 7487.98 7032.45 310.80 o
4 4 -20 4716.50 4779.51 481.13 o
-4 5 -20 6017.63 5988.45 488.46 o
-3 5 -20 1915.70 1726.51 222.73 o
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-1 5 -20 3541.17 3902.63 269.96 o
0 5 -20 12892.78 12964.45 563.94 o
1 5 -20 2420.10 2449.25 217.88 o
2 5 -20 2856.94 3427.89 249.10 o
3 5 -20 1642.48 1597.70 240.18 o
4 5 -20 3460.99 3552.24 361.54 o
5 5 -20 331.41 89.34 190.58 o
-3 6 -20 9540.83 9555.78 358.58 o
-2 6 -20 19726.53 19798.03 540.72 o
-1 6 -20 1556.13 1423.31 247.49 o
0 6 -20 2557.78 2242.54 282.78 o
1 6 -20 11756.18 11720.70 597.39 o
2 6 -20 4033.62 4188.10 362.19 o
-2 7 -20 7438.76 8356.60 680.10 o
0 7 -20 4586.33 4519.71 584.79 o
1 7 -20 1043.54 1255.36 377.83 o
0 1 -19 2069.70 1874.93 239.17 o
1 1 -19 3283.64 3566.98 302.56 o
-1 2 -19 24522.46 24646.03 548.81 o
0 2 -19 14597.63 14656.16 379.71 o
1 2 -19 23224.08 23053.23 521.46 o
2 2 -19 31853.04 32457.92 660.12 o
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0 3 -19 39525.46 40738.41 704.16 o
1 3 -19 14737.89 13723.75 480.50 o
2 3 -19 22677.62 23286.24 522.91 o
3 3 -19 6208.77 6027.86 214.62 o
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0 4 -19 3190.61 3126.47 188.27 o
1 4 -19 6421.22 6015.35 237.34 o
2 4 -19 9751.61 9453.31 305.09 o
3 4 -19 2048.50 1928.75 168.58 o
4 4 -19 20253.90 21667.93 2235.69 o
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0 5 -19 31017.42 32487.12 1028.38 o
1 5 -19 4109.14 3945.62 248.37 o
2 5 -19 8237.39 7634.20 365.23 o
3 5 -19 1982.00 2273.83 265.93 o
4 5 -19 2566.63 2654.95 393.48 o
5 5 -19 27081.58 29254.39 984.46 o
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-1 6 -19 647.77 420.36 150.56 o
0 6 -19 664.75 646.28 199.71 o
1 6 -19 90.63 217.93 177.86 o
2 6 -19 7330.18 8290.13 632.45 o
-2 7 -19 6847.22 6795.56 612.02 o
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0 7 -19 24126.52 25971.82 934.34 o
1 7 -19 4399.42 4516.74 525.56 o
2 7 -19 10903.31 11722.38 786.98 o
0 1 -18 21238.82 21625.78 479.74 o
1 1 -18 11235.36 10854.23 306.22 o
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1 2 -18 11731.22 11600.80 443.64 o
2 2 -18 15545.02 15017.21 345.74 o
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0 3 -18 2015.69 1553.15 117.03 o
1 3 -18 3496.70 3646.90 176.01 o
2 3 -18 10669.43 10272.51 311.30 o
3 3 -18 23768.82 23898.79 578.93 o
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0 4 -18 11148.45 10661.34 280.43 o
1 4 -18 11783.51 11428.07 329.16 o
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1 6 -18 629.22 687.67 193.49 o
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0 7 -18 5920.96 5913.14 410.18 o
1 7 -18 2317.72 2346.89 648.10 o
2 7 -18 15022.30 16585.21 956.50 o
0 1 -17 11603.30 11378.83 412.14 o
1 1 -17 40317.31 40523.07 895.86 o
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0 2 -17 43224.80 44036.21 733.53 o
1 2 -17 15835.68 14834.73 373.80 o
2 2 -17 1601.34 1461.54 115.19 o
-2 3 -17 18834.35 18841.68 399.17 o
-1 3 -17 1053.62 948.20 101.29 o
0 3 -17 37613.78 39327.20 670.47 o
1 3 -17 14.83 22.79 77.14 o
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0 3 28 2959.48 3092.61 308.56 o
1 3 28 4266.01 3537.34 490.85 o
2 3 28 17150.48 18046.09 578.08 o
3 3 28 4484.88 4591.61 269.24 o
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0 4 28 160.86 164.95 196.88 o
1 4 28 1460.00 1731.49 191.34 o
2 4 28 6391.44 6320.49 402.88 o
1 5 28 1381.28 1802.03 382.60 o
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0 2 29 11997.61 13463.14 780.18 o
1 2 29 13832.75 13349.45 800.60 o
2 2 29 6374.33 6136.12 873.10 o
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0 3 29 10146.77 9857.41 496.51 o
1 3 29 16799.88 18348.43 1008.24 o
2 3 29 13093.42 13453.72 485.47 o
3 3 29 4075.66 4591.37 281.74 o
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0 4 29 219.13 264.32 210.43 o
1 4 29 15891.79 16943.50 2047.11 o
2 4 29 7326.39 8476.41 682.14 o
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2 2 30 1103.59 1036.15 319.97 o
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0 3 30 281.02 234.19 291.37 o
1 3 30 2667.52 2948.47 468.38 o
2 3 30 927.54 480.14 211.25 o
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0 3 31 3019.60 3246.65 495.61 o
1 3 31 6355.11 6888.83 623.60 o
2 3 31 2733.28 3008.37 459.53 o