#------------------------------------------------------------------------------
#$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/01/75/2017579.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_2017579_Fobs
loop_
_publ_author_name
'Pavlyuk, Volodymyr'
'Rozycka-Sokolowska, Ewa'
'Marciniak, Bernard'
_publ_section_title
;
 The new ternary phases of La~3~(Zn~0.874~Mg~0.126~)~11~ and
 Ce~3~(Zn~0.863~Mg~0.137~)~11~
;
_journal_coeditor_code           SQ3225
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              i25
_journal_page_last               i28
_journal_volume                  66
_journal_year                    2010
_space_group_IT_number           71
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   4.5992
_cell_length_b                   9.0514
_cell_length_c                   13.8635
_exptl_crystal_F_000             624.00
_reflns_d_resolution_high        0.8011
_[local]_cod_data_source_file    sq3225Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' la20mg15zn65 in Immm'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            711.71
_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'
'-x, y, -z'
'x, -y, -z'
'x+1/2, y+1/2, z+1/2'
'-x+1/2, -y+1/2, z+1/2'
'-x+1/2, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z+1/2'
'-x, -y, -z'
'x, y, -z'
'x, -y, z'
'-x, y, z'
'-x+1/2, -y+1/2, -z+1/2'
'x+1/2, y+1/2, -z+1/2'
'x+1/2, -y+1/2, z+1/2'
'-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
2 0 0 506529.09 488095.31 49156.84 o
4 0 0 192315.86 180548.42 1019.76 o
1 1 0 11216.38 12859.25 108.10 o
3 1 0 6080.41 5920.41 225.90 o
5 1 0 3908.64 3473.08 214.67 o
0 2 0 1771.29 2595.77 251.23 o
2 2 0 1307.36 1762.86 56.44 o
4 2 0 1439.76 1548.14 145.92 o
1 3 0 187876.44 190227.94 1346.40 o
3 3 0 98102.47 96345.47 997.56 o
5 3 0 40867.45 41392.30 426.18 o
0 4 0 59584.63 65024.09 686.04 o
2 4 0 42315.31 42502.89 566.71 o
4 4 0 20909.55 20315.50 278.02 o
1 5 0 24189.47 25624.71 199.56 o
3 5 0 15172.53 14503.91 279.90 o
5 5 0 7615.89 6974.14 802.55 o
0 6 0 71664.85 76363.58 605.85 o
2 6 0 54178.66 52906.98 352.81 o
4 6 0 27330.01 27009.26 886.14 o
1 7 0 15346.80 15489.79 429.62 o
3 7 0 11097.73 11142.88 203.34 o
0 8 0 50355.39 50823.52 602.08 o
2 8 0 40456.38 40397.23 372.82 o
4 8 0 22739.11 22101.71 559.87 o
1 9 0 967.53 868.45 151.34 o
3 9 0 1040.95 653.47 161.83 o
0 10 0 11037.43 11023.67 886.44 o
2 10 0 9206.73 9115.68 263.33 o
1 11 0 50785.85 51703.11 555.38 o
1 0 1 748.01 805.23 75.45 o
3 0 1 329.55 428.84 114.46 o
5 0 1 123.27 139.25 223.76 o
2 1 1 456.32 484.26 46.63 o
4 1 1 218.64 214.02 95.96 o
1 2 1 912.11 957.63 38.44 o
3 2 1 257.48 233.91 57.02 o
5 2 1 22.97 82.85 164.23 o
0 3 1 1063.26 1230.82 67.54 o
2 3 1 627.49 584.75 40.80 o
4 3 1 192.69 207.01 90.46 o
1 4 1 48942.71 47366.88 142.00 o
3 4 1 24131.23 24025.82 213.09 o
5 4 1 8024.05 7890.03 391.02 o
0 5 1 25209.94 25988.58 232.50 o
2 5 1 17457.45 16911.82 178.87 o
4 5 1 6884.90 6665.44 283.08 o
1 6 1 3640.04 3755.93 97.31 o
3 6 1 2021.84 1998.00 89.66 o
0 7 1 22506.71 22789.77 374.73 o
2 7 1 16656.68 16420.56 152.78 o
4 7 1 7608.57 7179.24 340.09 o
1 8 1 463.19 549.13 93.88 o
3 8 1 187.12 147.27 93.24 o
0 9 1 3203.52 3506.18 194.64 o
2 9 1 2514.40 2407.82 116.96 o
1 10 1 2143.87 2230.37 172.39 o
0 11 1 721.37 474.70 237.45 o
2 0 2 6847.67 6867.22 226.20 o
4 0 2 3911.16 4093.92 240.74 o
1 1 2 244.63 367.72 63.36 o
3 1 2 238.00 404.77 91.79 o
5 1 2 297.39 546.81 173.25 o
0 2 2 340.75 492.79 51.66 o
2 2 2 290.80 492.40 114.83 o
4 2 2 315.58 402.47 130.83 o
1 3 2 58759.72 58224.75 192.20 o
3 3 2 29340.19 28639.18 172.03 o
5 3 2 10860.23 10263.66 242.71 o
0 4 2 100.49 118.48 58.25 o
2 4 2 21.31 73.21 57.24 o
4 4 2 39.98 130.12 169.04 o
1 5 2 823.82 976.68 61.35 o
3 5 2 760.64 904.44 71.88 o
5 5 2 643.67 655.39 251.96 o
0 6 2 420.53 522.34 126.62 o
2 6 2 485.36 643.42 63.76 o
4 6 2 588.73 786.80 222.31 o
1 7 2 4331.43 4401.23 108.14 o
3 7 2 2867.26 3035.29 111.97 o
0 8 2 9793.50 10186.75 232.11 o
2 8 2 7869.97 7873.49 137.36 o
4 8 2 4477.47 3878.06 276.81 o
1 9 2 2911.81 3151.45 128.74 o
3 9 2 2073.47 1734.74 138.45 o
0 10 2 26.75 130.76 173.70 o
2 10 2 3.31 59.58 173.99 o
1 11 2 5785.48 5764.94 299.36 o
1 0 3 48376.52 48945.10 569.45 o
3 0 3 24336.62 24373.37 713.69 o
5 0 3 10857.21 11581.68 367.44 o
0 1 3 6280.81 6816.68 176.89 o
2 1 3 4433.33 4691.57 80.85 o
4 1 3 3100.56 3332.97 175.98 o
1 2 3 180541.97 181921.03 2032.97 o
3 2 3 88302.71 85110.40 583.32 o
5 2 3 32949.76 33112.06 365.42 o
0 3 3 96067.50 94888.21 887.14 o
2 3 3 65978.93 64987.62 239.63 o
4 3 3 29836.17 29052.47 304.06 o
1 4 3 1897.06 1528.91 67.02 o
3 4 3 555.02 496.80 80.19 o
5 4 3 17.55 119.20 247.31 o
0 5 3 65045.80 63506.43 670.96 o
2 5 3 49243.12 48375.12 237.38 o
4 5 3 25624.25 26794.57 1127.89 o
1 6 3 70079.83 68536.69 270.11 o
3 6 3 42466.44 43375.89 359.87 o
0 7 3 7112.35 7095.27 196.58 o
2 7 3 4662.48 4797.21 106.29 o
4 7 3 1462.65 1691.91 215.54 o
1 8 3 53000.16 53227.25 308.32 o
3 8 3 33276.76 34004.04 287.05 o
0 9 3 33139.88 34192.21 418.52 o
2 9 3 26892.96 27098.48 242.64 o
1 10 3 55.25 109.33 126.44 o
0 11 3 4999.79 4862.05 501.14 o
0 0 4 876.87 740.74 148.99 o
2 0 4 624.69 421.30 133.02 o
4 0 4 137.35 634.27 203.00 o
1 1 4 68992.66 67899.49 455.43 o
3 1 4 34629.16 33948.71 507.29 o
5 1 4 13655.17 13885.28 304.05 o
0 2 4 111177.61 110222.10 2048.08 o
2 2 4 75055.84 75060.23 642.07 o
4 2 4 32495.35 33730.10 593.52 o
1 3 4 13220.18 11986.58 329.65 o
3 3 4 5292.36 4908.73 104.74 o
5 3 4 954.78 842.36 170.29 o
0 4 4 27499.55 27573.92 310.40 o
2 4 4 19869.52 19640.18 145.92 o
4 4 4 9504.58 9628.27 411.56 o
1 5 4 42607.49 42377.63 243.27 o
3 5 4 24619.80 24452.75 202.37 o
0 6 4 26889.36 26908.25 474.77 o
2 6 4 20325.34 20136.63 184.00 o
4 6 4 10007.87 9395.12 347.65 o
1 7 4 1653.91 1694.38 87.98 o
3 7 4 1395.34 1308.87 119.49 o
0 8 4 299.54 360.49 145.52 o
2 8 4 324.47 461.89 109.71 o
1 9 4 14157.43 14484.20 235.48 o
3 9 4 9646.73 9751.57 262.80 o
0 10 4 12600.46 13444.90 319.17 o
2 10 4 10176.68 10529.59 390.82 o
1 0 5 37916.18 37735.53 448.19 o
3 0 5 19962.73 20196.49 416.42 o
5 0 5 8283.80 8432.84 389.98 o
0 1 5 10927.37 10520.20 161.53 o
2 1 5 7649.40 7752.12 146.68 o
4 1 5 3810.77 3947.16 172.34 o
1 2 5 1181.13 1074.23 66.61 o
3 2 5 216.34 211.63 83.29 o
5 2 5 20.87 -10.78 486.19 o
0 3 5 14093.29 13472.87 445.43 o
2 3 5 10605.31 10872.66 119.05 o
4 3 5 5802.28 5889.47 188.55 o
1 4 5 971.98 1015.88 74.70 o
3 4 5 940.54 1082.76 88.01 o
5 4 5 831.21 652.58 188.25 o
0 5 5 16635.45 16666.96 455.48 o
2 5 5 12528.59 12448.57 160.35 o
4 5 5 6316.96 5961.44 212.65 o
1 6 5 6842.86 7014.92 197.64 o
3 6 5 4688.23 4538.89 118.53 o
0 7 5 3378.70 3024.77 122.30 o
2 7 5 2905.81 2902.09 116.67 o
4 7 5 1959.80 1879.15 338.85 o
1 8 5 1261.48 1119.87 115.47 o
3 8 5 1217.03 1195.09 134.94 o
0 9 5 2928.14 2662.22 275.67 o
2 9 5 2541.30 2421.80 176.84 o
1 10 5 2075.84 2152.76 200.68 o
0 0 6 227835.11 237241.53 2765.84 o
2 0 6 154662.94 153491.66 700.98 o
4 0 6 62217.40 64116.27 965.50 o
1 1 6 1111.00 1005.16 80.51 o
3 1 6 417.72 401.48 101.15 o
5 1 6 55.84 308.72 238.32 o
0 2 6 1808.46 1585.85 167.05 o
2 2 6 1158.81 1075.16 83.78 o
4 2 6 286.91 244.91 138.76 o
1 3 6 35651.15 33683.93 366.35 o
3 3 6 20412.15 20094.17 207.50 o
5 3 6 8702.25 9499.41 270.58 o
0 4 6 2409.99 2444.61 128.84 o
2 4 6 1819.17 1875.79 98.87 o
4 4 6 944.00 942.24 149.71 o
1 5 6 3592.97 3724.93 92.32 o
3 5 6 2201.02 2146.14 103.52 o
0 6 6 19615.75 19499.46 409.90 o
2 6 6 14725.25 14723.66 218.02 o
4 6 6 6976.76 7049.60 295.91 o
1 7 6 139.64 297.43 98.92 o
3 7 6 30.34 129.24 122.56 o
0 8 6 10792.12 10649.96 343.62 o
2 8 6 8619.90 8784.74 196.23 o
1 9 6 331.38 392.51 160.73 o
0 10 6 355.78 153.75 258.60 o
1 0 7 48444.69 45447.56 651.84 o
3 0 7 28744.00 29853.23 540.22 o
5 0 7 13511.53 13948.05 459.86 o
0 1 7 45712.52 44810.30 527.37 o
2 1 7 34178.25 33352.58 186.07 o
4 1 7 18286.25 19321.54 522.59 o
1 2 7 23058.38 24059.26 320.70 o
3 2 7 13904.33 13413.37 212.09 o
5 2 7 6563.44 5713.12 366.34 o
0 3 7 37923.27 38043.49 829.26 o
2 3 7 28843.68 28561.01 460.68 o
4 3 7 15284.84 14782.38 248.34 o
1 4 7 144861.14 141327.66 725.67 o
3 4 7 84973.56 85613.65 352.50 o
0 5 7 260.55 109.36 119.11 o
2 5 7 45.81 235.27 103.06 o
4 5 7 89.57 146.30 189.45 o
1 6 7 3674.28 3667.34 127.14 o
3 6 7 3027.09 2928.09 127.88 o
0 7 7 87448.46 88278.59 774.64 o
2 7 7 69300.48 70927.22 581.44 o
1 8 7 13833.22 14175.45 414.31 o
3 8 7 9388.65 9313.17 217.17 o
0 9 7 1146.00 971.11 326.62 o
2 9 7 1101.06 1154.34 188.13 o
1 10 7 21213.70 21471.22 362.18 o
0 0 8 15559.83 15896.38 359.45 o
2 0 8 10280.73 10238.07 221.29 o
4 0 8 3382.77 3117.42 430.38 o
1 1 8 827.81 779.66 95.16 o
3 1 8 581.20 594.70 113.41 o
5 1 8 359.43 526.70 206.01 o
0 2 8 8991.68 7993.34 232.58 o
2 2 8 6723.70 6877.89 166.50 o
4 2 8 3344.11 3333.45 166.91 o
1 3 8 3534.33 3710.40 138.21 o
3 3 8 1991.32 1779.38 137.41 o
0 4 8 4949.76 4596.43 193.88 o
2 4 8 3347.93 3217.77 127.08 o
4 4 8 1143.30 1088.67 159.35 o
1 5 8 3255.36 3058.02 112.38 o
3 5 8 2224.79 2317.70 127.42 o
0 6 8 227.01 485.68 144.21 o
2 6 8 252.14 459.89 115.86 o
4 6 8 282.03 426.70 218.93 o
1 7 8 104.47 257.55 118.28 o
3 7 8 43.40 103.38 211.34 o
0 8 8 1345.82 1163.59 380.70 o
2 8 8 1128.90 1147.77 142.81 o
1 9 8 6282.73 5873.71 230.65 o
0 10 8 391.29 220.49 255.67 o
1 0 9 2868.78 2454.98 153.67 o
3 0 9 1420.25 1431.24 181.70 o
0 1 9 14375.71 14742.13 351.21 o
2 1 9 10512.17 11124.93 230.81 o
4 1 9 4835.93 5198.86 201.09 o
1 2 9 2775.11 2710.64 146.59 o
3 2 9 1166.66 1037.69 114.15 o
0 3 9 7210.59 7046.35 162.76 o
2 3 9 5019.90 5044.32 164.39 o
4 3 9 1897.70 2126.03 177.94 o
1 4 9 10823.07 10500.74 301.57 o
3 4 9 6752.13 6702.51 170.26 o
0 5 9 248.94 343.51 151.17 o
2 5 9 190.97 319.80 118.19 o
4 5 9 101.77 236.28 241.31 o
1 6 9 1500.49 1461.85 127.04 o
3 6 9 779.04 631.05 128.42 o
0 7 9 12811.85 12203.42 370.98 o
2 7 9 10216.95 10161.66 190.01 o
1 8 9 3834.10 3800.68 202.14 o
0 9 9 0.24 247.75 540.54 o
0 0 10 1463.82 1804.88 177.98 o
2 0 10 1366.59 1619.88 186.56 o
4 0 10 1103.89 918.11 210.57 o
1 1 10 58868.88 56124.44 991.61 o
3 1 10 36850.56 38243.50 291.33 o
0 2 10 75303.28 74222.03 481.37 o
2 2 10 58500.59 58822.20 346.55 o
4 2 10 30818.99 32946.94 360.68 o
1 3 10 347.59 587.94 124.36 o
3 3 10 8.97 43.91 129.47 o
0 4 10 35918.22 36850.44 404.87 o
2 4 10 28595.33 28881.06 449.72 o
4 4 10 15739.36 16090.80 339.49 o
1 5 10 35804.91 36113.75 435.91 o
3 5 10 23541.99 23920.36 488.37 o
0 6 10 25642.29 24651.43 388.89 o
2 6 10 20730.95 20657.27 393.05 o
1 7 10 8929.76 8603.67 198.36 o
3 7 10 6651.08 6334.18 390.83 o
0 8 10 2644.39 2105.23 278.20 o
2 8 10 2394.60 1994.98 166.43 o
1 9 10 15968.78 16079.34 423.17 o
1 0 11 1503.07 1774.23 174.90 o
3 0 11 695.44 835.10 197.90 o
0 1 11 1858.08 1955.83 144.80 o
2 1 11 1561.83 1546.21 136.07 o
4 1 11 970.85 1048.85 183.84 o
1 2 11 31709.64 30588.99 493.49 o
3 2 11 18493.87 18972.88 371.80 o
0 3 11 663.45 852.47 225.09 o
2 3 11 541.54 452.34 128.05 o
4 3 11 303.65 219.14 190.29 o
1 4 11 181.53 207.70 114.72 o
3 4 11 131.05 144.91 132.86 o
0 5 11 4065.00 3563.00 214.23 o
2 5 11 3375.15 3351.62 143.90 o
1 6 11 3818.46 3148.89 166.96 o
3 6 11 2517.74 2383.56 162.58 o
0 7 11 304.98 230.32 259.90 o
2 7 11 223.88 207.76 167.54 o
1 8 11 3695.33 3480.53 223.64 o
0 0 12 4897.35 5134.75 293.03 o
2 0 12 3207.95 3175.21 409.55 o
4 0 12 946.01 1134.85 346.00 o
1 1 12 9323.14 8868.36 182.29 o
3 1 12 6226.18 5920.14 212.81 o
0 2 12 3051.54 3528.29 230.63 o
2 2 12 2579.96 2523.08 176.25 o
4 2 12 1673.60 1270.50 204.23 o
1 3 12 1103.08 1275.43 163.35 o
3 3 12 807.02 494.32 147.17 o
0 4 12 9951.46 9696.42 387.49 o
2 4 12 8218.84 8116.68 180.67 o
1 5 12 74.68 78.90 142.53 o
3 5 12 129.21 89.71 231.20 o
0 6 12 399.67 563.17 256.46 o
2 6 12 220.88 305.27 153.88 o
1 7 12 14661.74 14932.23 331.81 o
0 8 12 257.19 386.34 286.62 o
1 0 13 3426.58 4113.85 392.09 o
3 0 13 2555.91 2317.18 346.98 o
0 1 13 11292.21 12186.38 645.25 o
2 1 13 9313.55 9091.90 287.87 o
1 2 13 8707.59 9290.41 300.76 o
3 2 13 5674.94 5587.67 207.91 o
0 3 13 4037.85 4140.46 344.80 o
2 3 13 3369.39 3259.40 157.86 o
1 4 13 34655.94 35216.04 732.96 o
3 4 13 22531.10 21944.02 526.14 o
0 5 13 79.24 163.89 208.22 o
2 5 13 27.00 -3.66 179.22 o
1 6 13 560.20 397.36 171.42 o
0 7 13 21571.28 23006.12 950.74 o
0 0 14 49962.52 56607.98 698.70 o
2 0 14 39600.44 41533.36 584.29 o
1 1 14 6325.42 7014.04 291.87 o
3 1 14 4553.83 4166.92 271.05 o
0 2 14 1513.24 1303.66 391.97 o
2 2 14 1387.58 848.08 202.78 o
1 3 14 10343.50 10657.70 319.03 o
3 3 14 7489.42 6666.60 234.92 o
0 4 14 19481.53 20058.75 749.70 o
2 4 14 15904.75 15385.60 646.31 o
1 5 14 3267.75 3038.39 210.30 o
0 6 14 7173.99 7270.67 712.34 o
1 0 15 1519.03 1734.57 391.97 o
0 1 15 7277.37 8121.24 419.33 o
2 1 15 5920.24 6273.80 570.25 o
1 2 15 1377.57 1291.05 181.31 o
0 3 15 1210.25 1453.85 226.35 o
2 3 15 850.07 713.09 193.22 o
1 4 15 1323.89 1080.44 158.82 o
0 5 15 4429.47 3990.22 285.07 o
0 0 16 167.56 175.68 355.86 o
2 0 16 155.28 -18.02 427.93 o
1 1 16 2922.74 3326.16 310.65 o
0 2 16 1771.92 1439.79 239.24 o
1 3 16 3072.78 3556.79 199.39 o
0 4 16 4023.34 3866.65 277.77 o
1 0 17 4347.21 4831.35 468.71 o
0 1 17 6667.66 7064.30 495.90 o