#------------------------------------------------------------------------------
#$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $
#$Revision: 26025 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2203669.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_2203669_Fobs
loop_
_publ_author_name
'Tursina, Anna I.'
'Nesterenko, Sergei N.'
'Seropegin, Yuri D.'
_publ_section_title
;
 Intermetallic CePdIn
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i64
_journal_page_last               i65
_journal_volume                  60
_journal_year                    2004
_space_group_IT_number           189
_symmetry_space_group_name_Hall  'P -6 -2'
_symmetry_space_group_name_H-M   'P -6 2 m'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_length_a                   7.7036
_cell_length_b                   7.7036
_cell_length_c                   4.0190
_exptl_crystal_F_000             459.00
_reflns_d_resolution_high        0.7814
_[local]_cod_data_source_file    wm6014Isup2.hkl
_[local]_cod_data_source_block   I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     '  36 in P -6 2 m'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            329.40
_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'
'y, x, z'
'y, x, -z'
'x-y, -y, -z'
'x-y, -y, z'
'-x, -x+y, z'
'-x, -x+y, -z'
'-y, x-y, z'
'-y, x-y, -z'
'-x+y, -x, -z'
'-x+y, -x, 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
0 1 0 66.22 40.17 68.73 o
1 1 0 517.44 405.18 138.46 o
-1 2 0 289.87 508.74 159.82 o
0 2 0 2718.52 2433.18 190.34 o
1 2 0 21769.47 20662.56 937.42 o
2 2 0 6769.25 6408.79 339.86 o
-1 3 0 21652.12 22231.62 464.75 o
0 3 0 33435.49 32009.92 836.12 o
1 3 0 8747.38 7991.01 329.25 o
2 3 0 2609.35 3001.62 188.18 o
3 3 0 12932.94 13495.57 801.19 o
-2 4 0 7085.48 7116.54 467.74 o
-1 4 0 8451.72 8331.47 884.02 o
0 4 0 7628.46 7582.39 407.01 o
1 4 0 8534.42 8369.72 374.64 o
2 4 0 6654.64 7127.43 539.14 o
3 4 0 1369.11 1558.45 285.39 o
4 4 0 9195.06 9693.74 644.71 o
-2 5 0 2901.54 2786.05 239.85 o
-1 5 0 8871.96 8925.74 441.50 o
0 5 0 14302.12 13963.26 421.29 o
1 5 0 3038.80 3085.65 234.11 o
2 5 0 10705.83 10753.15 422.82 o
3 5 0 1250.96 1280.93 204.52 o
4 5 0 640.21 710.74 192.57 o
-3 6 0 12251.01 12314.42 729.64 o
-2 6 0 6478.78 6363.09 410.88 o
-1 6 0 3258.86 3719.05 320.89 o
0 6 0 153.30 173.91 148.79 o
1 6 0 2363.24 2956.33 304.95 o
2 6 0 3400.89 3602.82 286.77 o
3 6 0 6040.07 5826.59 404.05 o
-3 7 0 1315.04 1292.69 217.65 o
-2 7 0 10448.48 9722.77 555.53 o
-1 7 0 2598.89 2787.83 531.34 o
0 7 0 6136.71 5646.74 417.88 o
1 7 0 3707.00 3967.75 306.28 o
2 7 0 434.12 381.50 213.90 o
-4 8 0 10222.41 9178.29 845.95 o
-3 8 0 1223.46 1285.70 276.61 o
-2 8 0 3303.69 3420.52 392.28 o
-1 8 0 3965.07 4238.53 644.71 o
0 8 0 3026.27 2999.47 307.35 o
-4 9 0 608.09 569.41 249.63 o
-3 9 0 5608.62 6512.61 874.82 o
-2 9 0 502.82 954.36 250.86 o
0 0 1 323.48 321.31 171.53 o
0 1 1 2.49 -59.48 85.22 o
1 1 1 31402.26 31667.17 531.87 o
-1 2 1 31117.50 29595.78 732.99 o
0 2 1 38687.48 40415.87 931.92 o
1 2 1 7774.16 7747.86 315.95 o
2 2 1 1428.53 1411.48 204.91 o
-1 3 1 8234.94 7302.84 338.13 o
0 3 1 346.94 481.55 102.43 o
1 3 1 8665.75 8590.49 346.02 o
2 3 1 20831.25 19735.66 588.77 o
3 3 1 509.88 348.37 214.49 o
-2 4 1 1416.71 1368.92 274.45 o
-1 4 1 8281.87 8744.85 456.03 o
0 4 1 1639.59 1704.90 193.96 o
1 4 1 5592.70 5904.45 287.67 o
2 4 1 4179.36 4139.77 266.89 o
3 4 1 1175.54 1257.39 181.63 o
4 4 1 16177.47 17043.81 816.78 o
-2 5 1 20701.30 18082.24 645.40 o
-1 5 1 5434.19 5382.30 868.13 o
0 5 1 11353.97 10057.94 380.38 o
1 5 1 6375.55 5544.18 316.08 o
2 5 1 5398.98 5691.83 334.76 o
3 5 1 1074.66 1248.34 197.96 o
4 5 1 385.97 526.16 186.28 o
-3 6 1 654.80 978.16 320.47 o
-2 6 1 4708.73 3889.26 376.62 o
-1 6 1 5960.34 5440.53 424.74 o
0 6 1 699.38 727.32 164.46 o
1 6 1 6587.56 6519.84 363.23 o
2 6 1 2200.25 2322.15 245.52 o
3 6 1 585.75 472.81 196.46 o
-3 7 1 1096.07 781.22 431.76 o
-2 7 1 5729.17 4828.38 472.76 o
-1 7 1 6118.36 4933.54 517.95 o
0 7 1 5940.32 6554.97 373.28 o
1 7 1 2218.57 2201.06 256.42 o
2 7 1 5861.72 6282.32 397.00 o
-4 8 1 15534.88 15863.91 1055.98 o
-3 8 1 1041.13 935.84 227.60 o
-2 8 1 2509.94 2360.10 330.67 o
-1 8 1 2099.31 1159.13 370.02 o
0 8 1 163.67 -23.12 187.96 o
-4 9 1 350.72 655.65 202.26 o
-3 9 1 695.80 665.64 213.59 o
-2 9 1 5885.06 5871.16 561.95 o
0 0 2 108504.62 107877.73 1384.82 o
0 1 2 32.04 81.14 94.70 o
1 1 2 270.94 104.96 148.25 o
-1 2 2 122.24 105.43 230.11 o
0 2 2 1768.84 2221.76 313.34 o
1 2 2 14559.20 15876.95 348.24 o
2 2 2 4634.89 5026.79 334.25 o
-1 3 2 14466.11 14630.17 712.91 o
0 3 2 22297.29 23217.55 1115.83 o
1 3 2 6458.56 6970.49 437.31 o
2 3 2 1925.46 2132.98 191.76 o
3 3 2 10172.35 10008.84 555.20 o
-2 4 2 4879.64 3732.73 502.89 o
-1 4 2 6224.87 6213.34 391.84 o
0 4 2 5460.71 6013.00 585.15 o
1 4 2 6268.81 6704.21 503.15 o
2 4 2 5331.80 5123.04 306.81 o
3 4 2 1108.58 1228.51 191.79 o
4 4 2 7621.83 7989.83 832.98 o
-2 5 2 2163.36 2169.65 279.48 o
-1 5 2 6546.01 6124.08 537.19 o
0 5 2 11222.91 11373.35 522.79 o
1 5 2 2414.24 2794.19 244.19 o
2 5 2 8777.60 9106.85 420.29 o
3 5 2 1038.88 1325.52 200.37 o
4 5 2 542.48 542.47 223.12 o
-3 6 2 9594.67 8645.28 732.99 o
-2 6 2 5183.35 4577.86 427.47 o
-1 6 2 2600.26 2692.54 346.15 o
0 6 2 116.34 1.90 125.74 o
1 6 2 1955.83 1893.99 235.67 o
2 6 2 2880.91 2720.35 288.05 o
-3 7 2 1062.69 383.12 272.92 o
-2 7 2 8558.52 8728.31 588.68 o
-1 7 2 2161.97 2189.66 779.85 o
0 7 2 5134.07 5518.19 350.52 o
1 7 2 3136.16 3447.39 271.84 o
-4 8 2 8534.67 7454.59 889.46 o
-3 8 2 1014.77 1480.92 255.20 o
-2 8 2 2793.41 3095.45 407.31 o
-1 8 2 3369.56 3093.57 423.19 o
-4 9 2 513.64 709.93 618.36 o
0 0 3 65.90 340.56 158.98 o
0 1 3 6.93 36.64 110.90 o
1 1 3 15376.19 16715.61 536.67 o
-1 2 3 15189.04 18031.08 849.30 o
0 2 3 18711.34 19669.82 478.87 o
1 2 3 3678.81 4357.92 343.24 o
2 2 3 848.56 343.12 452.26 o
-1 3 3 3972.56 4212.43 334.70 o
0 3 3 148.13 211.43 135.34 o
1 3 3 5288.34 6106.38 284.90 o
2 3 3 12603.97 12965.88 426.46 o
3 3 3 368.57 173.12 257.08 o
-2 4 3 838.68 1100.32 360.64 o
-1 4 3 5030.37 4945.60 420.82 o
0 4 3 978.18 949.43 177.94 o
1 4 3 3503.42 3684.25 330.93 o
2 4 3 2710.68 3297.60 244.01 o
3 4 3 815.50 575.91 191.91 o
4 4 3 11707.43 11934.58 748.82 o
-2 5 3 12517.99 12323.79 858.08 o
-1 5 3 3389.08 4000.67 829.64 o
0 5 3 7459.57 8283.25 362.19 o
1 5 3 4196.33 4265.28 355.91 o
2 5 3 3708.76 3966.81 316.25 o
-3 6 3 478.13 799.09 326.33 o
-2 6 3 3105.51 2964.08 375.83 o
-1 6 3 3879.97 3180.77 416.72 o
0 6 3 507.47 828.30 179.72 o
1 6 3 4644.41 4443.50 489.74 o
-3 7 3 752.34 459.34 446.82 o
-2 7 3 3967.75 3466.33 421.26 o
-1 7 3 4268.57 4724.23 445.70 o
-4 8 3 11184.21 8674.57 1005.77 o
0 0 4 45984.00 46930.68 1417.45 o
0 1 4 4.44 115.51 129.36 o
1 1 4 153.52 -63.50 220.39 o
-1 2 4 67.96 463.56 370.68 o
0 2 4 917.11 1103.18 186.79 o
1 2 4 7068.51 7115.44 332.23 o
2 2 4 2346.38 2889.68 563.55 o
-1 3 4 7009.94 6691.89 521.09 o
0 3 4 10826.57 10974.88 401.28 o
1 3 4 3571.36 3545.51 269.73 o
2 3 4 1017.20 1152.01 223.24 o
3 3 4 5963.13 4799.55 522.77 o
-2 4 4 2504.50 2674.25 514.60 o
-1 4 4 3430.92 3345.95 547.65 o
0 4 4 2755.76 2754.56 258.60 o
1 4 4 3374.09 3172.94 288.24 o
2 4 4 3198.43 3506.89 300.66 o
-2 5 4 1172.21 1156.17 386.16 o
-1 5 4 3562.21 4070.61 1271.02 o
0 5 4 6469.99 6256.70 360.82 o
-3 6 4 5547.67 6955.89 743.87 o
-2 6 4 3092.45 2796.87 386.66 o
0 0 5 14.07 -265.25 295.37 o
0 1 5 6.75 33.24 212.56 o
1 1 5 7193.37 6177.48 1009.95 o
-1 2 5 7100.94 6444.63 730.48 o
0 2 5 8675.30 7501.62 379.46 o