#------------------------------------------------------------------------------
#$Date: 2016-04-03 01:44:07 +0300 (Sun, 03 Apr 2016) $
#$Revision: 181088 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/21/68/2216819.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_2216819_Fobs
loop_
_publ_author_name
'Sahlberg, Martin'
'Gustafsson, Torbj\"orn'
'Andersson, Yvonne'
_publ_section_title
;
 YMgGa
;
_journal_coeditor_code           WM2155
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              i195
_journal_volume                  63
_journal_year                    2007
_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                   7.2689
_cell_length_b                   7.2689
_cell_length_c                   4.4205
_exptl_crystal_F_000             246.00
_reflns_d_resolution_high        0.6336
_cod_data_source_file            wm2155Isup2.hkl
_cod_data_source_block           I
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' p-62m in P-62m'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            123.24
_shelx_f_squared_multiplier      1.000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x, y, -z'
'-y, x-y, -z'
'-x+y, -x, -z'
'y, x, -z'
'x-y, -y, -z'
'-x, -x+y, -z'
'y, x, z'
'x-y, -y, z'
'-x, -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
0 1 0 287.05 332.63 8.83 o
1 1 0 2710.98 2829.50 44.85 o
-1 2 0 2222.65 2677.56 50.25 o
0 2 0 3664.03 3714.24 42.67 o
1 2 0 3637.24 3784.64 48.29 o
2 2 0 6793.52 6707.86 104.47 o
-1 3 0 3604.59 3777.47 48.56 o
0 3 0 8353.51 7987.36 100.95 o
1 3 0 4250.42 4014.28 61.49 o
2 3 0 264.12 305.67 19.76 o
3 3 0 3648.57 3353.64 86.71 o
-2 4 0 6883.14 6595.37 102.84 o
-1 4 0 4130.06 3999.20 58.44 o
0 4 0 950.70 972.60 29.79 o
1 4 0 2911.70 3044.91 65.07 o
2 4 0 944.23 970.69 46.11 o
3 4 0 116.39 157.28 23.39 o
4 4 0 1630.48 1735.29 116.56 o
-2 5 0 342.88 335.59 22.79 o
-1 5 0 3258.19 3064.47 54.48 o
0 5 0 2834.05 2742.80 53.50 o
1 5 0 1000.59 946.31 49.94 o
2 5 0 5175.32 4822.67 109.76 o
3 5 0 311.73 291.43 34.43 o
4 5 0 292.75 328.83 40.53 o
5 5 0 1253.17 1234.74 136.68 o
-3 6 0 3348.66 3176.30 142.97 o
-2 6 0 875.36 893.33 40.06 o
-1 6 0 1133.01 1049.92 50.34 o
0 6 0 476.49 427.24 35.82 o
1 6 0 367.75 422.76 37.96 o
2 6 0 1069.52 939.29 71.91 o
3 6 0 843.14 839.17 69.10 o
4 6 0 900.58 824.67 77.59 o
5 6 0 113.49 121.67 30.18 o
-3 7 0 117.07 136.82 17.93 o
-2 7 0 4944.85 4785.54 116.09 o
-1 7 0 429.18 379.67 35.58 o
0 7 0 1926.08 1912.32 84.13 o
1 7 0 456.71 378.99 40.60 o
2 7 0 459.76 509.63 50.58 o
3 7 0 25.38 67.62 23.34 o
4 7 0 519.92 568.98 62.56 o
-4 8 0 2067.80 1809.37 93.04 o
-3 8 0 285.30 312.23 33.67 o
-2 8 0 1041.77 1061.53 68.13 o
-1 8 0 464.91 468.37 55.80 o
0 8 0 1.95 -6.83 16.85 o
1 8 0 557.25 595.91 56.66 o
2 8 0 332.73 347.69 38.36 o
3 8 0 595.63 615.03 124.53 o
-4 9 0 280.04 326.20 38.93 o
-3 9 0 781.31 859.99 62.12 o
-2 9 0 525.70 494.55 45.71 o
-1 9 0 520.41 565.95 58.95 o
0 9 0 2130.43 2436.80 164.05 o
1 9 0 273.25 288.51 57.34 o
-5 10 0 1168.86 1138.93 116.65 o
-4 10 0 856.72 828.17 71.54 o
-3 10 0 44.30 64.58 19.44 o
-2 10 0 384.26 373.32 45.07 o
-1 10 0 271.44 383.73 46.24 o
-5 11 0 147.83 125.08 38.53 o
-4 11 0 529.56 495.43 59.10 o
0 0 1 1931.17 1981.29 57.27 o
0 1 1 329.49 413.36 8.98 o
1 1 1 7610.37 7887.52 66.53 o
-1 2 1 7425.71 7901.37 66.66 o
0 2 1 15187.11 14787.89 75.98 o
1 2 1 1849.44 2059.85 30.10 o
2 2 1 275.03 284.93 14.41 o
-1 3 1 2262.46 2191.14 25.74 o
0 3 1 140.61 173.73 7.89 o
1 3 1 3498.02 3264.51 43.58 o
2 3 1 4596.18 4408.70 64.74 o
3 3 1 2167.31 1997.26 58.10 o
-2 4 1 266.60 303.75 18.24 o
-1 4 1 3229.59 3270.10 38.31 o
0 4 1 836.24 806.96 20.24 o
1 4 1 2029.38 1924.23 36.65 o
2 4 1 1215.77 1299.84 34.51 o
3 4 1 970.30 959.09 35.13 o
4 4 1 3089.37 2924.51 112.99 o
-2 5 1 4515.97 4362.95 49.03 o
-1 5 1 1876.50 1883.52 32.07 o
0 5 1 4750.55 4418.95 66.09 o
1 5 1 1531.06 1348.59 40.81 o
2 5 1 733.86 779.57 37.35 o
3 5 1 514.33 470.80 32.45 o
4 5 1 669.33 742.14 44.79 o
5 5 1 111.58 127.06 34.77 o
-3 6 1 2349.53 2072.18 63.10 o
-2 6 1 1418.66 1327.99 36.37 o
-1 6 1 1309.42 1426.56 37.55 o
0 6 1 545.87 558.06 28.60 o
1 6 1 331.29 375.94 24.20 o
2 6 1 434.41 485.81 33.38 o
3 6 1 356.99 380.19 31.05 o
4 6 1 569.40 677.94 46.52 o
5 6 1 343.12 336.45 32.89 o
-3 7 1 958.11 1004.07 39.90 o
-2 7 1 844.01 734.00 36.85 o
-1 7 1 315.02 305.89 21.86 o
0 7 1 3759.61 3567.69 74.42 o
1 7 1 535.24 513.11 32.07 o
2 7 1 1938.08 1920.19 66.10 o
3 7 1 609.98 559.44 38.71 o
4 7 1 23.74 11.33 17.04 o
-4 8 1 2823.94 2727.74 89.13 o
-3 8 1 470.33 438.40 28.17 o
-2 8 1 565.71 515.92 30.42 o
-1 8 1 522.77 573.61 36.90 o
0 8 1 1.13 11.75 11.99 o
1 8 1 354.21 321.38 29.69 o
2 8 1 268.28 298.62 36.08 o
-4 9 1 652.96 615.88 37.65 o
-3 9 1 409.42 398.25 28.05 o
-2 9 1 1850.87 1888.03 65.39 o
-1 9 1 325.38 374.38 29.30 o
0 9 1 83.05 79.79 17.75 o
1 9 1 129.02 139.20 21.56 o
-5 10 1 134.64 104.04 25.29 o
-4 10 1 681.83 690.33 44.72 o
-3 10 1 565.85 606.68 37.75 o
-2 10 1 265.47 298.23 24.52 o
-1 10 1 176.50 147.94 21.91 o
-5 11 1 299.88 264.28 25.56 o
-4 11 1 20.76 32.50 21.14 o
0 1 2 175.16 195.80 8.46 o
1 1 2 1806.85 1646.03 35.69 o
-1 2 2 1429.67 1593.73 30.98 o
0 2 2 2396.46 2329.58 29.20 o
1 2 2 2437.85 2470.35 34.88 o
2 2 2 4873.16 4635.94 66.24 o
-1 3 2 2412.99 2477.28 30.27 o
0 3 2 5816.25 5753.64 52.36 o
1 3 2 3091.32 2991.41 41.62 o
2 3 2 208.87 252.79 15.66 o
3 3 2 2799.12 2470.81 64.88 o
-2 4 2 4945.81 4551.32 68.26 o
-1 4 2 2996.53 2956.41 38.07 o
0 4 2 671.50 755.18 23.09 o
1 4 2 2134.51 2203.37 44.07 o
2 4 2 738.52 720.75 33.85 o
3 4 2 92.59 91.82 15.07 o
4 4 2 1294.71 1503.54 77.56 o
-2 5 2 271.27 255.37 14.84 o
-1 5 2 2410.86 2224.23 38.26 o
0 5 2 2184.15 2166.46 43.34 o
1 5 2 799.96 837.37 36.90 o
2 5 2 4128.68 3834.28 69.25 o
3 5 2 258.07 238.06 20.05 o
4 5 2 238.79 245.21 23.04 o
5 5 2 1041.50 960.81 77.67 o
-3 6 2 2558.20 2436.83 64.12 o
-2 6 2 683.85 722.78 28.59 o
-1 6 2 905.64 834.13 31.59 o
0 6 2 363.83 398.31 23.58 o
1 6 2 285.36 309.01 22.19 o
2 6 2 868.84 905.32 44.31 o
3 6 2 685.83 706.56 44.78 o
4 6 2 748.74 811.87 47.74 o
-3 7 2 93.13 54.64 9.40 o
-2 7 2 3941.93 3786.19 68.70 o
-1 7 2 335.15 336.93 23.54 o
0 7 2 1580.11 1462.37 54.85 o
1 7 2 359.61 359.21 26.80 o
2 7 2 386.08 459.51 32.92 o
3 7 2 20.37 53.93 18.04 o
-4 8 2 1652.96 1368.12 75.75 o
-3 8 2 236.31 241.53 20.26 o
-2 8 2 846.24 864.08 41.29 o
-1 8 2 366.40 388.74 29.31 o
0 8 2 2.17 26.59 12.83 o
1 8 2 465.09 498.86 37.64 o
2 8 2 279.04 369.43 31.05 o
-4 9 2 228.24 239.74 20.39 o
-3 9 2 633.89 709.08 40.42 o
-2 9 2 440.92 415.70 32.92 o
-1 9 2 434.25 488.31 34.02 o
0 9 2 1765.58 1851.62 74.48 o
-5 10 2 970.43 1093.62 74.93 o
-4 10 2 712.11 772.04 40.82 o
-3 10 2 36.28 24.78 13.85 o
-2 10 2 323.49 348.22 29.75 o
0 0 3 914.95 958.26 81.22 o
0 1 3 164.78 169.09 11.20 o
1 1 3 3596.64 3447.95 68.61 o
-1 2 3 3491.53 3634.77 54.22 o
0 2 3 7390.05 7301.66 57.49 o
1 2 3 926.77 1056.05 29.15 o
2 2 3 159.49 187.17 18.45 o
-1 3 3 1185.95 1121.25 22.73 o
0 3 3 63.02 68.87 7.03 o
1 3 3 1996.97 1875.13 35.04 o
2 3 3 2618.50 2483.58 45.85 o
3 3 3 1429.67 1483.45 76.07 o
-2 4 3 153.70 157.22 15.13 o
-1 4 3 1823.12 1869.12 33.63 o
0 4 3 517.71 532.36 22.98 o
1 4 3 1180.02 1190.71 37.24 o
2 4 3 724.80 820.31 36.88 o
3 4 3 619.03 646.36 35.63 o
4 4 3 2018.39 1920.52 84.18 o
-2 5 3 2568.10 2567.76 46.03 o
-1 5 3 1082.72 1176.58 35.01 o
0 5 3 2966.40 2871.21 55.90 o
1 5 3 936.15 918.63 39.65 o
2 5 3 488.00 526.85 29.72 o
3 5 3 344.52 356.32 27.18 o
4 5 3 464.51 449.23 35.06 o
5 5 3 74.89 39.30 26.40 o
-3 6 3 1547.07 1361.71 58.10 o
-2 6 3 857.06 827.38 34.38 o
-1 6 3 791.16 945.98 41.23 o
0 6 3 354.11 353.58 25.39 o
1 6 3 189.59 173.85 16.99 o
2 6 3 293.95 369.11 26.62 o
3 6 3 251.24 327.41 29.74 o
4 6 3 394.11 450.57 42.02 o
-3 7 3 610.89 621.73 31.72 o
-2 7 3 561.00 569.28 30.51 o
-1 7 3 179.04 185.09 18.15 o
0 7 3 2525.68 2439.64 72.71 o
1 7 3 351.20 356.74 32.19 o
2 7 3 1321.21 1365.12 85.76 o
3 7 3 418.25 292.61 72.78 o
-4 8 3 1839.06 1664.47 78.15 o
-3 8 3 313.92 349.42 25.74 o
-2 8 3 384.59 355.75 29.02 o
-1 8 3 342.62 379.41 30.01 o
0 8 3 1.44 2.52 14.67 o
1 8 3 249.02 267.19 26.46 o
-4 9 3 452.67 472.35 32.85 o
-3 9 3 287.99 284.42 34.85 o
-2 9 3 1260.24 1300.08 84.70 o
-1 9 3 226.97 305.59 41.97 o
-5 10 3 91.41 157.83 39.71 o
-4 10 3 475.87 465.72 39.34 o
0 1 4 78.93 94.28 11.64 o
1 1 4 799.53 754.55 45.37 o
-1 2 4 603.81 738.05 50.06 o
0 2 4 1089.75 1122.55 41.33 o
1 2 4 1006.88 1093.00 42.05 o
2 2 4 2223.30 2340.72 77.18 o
-1 3 4 994.92 1092.21 41.21 o
0 3 4 2465.77 2323.46 54.53 o
1 3 4 1536.37 1460.17 55.45 o
2 3 4 126.14 122.85 15.87 o
3 3 4 1413.53 1285.95 90.21 o
-2 4 4 2261.69 2211.47 89.14 o
-1 4 4 1486.79 1541.11 51.32 o
0 4 4 280.58 310.66 25.07 o
1 4 4 968.47 1079.29 53.64 o
2 4 4 391.52 407.28 32.46 o
3 4 4 50.10 47.18 15.03 o
4 4 4 692.05 778.25 71.41 o
-2 5 4 159.18 151.09 18.54 o
-1 5 4 1115.47 1099.09 57.74 o
0 5 4 1131.59 1234.14 61.47 o
1 5 4 444.97 495.67 36.76 o
2 5 4 2246.35 2149.83 84.68 o
3 5 4 150.39 152.79 23.97 o
4 5 4 134.28 156.21 33.24 o
-3 6 4 1282.37 1443.12 90.72 o
-2 6 4 362.64 385.43 28.62 o
-1 6 4 501.67 444.63 33.27 o
0 6 4 180.38 194.98 21.43 o
1 6 4 143.33 155.34 27.95 o
2 6 4 483.80 502.13 40.97 o
3 6 4 388.74 397.24 47.14 o
-3 7 4 50.39 64.75 14.65 o
-2 7 4 2141.90 2249.35 80.58 o
-1 7 4 171.13 193.34 22.60 o
0 7 4 902.73 948.84 54.98 o
1 7 4 191.97 209.83 27.69 o
-4 8 4 900.18 780.97 114.16 o
-3 8 4 137.72 123.91 29.95 o
-2 8 4 471.03 542.03 58.97 o
-1 8 4 196.08 196.66 33.98 o
0 8 4 2.30 -2.89 17.19 o
-4 9 4 128.02 146.76 28.82 o
-3 9 4 355.54 408.34 41.14 o
0 0 5 489.61 614.64 81.74 o
0 1 5 52.67 61.42 11.40 o
1 1 5 1345.73 1392.69 73.80 o
-1 2 5 1302.13 1324.07 71.08 o
0 2 5 2757.13 2812.03 63.13 o
1 2 5 338.36 385.81 27.25 o
2 2 5 74.90 79.69 21.04 o
-1 3 5 450.95 445.70 31.84 o
0 3 5 13.62 25.64 10.68 o
1 3 5 870.05 870.15 47.03 o
2 3 5 1061.74 1002.63 58.22 o
3 3 5 697.30 663.17 68.50 o
-2 4 5 72.43 117.60 25.40 o
-1 4 5 791.46 841.29 48.00 o
0 4 5 246.14 216.49 24.40 o
1 4 5 488.63 479.80 34.23 o
2 4 5 307.04 283.73 29.76 o
3 4 5 286.98 279.21 28.93 o
-2 5 5 1039.33 1075.75 55.05 o
-1 5 5 444.74 450.70 34.95 o
0 5 5 1353.83 1327.85 68.51 o
1 5 5 405.62 413.87 36.97 o
2 5 5 230.15 228.78 26.80 o
-3 6 5 751.80 713.15 102.35 o
-2 6 5 369.98 322.39 30.46 o
-1 6 5 336.09 336.54 31.42 o
0 6 5 165.45 171.48 24.14 o
1 6 5 75.89 116.30 24.69 o
-3 7 5 282.93 282.57 30.59 o
-2 7 5 265.24 238.93 28.92 o
-1 7 5 70.93 96.11 21.08 o
-4 8 5 846.87 157.71 99.23 o
0 0 6 3859.78 3905.58 226.42 o
0 1 6 34.29 43.03 12.08 o
1 1 6 302.91 251.43 30.87 o
-1 2 6 226.52 286.28 35.68 o
0 2 6 438.05 441.71 31.02 o
1 2 6 334.16 321.96 37.74 o
2 2 6 812.11 796.24 132.35 o
-1 3 6 329.96 334.11 30.67 o
0 3 6 834.18 742.49 46.11 o
1 3 6 605.08 570.59 40.28 o
2 3 6 59.51 63.14 17.19 o
-2 4 6 828.23 859.68 86.49 o
-1 4 6 585.07 598.20 52.47 o
0 4 6 88.77 104.91 19.00 o
1 4 6 343.51 323.87 43.62 o
-2 5 6 72.95 98.92 21.55 o
-1 5 6 405.56 338.56 42.86 o
0 5 6 441.53 238.18 56.64 o