data_2020121
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                120.000
_cell_length_a                   4.6790
_cell_length_b                   4.6790
_cell_length_c                   7.4776
_exptl_crystal_F_000             233.00
_reflns_d_resolution_high        0.6986
_cod_data_source_file            sk3600CeLi3Bi2sup3.hkl
_cod_data_source_block           CeLi3Bi2
_shelx_title
' CeLi3Bi2 in P-3m1 after absorption correction'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            176.45
_shelx_f_squared_multiplier      1.000
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x-y, -y, -z'
'-x, -x+y, -z'
'y, x, -z'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-x+y, y, z'
'x, x-y, z'
'-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 0 503.74 569.84 8.55 o
-1 2 0 31132.86 30692.76 211.29 o
0 2 0 397.97 421.65 10.78 o
-1 3 0 332.69 388.30 9.21 o
0 3 0 18696.79 18178.79 121.20 o
-2 4 0 15344.86 15376.00 123.26 o
-1 4 0 233.31 251.77 9.72 o
0 4 0 199.19 245.99 16.14 o
-2 5 0 172.75 189.85 12.52 o
-1 5 0 9421.74 9408.92 84.76 o
0 5 0 134.64 128.20 21.01 o
-3 6 0 7165.56 7176.24 140.57 o
-2 6 0 120.24 140.07 18.49 o
-1 6 0 107.87 125.78 26.19 o
0 0 1 2151.43 2217.95 27.06 o
-1 1 1 4969.10 5202.09 37.53 o
0 1 1 29067.84 29731.82 169.04 o
-2 2 1 20695.81 21084.31 142.21 o
-1 2 1 1404.30 1416.28 12.94 o
0 2 1 3708.42 3625.30 32.24 o
-3 3 1 856.23 883.93 19.11 o
-2 3 1 2982.90 2930.74 24.12 o
-1 3 1 16182.37 15797.44 80.36 o
0 3 1 856.23 844.80 17.54 o
-4 4 1 1752.65 1692.11 32.50 o
-3 4 1 11013.86 10885.11 65.19 o
-2 4 1 719.28 753.70 14.57 o
-1 4 1 2057.18 2040.29 26.72 o
0 4 1 9363.92 9178.80 117.54 o
-5 5 1 6141.81 6022.51 109.00 o
-4 5 1 468.13 474.37 20.55 o
-3 5 1 1513.97 1452.86 26.59 o
-2 5 1 8063.30 8119.05 71.32 o
-1 5 1 468.13 465.72 22.17 o
0 5 1 1164.14 1229.51 73.71 o
-5 6 1 918.04 876.58 41.00 o
-4 6 1 5413.45 5362.61 72.25 o
-3 6 1 364.27 410.50 24.32 o
-2 6 1 1031.41 1006.33 35.55 o
-1 6 1 4795.53 4948.92 142.73 o
0 0 2 8568.89 8877.87 96.39 o
-1 1 2 13816.75 14049.80 85.51 o
0 1 2 12871.68 12956.74 89.08 o
-2 2 2 9367.09 9172.28 72.22 o
-1 2 2 6281.82 6296.60 35.38 o
0 2 2 10158.94 9834.62 72.35 o
-3 3 2 4099.44 4041.51 47.79 o
-2 3 2 8023.96 7919.97 45.86 o
-1 3 2 7327.60 7187.98 44.07 o
0 3 2 4099.44 4119.91 49.43 o
-4 4 2 4696.60 4477.78 55.71 o
-3 4 2 4945.98 5000.36 42.20 o
-2 4 2 3421.92 3431.03 34.32 o
-1 4 2 5511.99 5472.56 46.36 o
0 4 2 4182.35 4202.83 62.79 o
-5 5 2 2699.30 2642.56 76.14 o
-4 5 2 2178.11 2132.12 31.58 o
-3 5 2 4049.22 3975.11 50.18 o
-2 5 2 3581.36 3647.62 44.14 o
-1 5 2 2178.11 2236.23 40.43 o
0 5 2 3086.79 3143.09 83.24 o
-5 6 2 2410.28 2480.52 107.33 o
-4 6 2 2368.26 2363.03 53.22 o
-3 6 2 1690.28 1733.31 39.93 o
-2 6 2 2720.85 2848.51 54.69 o
-1 6 2 2089.48 2321.74 93.64 o
0 0 3 2991.59 3074.58 51.98 o
-1 1 3 20788.28 20939.76 126.16 o
0 1 3 5247.92 5251.56 40.08 o
-2 2 3 4113.46 4162.84 39.21 o
-1 2 3 2185.66 2210.92 18.53 o
0 2 3 16024.35 15914.77 116.99 o
-3 3 3 1402.71 1385.87 26.37 o
-2 3 3 12950.08 12849.30 68.43 o
-1 3 3 3318.43 3307.35 31.20 o
0 3 3 1402.71 1416.63 31.10 o
-4 4 3 7822.01 7645.08 84.57 o
-3 4 3 2290.01 2280.51 28.60 o
-2 4 3 1174.19 1211.32 21.34 o
-1 4 3 9111.87 9086.29 65.80 o
0 4 3 1950.34 1986.68 52.52 o
-5 5 3 1287.12 1357.19 52.93 o
-4 5 3 744.17 753.23 24.29 o
-3 5 3 6784.18 6763.21 64.66 o
-2 5 3 1682.39 1744.28 33.02 o
-1 5 3 744.17 827.66 27.12 o
0 5 3 5219.20 5379.45 141.61 o
-5 6 3 4102.37 4303.85 230.93 o
-4 6 3 1136.91 1112.40 35.97 o
-3 6 3 571.07 599.90 26.38 o
-2 6 3 4616.90 4828.64 79.96 o
-1 6 3 1008.86 1083.11 99.27 o
0 0 4 24868.36 24815.57 259.41 o
-1 1 4 545.71 584.30 14.26 o
0 1 4 98.30 147.00 14.48 o
-2 2 4 87.68 128.06 8.66 o
-1 2 4 19552.18 19078.02 93.46 o
0 2 4 465.58 493.30 17.19 o
-3 3 4 13342.65 12954.30 114.17 o
-2 3 4 399.07 415.58 12.10 o
-1 3 4 76.65 104.88 8.94 o
0 3 4 13342.65 12898.65 123.96 o
-4 4 4 269.71 305.01 29.68 o
-3 4 4 59.90 67.94 8.47 o
-2 4 4 11344.69 11262.43 82.52 o
-1 4 4 303.84 322.03 15.13 o
0 4 4 53.93 73.38 14.85 o
-5 5 4 40.97 54.71 18.31 o
-4 5 4 7435.64 7337.99 76.91 o
-3 5 4 241.33 242.22 15.32 o
-2 5 4 48.98 75.50 11.82 o
-1 5 4 7435.64 7646.89 82.55 o
0 5 4 195.96 208.03 27.44 o
-4 6 4 37.57 18.77 44.71 o
-3 6 4 5802.64 5837.90 85.19 o
-2 6 4 177.24 156.65 60.75 o
0 0 5 603.34 639.82 37.51 o
-1 1 5 2676.64 2754.89 30.68 o
0 1 5 16835.78 16826.03 117.51 o
-2 2 5 13791.16 13930.03 109.80 o
-1 2 5 490.90 505.77 10.99 o
0 2 5 2180.19 2201.04 33.59 o
-3 3 5 353.85 393.52 22.26 o
-2 3 5 1809.74 1786.95 28.61 o
-1 3 5 11552.07 11372.05 79.64 o
0 3 5 353.85 367.92 21.78 o
-4 4 5 1135.06 1130.75 43.20 o
-3 4 5 8469.77 8469.16 77.77 o
-2 4 5 306.33 329.54 16.42 o
-1 4 5 1309.53 1328.51 27.96 o
0 4 5 7363.74 7554.58 97.45 o
-5 5 5 5032.49 4803.31 140.12 o
-4 5 5 206.70 227.75 18.79 o
-3 5 5 992.70 936.86 28.93 o
-2 5 5 6449.47 6553.77 73.32 o
-1 5 5 206.70 181.25 16.75 o
0 5 5 773.86 733.41 91.57 o
0 0 6 3712.64 3747.17 69.30 o
-1 1 6 7884.76 7959.90 65.94 o
0 1 6 4503.15 4488.43 47.84 o
-2 2 6 3791.64 3756.27 55.89 o
-1 2 6 3128.23 3147.07 32.02 o
0 2 6 6601.27 6513.49 72.52 o
-3 3 6 2322.59 2292.14 51.17 o
-2 3 6 5614.61 5625.68 55.15 o
-1 3 6 3241.36 3181.81 35.06 o
0 3 6 2322.59 2354.55 57.97 o
-4 4 6 3672.02 3671.81 91.66 o
-3 4 6 2442.23 2479.39 42.19 o
-2 4 6 2034.60 1952.98 32.72 o
-1 4 6 4196.80 4213.68 60.31 o
0 4 6 2143.41 2202.70 55.32 o
-4 5 6 1421.14 1379.37 57.42 o
-3 5 6 3232.47 3376.30 51.61 o
-2 5 6 1891.80 1889.55 53.24 o
-1 5 6 1421.14 1368.37 59.56 o
0 0 7 1584.56 1688.47 60.00 o
-1 1 7 8907.72 8979.40 84.50 o
0 1 7 2470.83 2509.86 39.21 o
-2 2 7 2116.05 2116.57 79.26 o
-1 2 7 1366.94 1378.95 23.33 o
0 2 7 7619.47 7540.40 89.83 o
-3 3 7 1044.59 1032.55 48.07 o
-2 3 7 6588.33 6646.83 67.36 o
-1 3 7 1834.46 1820.62 33.45 o
0 3 7 1044.59 1008.94 38.29 o
-4 4 7 4453.01 4580.59 95.54 o
-3 4 7 1415.21 1398.11 52.33 o
-2 4 7 921.71 929.53 31.73 o
-1 4 7 5043.77 5018.78 60.80 o
0 4 7 1254.34 1226.99 48.83 o
-3 5 7 3950.08 3939.68 125.31 o
-2 5 7 1116.41 875.60 103.50 o
0 0 8 10621.87 10921.48 185.99 o
-1 1 8 521.32 487.82 27.54 o
0 1 8 15.55 28.63 10.73 o
-2 2 8 14.46 -0.17 15.31 o
-1 2 8 9181.28 9260.64 85.06 o
0 2 8 454.04 461.64 26.70 o
-3 3 8 7024.27 7055.02 144.98 o
-2 3 8 399.10 441.91 23.81 o
-1 3 8 13.48 19.82 12.04 o
0 3 8 7024.27 7123.22 96.67 o
-3 4 8 11.85 41.23 35.23 o
-2 4 8 6199.75 6156.99 95.41 o
-1 4 8 314.13 333.47 35.92 o
0 0 9 130.22 136.61 34.59 o
-1 1 9 797.45 780.70 40.24 o
0 1 9 7318.81 7226.01 118.82 o
-2 2 9 6451.29 6229.03 105.16 o
-1 2 9 114.24 140.02 18.17 o
0 2 9 705.36 628.08 49.89 o
-2 3 9 627.07 570.58 33.16 o
-1 3 9 5715.42 5598.09 135.16 o
0 3 9 89.47 35.86 49.16 o
0 0 10 1547.29 1591.15 128.84 o
-1 1 10 3738.90 3858.71 143.72 o
0 1 10 1602.46 1408.71 89.74 o
-2 2 10 1416.74 1369.76 102.77 o
-1 2 10 1373.98 1408.80 66.72 o
0 2 10 3312.06 3691.75 232.19 o