Table 5 (To be deposited). Observed and calculated structure factors pertaining to the refinement of epididymite and eudidymite. ========================================================================================================================== EPIDIDYMITE # # h,k,l, Fc-squared, Fo-squared, sigma(Fo-squared) and status flag # data_epididymite _shelx_title ' Epididymite' _shelx_refln_list_code 4 _shelx_F_calc_maximum 337.38 _exptl_crystal_F_000 532.57 _reflns_d_resolution_high 0.6122 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, y+1/2, -z' 'x+1/2, -y+1/2, -z+1/2' '-x+1/2, -y, z+1/2' '-x, -y, -z' 'x, -y-1/2, z' '-x-1/2, y-1/2, z-1/2' 'x-1/2, y, -z-1/2' _cell_length_a 12.7334 _cell_length_b 13.6298 _cell_length_c 7.3467 _cell_angle_alpha 90.000 _cell_angle_beta 90.000 _cell_angle_gamma 90.000 _shelx_F_squared_multiplier 1.000 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 0 444.12 354.86 48.30 o 4 0 0 2908.97 2882.65 67.08 o 6 0 0 1742.77 1692.91 54.86 o 8 0 0 2150.02 2082.99 57.94 o 10 0 0 699.69 711.13 30.96 o 12 0 0 5592.33 5811.40 85.87 o 14 0 0 12291.47 11564.49 149.74 o 16 0 0 4947.66 4741.28 150.49 o 18 0 0 14484.04 13999.85 288.93 o 2 1 0 1635.81 1655.95 68.11 o 4 1 0 969.04 919.95 29.40 o 6 1 0 1824.32 1828.71 26.74 o 8 1 0 3208.95 3304.22 62.04 o 10 1 0 2733.39 2819.52 34.49 o 12 1 0 4628.06 4572.66 78.50 o 14 1 0 323.70 364.62 23.95 o 16 1 0 3222.62 3256.99 91.24 o 18 1 0 184.00 161.59 41.25 o 0 2 0 11365.75 10310.54 88.04 o 2 2 0 18218.14 18931.50 88.79 o 4 2 0 18072.04 18275.48 80.39 o 6 2 0 149.00 187.82 10.30 o 8 2 0 669.79 699.83 19.86 o 10 2 0 5854.90 5884.77 64.06 o 12 2 0 19006.07 19216.88 251.37 o 14 2 0 8361.48 8616.66 91.78 o 16 2 0 1301.84 1411.95 65.62 o 18 2 0 896.37 1031.56 61.73 o 2 3 0 325.63 331.64 10.66 o 4 3 0 829.69 838.14 28.58 o 6 3 0 393.89 381.78 14.16 o 8 3 0 307.42 304.44 14.42 o 10 3 0 21820.56 21028.42 315.05 o 12 3 0 2019.56 1990.71 44.16 o 14 3 0 131.81 165.60 24.69 o 16 3 0 2592.30 2608.46 121.38 o 18 3 0 321.24 428.58 65.55 o 0 4 0 13074.02 12625.60 110.07 o 2 4 0 41946.26 42356.16 181.09 o 4 4 0 2344.45 2318.46 41.23 o 6 4 0 667.15 620.61 22.42 o 8 4 0 15212.87 15335.39 106.04 o 10 4 0 4556.81 4612.48 214.73 o 12 4 0 3555.27 3554.33 69.05 o 14 4 0 835.88 785.07 44.87 o 16 4 0 22381.68 21777.74 647.78 o 18 4 0 14.64 -30.51 47.67 o 2 5 0 1.28 2.59 9.82 o 4 5 0 1039.22 1180.31 32.10 o 6 5 0 201.86 213.57 22.58 o 8 5 0 4738.19 5036.65 156.36 o 10 5 0 3600.03 3549.31 51.87 o 12 5 0 2127.58 2173.81 105.20 o 14 5 0 3627.78 3615.30 143.77 o 16 5 0 3374.14 3319.83 132.60 o 18 5 0 340.53 376.21 66.03 o 0 6 0 12179.12 11665.57 89.95 o 2 6 0 0.00 14.05 13.42 o 4 6 0 17152.05 16804.69 139.72 o 6 6 0 56577.77 57780.02 93.44 o 8 6 0 5947.41 5885.93 92.48 o 10 6 0 4837.53 4798.79 92.21 o 12 6 0 13400.22 13876.51 202.32 o 14 6 0 119.04 187.45 45.13 o 16 6 0 5347.41 4800.39 157.78 o 18 6 0 1302.33 1263.00 98.93 o 2 7 0 58.46 59.59 17.31 o 4 7 0 1309.90 1388.14 49.77 o 6 7 0 2454.84 2397.80 62.19 o 8 7 0 5631.07 5535.61 89.66 o 10 7 0 291.88 296.13 29.96 o 12 7 0 5375.13 5598.24 139.84 o 14 7 0 4727.92 4853.12 142.22 o 16 7 0 1741.39 1741.97 106.09 o 18 7 0 3.92 52.30 50.51 o 0 8 0 28355.04 28264.67 120.42 o 2 8 0 29900.87 29050.41 137.06 o 4 8 0 1659.13 1721.22 54.27 o 6 8 0 38963.21 39548.33 248.04 o 8 8 0 20664.97 21296.57 172.89 o 10 8 0 832.95 850.43 48.60 o 12 8 0 395.70 399.51 50.51 o 14 8 0 4.83 75.29 42.80 o 16 8 0 88.54 126.01 51.77 o 18 8 0 5127.30 4801.78 195.20 o 2 9 0 2256.04 2331.45 61.77 o 4 9 0 2643.68 2536.58 64.30 o 6 9 0 1513.33 1434.05 49.88 o 8 9 0 3235.71 3454.72 81.67 o 10 9 0 112.98 198.63 33.89 o 12 9 0 2510.76 2379.71 114.28 o 14 9 0 693.84 692.61 65.70 o 16 9 0 173.62 314.27 59.93 o 0 10 0 15333.76 14238.46 146.03 o 2 10 0 69.92 71.74 16.54 o 4 10 0 51494.90 52869.02 289.18 o 6 10 0 3650.28 3428.95 74.15 o 8 10 0 9969.69 9794.18 150.56 o 10 10 0 10945.99 11397.35 194.51 o 12 10 0 1092.28 1178.34 81.47 o 14 10 0 102.67 138.21 47.73 o 16 10 0 466.64 648.89 73.04 o 18 10 0 196.07 218.37 65.14 o 2 11 0 560.05 660.02 32.40 o 4 11 0 2.76 -8.63 13.88 o 6 11 0 5.88 33.84 19.71 o 8 11 0 2868.55 2928.88 97.41 o 10 11 0 2180.85 2234.09 105.48 o 12 11 0 3825.94 3740.57 133.40 o 14 11 0 7513.01 7334.60 296.35 o 16 11 0 505.67 502.22 72.66 o 0 12 0 1.82 30.99 14.60 o 2 12 0 33388.79 32195.99 237.02 o 4 12 0 1569.65 1673.52 63.46 o 6 12 0 499.97 528.42 42.81 o 8 12 0 10532.68 10425.17 189.69 o 10 12 0 767.05 924.70 72.76 o 12 12 0 823.12 801.50 69.77 o 14 12 0 984.01 1029.57 86.45 o 16 12 0 18877.59 18674.92 262.28 o 2 13 0 1805.68 1667.95 69.12 o 4 13 0 65.95 82.00 26.51 o 6 13 0 913.99 815.65 56.91 o 8 13 0 4.80 40.25 33.88 o 10 13 0 10189.93 9982.23 145.41 o 12 13 0 560.50 580.53 67.22 o 14 13 0 1794.73 1848.97 137.83 o 16 13 0 38.64 6.70 55.77 o 0 14 0 20046.54 19522.69 236.83 o 2 14 0 14926.32 14490.97 206.87 o 4 14 0 257.33 281.95 41.62 o 6 14 0 6730.72 6401.92 162.21 o 8 14 0 9454.32 9754.06 139.26 o 10 14 0 71.51 107.45 45.99 o 12 14 0 30403.67 30298.31 295.35 o 14 14 0 7466.77 7458.01 239.34 o 2 15 0 828.20 810.45 62.59 o 4 15 0 206.20 224.62 46.78 o 6 15 0 1644.50 1560.42 94.25 o 8 15 0 257.64 247.06 48.52 o 10 15 0 793.76 844.47 75.85 o 12 15 0 3379.46 3738.21 171.43 o 14 15 0 1702.01 1645.18 145.19 o 0 16 0 113825.87 117844.47 766.99 o 2 16 0 2092.09 2316.39 118.32 o 4 16 0 574.07 653.32 58.78 o 6 16 0 905.82 924.62 72.73 o 8 16 0 246.98 412.55 58.54 o 10 16 0 1278.24 1300.65 93.71 o 12 16 0 379.14 359.69 68.83 o 2 17 0 1518.18 1643.46 88.70 o 4 17 0 1705.81 1682.19 93.13 o 6 17 0 256.71 302.22 57.00 o 8 17 0 615.34 693.61 74.23 o 10 17 0 685.97 677.18 79.35 o 12 17 0 15.43 75.82 52.97 o 0 18 0 23.49 -39.86 40.05 o 2 18 0 6038.97 6101.71 179.59 o 4 18 0 28039.85 28214.11 272.36 o 6 18 0 7744.74 8005.57 151.58 o 8 18 0 15.05 1.40 45.21 o 10 18 0 9249.07 9236.01 186.79 o 2 19 0 58.02 145.19 49.41 o 4 19 0 1475.35 1364.41 125.22 o 6 19 0 130.18 78.87 50.04 o 8 19 0 300.60 242.05 61.92 o 10 19 0 5477.75 6325.16 229.81 o 0 20 0 305.28 434.83 70.61 o 2 20 0 5200.81 5219.46 207.58 o 4 20 0 981.62 857.39 92.68 o 6 20 0 2622.35 2715.81 158.16 o 8 20 0 18366.99 18899.00 386.06 o 2 21 0 153.78 142.47 57.23 o 4 21 0 1673.17 1613.69 141.89 o 1 0 1 10423.73 10621.33 268.23 o 2 0 1 163.81 149.11 18.97 o 3 0 1 1872.66 1865.02 32.72 o 4 0 1 421.62 443.24 38.12 o 5 0 1 19410.29 19590.27 140.28 o 6 0 1 1313.44 1254.25 92.98 o 7 0 1 1399.19 1416.35 69.47 o 8 0 1 9.18 18.48 10.62 o 9 0 1 148.25 171.35 14.78 o 10 0 1 15.33 30.04 10.56 o 11 0 1 111.42 142.23 14.30 o 12 0 1 4799.11 4808.60 73.86 o 13 0 1 2221.65 2244.26 63.68 o 14 0 1 7343.30 7533.21 120.93 o 15 0 1 1393.36 1546.53 116.08 o 16 0 1 11.66 55.72 41.31 o 17 0 1 3831.98 3869.75 152.89 o 18 0 1 3934.34 3934.47 164.79 o 19 0 1 1785.62 1757.76 116.25 o 0 1 1 10.63 -48.45 91.81 o 1 1 1 316.72 305.12 23.44 o 2 1 1 106.24 109.56 15.75 o 3 1 1 97.65 119.17 9.54 o 4 1 1 52.70 66.55 9.41 o 5 1 1 42.84 67.14 16.88 o 6 1 1 156.51 160.69 11.67 o 7 1 1 1366.90 1330.95 28.16 o 8 1 1 509.10 519.23 17.46 o 9 1 1 3750.43 3788.88 51.31 o 10 1 1 1828.15 1824.68 34.90 o 11 1 1 985.54 979.90 38.78 o 12 1 1 159.91 165.93 15.65 o 13 1 1 0.59 13.27 14.11 o 14 1 1 462.21 430.81 36.66 o 15 1 1 291.92 308.74 46.04 o 16 1 1 1406.43 1402.00 60.03 o 17 1 1 344.86 342.64 41.28 o 18 1 1 33.37 20.98 33.58 o 19 1 1 1722.40 1454.63 137.59 o 1 2 1 219.34 244.83 23.59 o 2 2 1 81.80 83.99 14.19 o 3 2 1 3625.04 3663.60 45.52 o 4 2 1 40.94 64.86 9.27 o 5 2 1 1662.20 1659.31 36.11 o 6 2 1 180.79 202.71 12.86 o 7 2 1 1096.58 1116.59 26.51 o 8 2 1 341.55 316.09 26.82 o 9 2 1 1731.61 1705.54 31.06 o 10 2 1 357.68 368.47 15.17 o 11 2 1 68.64 91.25 11.00 o 12 2 1 2580.24 2662.35 47.62 o 13 2 1 1395.80 1312.74 43.95 o 14 2 1 3264.19 3373.69 109.81 o 15 2 1 2448.68 2334.14 69.73 o 16 2 1 393.41 427.39 40.34 o 17 2 1 1773.56 1655.89 70.07 o 18 2 1 0.00 38.46 33.20 o 19 2 1 1137.24 1099.44 88.80 o 0 3 1 0.03 9.28 7.25 o 1 3 1 28.03 54.61 13.00 o 2 3 1 6.56 19.17 14.31 o 3 3 1 401.58 403.87 14.59 o 4 3 1 504.20 512.91 22.69 o 5 3 1 10462.48 10522.07 112.42 o 6 3 1 0.65 17.94 8.60 o 7 3 1 658.52 657.04 20.88 o 8 3 1 110.74 120.67 21.37 o 9 3 1 414.65 395.87 16.15 o 10 3 1 7529.94 7617.32 183.98 o 11 3 1 17538.09 17515.87 165.28 o 12 3 1 30.17 5.15 13.32 o 13 3 1 2845.63 2757.21 58.22 o 14 3 1 0.50 -24.33 24.33 o 15 3 1 44.03 153.91 44.64 o 16 3 1 5013.40 4933.02 155.22 o 17 3 1 279.70 146.51 51.12 o 18 3 1 2.50 -5.64 48.54 o 19 3 1 1695.22 1642.55 115.01 o 1 4 1 83.67 112.39 14.81 o 2 4 1 701.15 649.91 35.04 o 3 4 1 14430.20 14818.33 287.61 o 4 4 1 466.18 462.10 19.41 o 5 4 1 1816.66 1824.06 50.54 o 6 4 1 784.20 764.75 32.21 o 7 4 1 8833.31 8619.55 127.59 o 8 4 1 80.64 114.10 25.36 o 9 4 1 9442.29 9388.50 196.86 o 10 4 1 1407.20 1326.05 34.00 o 11 4 1 1532.57 1550.99 61.86 o 12 4 1 104.20 120.62 20.60 o 13 4 1 2.61 15.93 30.61 o 14 4 1 67.67 63.88 27.16 o 15 4 1 1993.24 2331.42 107.20 o 16 4 1 6693.56 6621.18 179.68 o 17 4 1 617.34 753.56 75.96 o 18 4 1 2453.56 2584.52 130.22 o 19 4 1 14.19 29.40 52.30 o 0 5 1 70.74 79.32 11.44 o 1 5 1 197.09 224.25 14.86 o 2 5 1 6.46 12.67 9.93 o 3 5 1 960.84 1051.86 30.43 o 4 5 1 765.84 765.06 29.70 o 5 5 1 493.64 487.00 40.00 o 6 5 1 141.46 159.08 14.29 o 7 5 1 1134.73 1143.65 32.99 o 8 5 1 1644.76 1595.93 37.10 o 9 5 1 1837.64 1828.58 86.82 o 10 5 1 0.25 2.60 10.52 o 11 5 1 422.34 461.03 25.47 o 12 5 1 1970.41 1941.16 57.34 o 13 5 1 1506.56 1452.46 87.27 o 14 5 1 57.60 108.94 28.84 o 15 5 1 1820.77 1717.03 89.92 o 16 5 1 1134.29 1140.73 83.98 o 17 5 1 4211.10 4407.40 165.82 o 18 5 1 5905.73 6263.75 206.66 o 1 6 1 537.21 552.65 30.16 o 2 6 1 2.26 22.75 14.51 o 3 6 1 8.24 26.94 15.18 o 4 6 1 297.36 294.15 24.13 o 5 6 1 183.29 269.24 23.15 o 6 6 1 1276.85 1285.38 48.19 o 7 6 1 815.06 887.26 42.68 o 8 6 1 695.79 752.20 34.93 o 9 6 1 0.27 11.13 13.45 o 11 6 1 3116.52 3173.70 91.61 o 12 6 1 176.60 171.61 35.10 o 13 6 1 1835.30 1973.99 96.54 o 14 6 1 941.47 1163.83 80.28 o 15 6 1 203.97 237.82 49.33 o 16 6 1 40.37 -11.04 42.47 o 17 6 1 290.24 334.22 62.60 o 18 6 1 2001.17 1894.51 133.43 o 0 7 1 67.65 67.50 15.81 o 1 7 1 64.81 84.13 17.02 o 2 7 1 22.44 48.49 16.29 o 3 7 1 506.50 477.42 28.84 o 4 7 1 0.52 18.12 15.38 o 5 7 1 189.58 155.60 19.78 o 6 7 1 666.54 712.80 34.30 o 7 7 1 4732.85 4360.56 80.72 o 8 7 1 1092.20 1087.37 44.25 o 9 7 1 5050.26 5241.69 92.68 o 10 7 1 154.65 118.86 25.22 o 11 7 1 102.00 80.56 28.40 o 12 7 1 1737.95 2052.93 94.20 o 13 7 1 962.35 1178.15 83.67 o 14 7 1 2574.33 2657.25 107.44 o 15 7 1 30.52 45.60 39.04 o 16 7 1 118.63 127.85 49.95 o 17 7 1 620.86 742.30 79.44 o 18 7 1 819.32 752.29 85.89 o 1 8 1 6282.80 5861.39 93.81 o 2 8 1 563.04 560.45 31.06 o 3 8 1 6573.32 6485.18 98.47 o 4 8 1 1169.47 1230.19 47.44 o 5 8 1 6838.67 7175.78 102.78 o 6 8 1 462.29 473.74 28.82 o 7 8 1 4309.24 4293.01 78.94 o 8 8 1 4215.26 3904.96 77.98 o 9 8 1 10724.38 10516.52 143.09 o 10 8 1 28.92 99.05 26.41 o 11 8 1 5168.18 5140.79 131.20 o 12 8 1 210.37 122.97 40.02 o 13 8 1 448.92 438.68 60.94 o 14 8 1 393.90 295.62 51.23 o 15 8 1 395.80 365.95 56.30 o 16 8 1 731.20 677.27 75.55 o 17 8 1 19.47 3.86 48.15 o 18 8 1 11974.71 12174.81 294.91 o 0 9 1 289.39 281.97 24.08 o 1 9 1 37.36 74.91 16.49 o 2 9 1 259.58 288.01 23.93 o 3 9 1 0.36 31.18 14.89 o 4 9 1 460.97 478.68 29.30 o 5 9 1 3660.72 3574.61 73.84 o 6 9 1 43.81 59.63 15.86 o 7 9 1 3800.98 4039.05 78.37 o 8 9 1 778.05 796.00 42.07 o 9 9 1 2764.38 2887.83 87.94 o 10 9 1 22.36 49.45 28.82 o 11 9 1 693.01 702.29 57.45 o 12 9 1 545.61 546.89 58.44 o 13 9 1 1864.01 1847.32 102.76 o 14 9 1 80.57 61.32 41.31 o 15 9 1 1658.14 1549.78 111.93 o 16 9 1 216.59 210.77 54.49 o 17 9 1 1544.87 1532.98 107.24 o 1 10 1 6.01 20.73 13.69 o 2 10 1 0.36 11.95 13.59 o 3 10 1 3129.47 3146.04 69.92 o 4 10 1 193.49 216.16 21.94 o 5 10 1 762.48 751.46 38.26 o 6 10 1 399.21 355.83 27.60 o 7 10 1 533.56 507.90 35.53 o 8 10 1 615.44 683.86 44.03 o 9 10 1 2675.50 2713.08 93.86 o 10 10 1 719.68 715.24 54.90 o 11 10 1 484.99 424.39 52.65 o 12 10 1 552.99 550.16 57.57 o 13 10 1 200.22 189.98 49.57 o 14 10 1 9.58 -35.76 35.76 o 15 10 1 474.20 634.83 72.13 o 16 10 1 11.61 16.53 48.10 o 17 10 1 76.79 62.62 53.85 o 18 10 1 1645.21 1568.51 139.56 o 0 11 1 72.92 88.27 16.97 o 1 11 1 419.73 426.43 27.27 o 2 11 1 160.27 196.50 20.83 o 3 11 1 2449.77 2423.59 60.40 o 4 11 1 63.91 77.56 17.74 o 5 11 1 2.32 52.92 18.03 o 6 11 1 187.30 190.53 27.82 o 7 11 1 2917.13 2996.38 90.93 o 8 11 1 1357.09 1386.93 75.74 o 9 11 1 1646.54 1728.07 90.26 o 10 11 1 0.18 10.84 36.05 o 12 11 1 3964.14 3944.87 132.27 o 13 11 1 2865.75 2806.95 129.74 o 14 11 1 1186.06 1243.77 88.14 o 15 11 1 686.13 648.23 75.39 o 16 11 1 141.86 133.55 53.32 o 17 11 1 1554.07 1439.00 113.19 o 1 12 1 226.39 278.24 25.80 o 2 12 1 338.04 343.45 28.27 o 3 12 1 8414.42 8360.25 126.64 o 4 12 1 704.52 709.89 42.55 o 5 12 1 638.54 651.07 43.36 o 6 12 1 566.90 545.55 43.49 o 7 12 1 5634.55 5662.56 135.47 o 8 12 1 4.83 9.50 31.38 o 9 12 1 2809.97 2716.43 116.46 o 10 12 1 934.04 841.92 70.38 o 11 12 1 69.50 140.28 44.78 o 12 12 1 44.59 -38.27 38.27 o 13 12 1 72.84 78.29 45.94 o 14 12 1 445.91 370.07 64.16 o 15 12 1 1451.80 1750.79 115.49 o 16 12 1 4918.78 5063.72 203.92 o 0 13 1 579.29 634.03 41.66 o 1 13 1 27.71 32.20 20.87 o 2 13 1 466.97 470.43 38.17 o 3 13 1 1471.23 1555.79 70.98 o 4 13 1 29.00 35.62 25.21 o 5 13 1 2410.62 2305.80 93.60 o 6 13 1 416.88 409.15 45.35 o 7 13 1 1199.05 1149.22 70.67 o 8 13 1 37.62 53.94 37.79 o 9 13 1 9.26 55.77 39.62 o 10 13 1 3380.72 3611.80 131.62 o 11 13 1 8622.57 8726.43 207.64 o 12 13 1 320.86 233.25 55.66 o 13 13 1 1536.93 1565.68 101.69 o 14 13 1 1046.72 1139.32 93.95 o 15 13 1 1073.74 980.09 94.68 o 16 13 1 1206.94 1249.40 109.00 o 1 14 1 1851.53 1960.43 85.33 o 2 14 1 0.54 10.94 26.03 o 3 14 1 858.42 901.52 58.35 o 4 14 1 1.68 -11.18 28.24 o 5 14 1 2534.52 2658.70 109.94 o 6 14 1 6.99 37.88 35.28 o 7 14 1 642.58 601.21 60.87 o 8 14 1 385.98 356.60 52.15 o 9 14 1 7294.98 6883.12 178.26 o 10 14 1 2.93 -23.52 39.67 o 11 14 1 140.70 164.36 48.94 o 12 14 1 5981.44 5633.01 193.66 o 13 14 1 3593.68 3195.43 164.56 o 14 14 1 1077.98 937.74 92.65 o 15 14 1 513.42 591.38 82.50 o 0 15 1 12.38 -19.71 31.52 o 1 15 1 56.08 -8.87 32.30 o 2 15 1 34.20 -11.28 32.05 o 3 15 1 61.42 58.91 36.20 o 4 15 1 69.09 77.32 40.16 o 5 15 1 189.34 225.67 48.99 o 6 15 1 67.17 36.30 35.58 o 7 15 1 4090.57 3885.41 135.77 o 8 15 1 32.16 23.81 39.72 o 9 15 1 816.76 917.55 76.43 o 10 15 1 559.88 520.54 66.50 o 11 15 1 1.69 -42.51 42.51 o 12 15 1 659.55 633.08 76.50 o 13 15 1 188.61 205.02 60.66 o 14 15 1 1393.77 1289.81 107.50 o 1 16 1 4838.07 4749.42 155.73 o 2 16 1 76.60 79.16 42.33 o 3 16 1 198.08 114.72 40.50 o 4 16 1 335.75 465.03 54.75 o 5 16 1 4743.23 4875.13 149.70 o 6 16 1 1132.91 1126.24 86.64 o 7 16 1 53.28 65.80 40.83 o 8 16 1 62.47 162.93 44.73 o 9 16 1 360.96 344.74 58.61 o 10 16 1 1.89 52.34 43.47 o 11 16 1 129.21 93.72 52.65 o 12 16 1 2561.13 2862.80 167.84 o 13 16 1 67.94 -25.69 47.92 o 0 17 1 170.78 229.75 45.81 o 1 17 1 38.95 62.18 40.68 o 2 17 1 826.24 806.49 68.09 o 3 17 1 1675.75 1630.68 90.95 o 4 17 1 186.57 251.17 52.46 o 5 17 1 0.24 27.47 39.04 o 6 17 1 91.14 103.36 46.04 o 7 17 1 21.40 -3.71 42.46 o 8 17 1 0.41 103.14 46.37 o 9 17 1 720.74 854.68 82.93 o 10 17 1 286.60 230.04 59.13 o 11 17 1 646.82 503.71 75.43 o 12 17 1 185.09 93.01 56.85 o 1 18 1 7.72 -26.36 37.74 o 2 18 1 189.62 167.60 49.57 o 3 18 1 5767.81 5986.04 181.62 o 4 18 1 128.40 179.49 50.38 o 5 18 1 1161.79 1235.67 89.53 o 6 18 1 219.98 185.55 50.49 o 7 18 1 1609.57 1816.95 110.07 o 8 18 1 25.74 77.02 48.59 o 9 18 1 1402.65 1419.32 103.97 o 10 18 1 790.73 808.76 86.08 o 11 18 1 77.56 189.45 60.35 o 0 19 1 10.45 -3.90 40.34 o 1 19 1 180.76 180.96 52.51 o 2 19 1 17.27 32.05 44.44 o 3 19 1 312.26 215.20 56.62 o 4 19 1 306.45 241.24 61.25 o 5 19 1 7479.78 7562.23 226.42 o 6 19 1 167.07 188.18 56.84 o 7 19 1 149.68 158.72 56.36 o 8 19 1 103.24 55.10 50.62 o 9 19 1 7.49 -22.80 48.87 o 1 20 1 495.33 445.85 68.32 o 2 20 1 376.53 318.88 61.93 o 3 20 1 847.17 991.81 97.34 o 4 20 1 165.84 168.89 62.05 o 5 20 1 567.23 534.32 80.29 o 6 20 1 913.08 906.94 93.68 o 7 20 1 4911.39 5485.21 214.13 o 0 21 1 153.44 187.60 57.71 o 1 21 1 1057.78 1085.68 94.77 o 2 21 1 144.88 184.07 58.38 o 3 21 1 551.67 521.70 74.16 o 4 21 1 1051.02 892.21 94.72 o 5 21 1 570.44 461.50 77.21 o 0 0 2 6053.58 6086.93 55.66 o 1 0 2 671.02 635.44 21.06 o 2 0 2 44.44 55.17 10.45 o 3 0 2 20.42 44.62 10.37 o 4 0 2 452.59 512.97 36.03 o 5 0 2 1390.51 1426.48 85.36 o 6 0 2 4.23 44.08 11.67 o 7 0 2 138.83 148.36 13.93 o 8 0 2 6040.50 6356.06 304.95 o 9 0 2 3758.40 3899.03 53.97 o 10 0 2 160.77 164.62 13.86 o 11 0 2 1352.17 1397.14 39.43 o 12 0 2 5655.27 5755.64 85.00 o 13 0 2 2022.59 2138.75 64.91 o 14 0 2 6553.35 6651.03 117.03 o 15 0 2 1062.18 1150.74 74.84 o 16 0 2 3221.65 3133.30 132.23 o 17 0 2 2556.40 2265.48 130.22 o 18 0 2 257.70 286.21 60.86 o 19 0 2 2373.49 1835.01 120.79 o 1 1 2 249.29 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11970.02 248.66 o 5 16 4 0.90 -35.81 35.81 o 6 16 4 5049.36 4976.88 172.94 o 7 16 4 927.08 870.62 80.50 o 8 16 4 6580.77 6436.45 209.85 o 9 16 4 218.44 148.13 52.61 o 10 16 4 474.61 442.45 72.95 o 11 16 4 94.24 15.28 52.64 o 1 17 4 442.35 396.03 60.40 o 2 17 4 92.74 156.48 49.03 o 3 17 4 558.83 471.94 65.97 o 4 17 4 912.71 901.07 81.71 o 5 17 4 350.29 431.50 67.86 o 6 17 4 465.92 450.95 68.07 o 7 17 4 267.15 283.66 63.66 o 8 17 4 90.42 27.91 51.63 o 9 17 4 19.27 26.99 50.42 o 10 17 4 43.05 24.97 48.97 o 0 18 4 12722.54 12905.45 277.04 o 1 18 4 388.24 374.42 63.29 o 2 18 4 166.00 187.55 52.89 o 3 18 4 50.47 144.08 52.06 o 4 18 4 428.59 417.09 68.94 o 5 18 4 2844.85 3004.44 156.89 o 6 18 4 8943.06 9122.59 257.76 o 7 18 4 2.40 31.81 48.05 o 8 18 4 10629.45 10253.91 281.06 o 9 18 4 101.09 -0.19 49.90 o 1 19 4 24.50 85.46 49.65 o 2 19 4 4.69 50.80 47.67 o 3 19 4 0.82 -0.63 51.23 o 4 19 4 33.23 60.35 51.67 o 5 19 4 688.46 621.08 75.10 o 6 19 4 513.98 350.91 69.33 o 7 19 4 981.79 801.44 91.37 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8010.35 228.45 o 4 14 7 1199.57 1294.52 98.33 o 5 14 7 125.82 193.85 58.53 o 6 14 7 0.72 -38.12 45.26 o 7 14 7 1466.78 1334.33 105.97 o 8 14 7 1265.13 1232.71 102.15 o 9 14 7 1020.78 810.63 92.39 o 0 15 7 1837.59 1719.51 110.94 o 1 15 7 824.01 892.18 85.94 o 2 15 7 793.54 803.05 82.17 o 3 15 7 2.47 29.50 51.48 o 4 15 7 82.65 160.72 57.27 o 5 15 7 92.76 154.79 54.96 o 6 15 7 420.42 475.06 76.27 o 7 15 7 2284.49 2381.64 158.29 o 8 15 7 410.32 378.43 71.44 o 1 16 7 12264.05 12358.92 297.04 o 2 16 7 697.32 727.24 83.41 o 3 16 7 3066.56 3365.23 174.31 o 4 16 7 89.15 128.90 54.18 o 5 16 7 283.94 331.89 66.70 o 6 16 7 744.90 647.55 85.39 o 0 17 7 1293.20 1051.88 100.18 o 1 17 7 141.11 177.80 64.65 o 2 17 7 136.85 153.41 58.19 o 3 17 7 274.01 288.77 68.09 o 0 0 8 13476.92 13455.92 47.20 o 1 0 8 81.83 104.54 26.02 o 2 0 8 381.39 300.94 53.16 o 3 0 8 3061.84 2998.07 81.86 o 4 0 8 4512.48 4401.33 98.66 o 5 0 8 3368.89 3282.23 146.28 o 6 0 8 1025.29 1083.55 137.67 o 7 0 8 3653.76 3720.07 130.40 o 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100.90 o 5 15 8 1295.16 1085.46 102.98 o 1 0 9 1978.20 1797.43 103.27 o 2 0 9 2902.59 2887.37 124.25 o 3 0 9 11439.45 11114.69 260.41 o 4 0 9 5833.63 5736.62 166.64 o 5 0 9 1348.90 1501.27 89.24 o 6 0 9 107.45 127.18 46.33 o 7 0 9 218.47 248.96 54.59 o 8 0 9 5442.62 5044.91 180.45 o 9 0 9 5705.77 5822.20 194.96 o 10 0 9 5669.44 6241.47 209.54 o 11 0 9 6268.93 6366.88 222.32 o 0 1 9 2870.63 3006.58 137.29 o 1 1 9 69.61 83.99 31.17 o 2 1 9 4502.34 4547.99 137.79 o 3 1 9 1226.70 1320.62 150.34 o 4 1 9 592.62 651.12 46.05 o 5 1 9 711.38 729.25 48.11 o 6 1 9 381.48 451.52 43.28 o 7 1 9 18.68 45.12 31.62 o 8 1 9 63.90 93.19 74.50 o 9 1 9 482.85 498.19 77.89 o 10 1 9 609.20 640.20 55.33 o 11 1 9 14.55 52.00 37.81 o 1 2 9 6354.17 6419.36 121.23 o 2 2 9 687.33 631.25 44.65 o 3 2 9 417.98 525.30 42.31 o 4 2 9 151.97 225.35 52.77 o 5 2 9 66.88 39.65 31.41 o 6 2 9 28.95 -14.21 45.81 o 7 2 9 1816.51 1801.67 71.98 o 8 2 9 0.07 -45.12 48.25 o 9 2 9 3995.30 4245.86 132.32 o 10 2 9 20.62 -13.01 92.59 o 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92.05 o 10 5 9 178.51 234.95 60.22 o 1 6 9 148.40 295.74 54.43 o 2 6 9 873.57 898.44 76.11 o 3 6 9 3559.53 3441.76 148.68 o 4 6 9 477.07 343.28 60.41 o 5 6 9 4244.45 4241.30 165.61 o 6 6 9 43.82 46.61 47.67 o 7 6 9 3777.10 3685.54 167.36 o 8 6 9 108.57 258.11 60.79 o 9 6 9 2500.34 2422.36 156.44 o 10 6 9 659.32 610.72 78.81 o 0 7 9 6341.59 6466.14 188.26 o 1 7 9 287.64 373.67 59.47 o 2 7 9 2426.18 2484.50 116.91 o 3 7 9 316.73 285.38 57.64 o 4 7 9 877.61 902.13 80.59 o 5 7 9 711.65 774.85 77.67 o 7 7 9 27.42 -34.90 44.59 o 8 7 9 63.22 -47.58 47.58 o 9 7 9 302.21 218.18 62.89 o 1 8 9 573.61 625.51 71.42 o 2 8 9 5317.40 5311.98 183.97 o 3 8 9 13225.58 13065.35 284.81 o 4 8 9 1354.76 904.38 111.22 o 5 8 9 2971.16 3092.49 153.11 o 6 8 9 37.91 56.83 50.95 o 7 8 9 1980.56 1916.64 117.55 o 8 8 9 1347.45 1236.91 100.68 o 9 8 9 802.24 688.00 86.71 o 0 9 9 5170.66 5229.97 180.82 o 1 9 9 165.98 270.15 62.10 o 2 9 9 562.91 630.41 73.49 o 3 9 9 1245.11 1127.51 89.84 o 4 9 9 24.50 -47.62 47.62 o 5 9 9 1147.55 1220.16 96.87 o 6 9 9 73.11 91.20 56.30 o 7 9 9 1099.38 1076.09 96.08 o 8 9 9 1380.78 1272.40 105.37 o 9 9 9 245.13 342.33 71.80 o 10 9 9 100.26 11.23 52.84 o 1 10 9 1700.70 1510.06 104.04 o 2 10 9 979.26 1091.27 91.67 o 3 10 9 70.45 32.54 51.34 o 4 10 9 1306.29 1252.98 99.75 o 5 10 9 4393.66 4710.12 195.51 o 6 10 9 3.20 75.67 53.98 o 7 10 9 7683.60 8098.07 249.36 o 8 10 9 1574.23 1559.56 115.18 o 9 10 9 363.73 366.77 72.83 o 0 11 9 8814.59 8460.83 244.73 o 1 11 9 1730.87 1566.74 108.98 o 2 11 9 570.87 523.86 73.30 o 3 11 9 4985.36 5016.71 199.45 o 4 11 9 1041.90 1034.81 93.27 o 5 11 9 3757.74 3875.06 187.48 o 6 11 9 1641.46 1361.03 110.02 o 7 11 9 20.47 91.68 56.01 o 8 11 9 1576.64 1679.55 123.01 o 1 12 9 3190.63 3226.49 171.20 o 2 12 9 1534.58 1313.71 106.22 o 3 12 9 16.50 -31.09 51.38 o 4 12 9 2011.40 1959.16 127.33 o 5 12 9 4781.14 4960.26 214.71 o 6 12 9 25.55 14.60 60.49 o 0 13 9 56.78 226.60 61.22 o 1 13 9 457.36 503.51 77.82 o 2 13 9 2351.16 2132.79 134.39 o 3 13 9 2694.64 2510.89 143.45 o 4 13 9 8.09 -33.26 54.51 o 0 0 10 4473.62 4303.13 168.17 o 1 0 10 9586.28 9349.45 235.14 o 2 0 10 245.89 308.77 61.15 o 3 0 10 150.61 203.36 55.69 o 4 0 10 5231.69 5408.60 185.76 o 5 0 10 575.46 623.18 74.99 o 6 0 10 2336.25 2182.36 121.71 o 7 0 10 3816.85 4067.78 182.90 o 8 0 10 21113.52 21922.47 390.08 o 9 0 10 3468.05 3473.86 161.15 o 1 1 10 55.38 117.29 53.70 o 2 1 10 1066.71 1107.54 61.88 o 3 1 10 83.68 126.48 37.73 o 4 1 10 212.12 282.95 42.28 o 5 1 10 350.93 408.92 46.45 o 6 1 10 486.02 456.82 87.42 o 7 1 10 167.51 245.13 43.27 o 8 1 10 67.96 117.31 43.70 o 0 2 10 23.69 51.72 48.44 o 1 2 10 503.05 509.18 67.21 o 2 2 10 112.16 65.32 44.06 o 3 2 10 1451.40 1503.54 98.53 o 4 2 10 2467.99 2559.20 142.93 o 5 2 10 21.70 -3.95 45.55 o 6 2 10 4809.63 4778.16 188.15 o 7 2 10 526.33 539.63 74.40 o 8 2 10 4645.52 4669.54 196.77 o 1 3 10 311.97 294.69 59.71 o 2 3 10 54.90 141.09 49.70 o 3 3 10 1907.99 1925.85 108.16 o 4 3 10 103.29 51.15 49.08 o 5 3 10 179.55 122.85 52.51 o 6 3 10 139.65 120.48 55.15 o 7 3 10 723.18 713.91 85.24 o 8 3 10 29.29 -41.55 50.56 o 0 4 10 7522.12 6974.47 217.35 o 1 4 10 12284.04 12224.83 136.47 o 2 4 10 660.07 768.72 78.91 o 3 4 10 104.73 174.51 54.57 o 4 4 10 522.13 620.55 73.58 o 5 4 10 3970.06 4222.63 176.80 o 6 4 10 7922.11 8243.03 239.44 o 7 4 10 2154.71 2132.74 123.84 o 8 4 10 4.33 121.17 54.17 o 1 5 10 727.04 713.65 80.71 o 2 5 10 1405.32 1440.26 100.40 o 3 5 10 589.20 489.24 70.46 o 4 5 10 184.91 183.32 53.62 o 5 5 10 221.95 401.77 67.27 o 6 5 10 211.55 132.41 56.66 o 7 5 10 469.55 586.56 79.56 o 0 6 10 5992.27 5932.10 206.09 o 1 6 10 576.36 671.15 77.93 o 2 6 10 8931.76 9307.25 250.72 o 3 6 10 13.63 58.32 51.48 o 4 6 10 1280.38 1351.40 101.87 o 5 6 10 1429.44 1356.14 102.77 o 6 6 10 58.06 30.80 53.41 o 7 6 10 376.00 286.90 65.60 o 1 7 10 67.34 50.13 52.78 o 2 7 10 493.91 431.48 71.26 o 3 7 10 21.18 43.72 51.14 o 4 7 10 39.58 64.40 53.02 o 5 7 10 762.70 725.74 82.93 o 6 7 10 276.39 226.75 64.43 o 0 8 10 5265.10 5371.81 204.53 o 1 8 10 2963.96 2959.38 145.04 o 2 8 10 10103.86 10448.15 276.77 o 3 8 10 4318.80 4569.64 198.64 o 4 8 10 2072.64 2108.43 128.66 o 5 8 10 975.47 1047.84 98.18 o 1 9 10 0.44 165.66 59.52 o 2 9 10 176.07 137.27 60.94 o 3 9 10 0.22 78.13 53.40 o 4 9 10 14.25 12.92 51.28 o 5 9 10 857.16 787.96 88.69 o 6 9 10 462.56 452.95 77.19 o 0 10 10 11250.34 10842.76 296.90 o 1 10 10 387.32 380.29 72.64 o 2 10 10 1927.24 1999.55 126.24 o 3 10 10 48.23 40.78 52.44 o 4 10 10 1390.62 1119.08 104.40 o 5 10 10 328.77 285.23 70.71 o 1 11 10 497.16 255.80 71.98 o 2 11 10 1406.89 1196.16 106.05 o 1 0 11 3066.59 2726.11 144.10 o 2 0 11 4078.30 4054.00 192.90 o 3 0 11 115.19 44.79 55.97 o 4 0 11 12.83 20.44 53.74 o 0 1 11 1895.84 1741.45 82.64 o 1 1 11 60.08 50.17 88.79 o 2 1 11 835.24 880.41 63.59 o 3 1 11 146.39 256.16 112.00 o 4 1 11 8.90 9.14 37.65 o 1 2 11 1062.15 997.08 95.35 o 2 2 11 605.09 506.76 75.14 o 3 2 11 156.47 209.58 64.85 o 0 3 11 386.68 336.88 70.86 o 1 3 11 1173.68 1184.18 104.17 o 2 3 11 1272.98 1297.49 106.89 o 3 3 11 46.53 -24.97 49.36 o 1 4 11 27.23 131.11 59.91 o 2 4 11 895.36 652.35 85.51 o 0 0 12 961.77 764.50 103.30 o ========================================================================================================================== EUDIDYMITE # h,k,l, Fc-squared, Fo-squared, sigma(Fo-squared) and status flag # data_eudidymite _shelx_title ' eudidymite' _shelx_refln_list_code 4 _shelx_F_calc_maximum 312.61 _exptl_crystal_F_000 532.57 _reflns_d_resolution_high 0.6494 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, y, -z+1/2' 'x+1/2, y+1/2, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y, z-1/2' '-x+1/2, -y+1/2, -z' 'x+1/2, -y+1/2, z-1/2' _cell_length_a 12.6188 _cell_length_b 7.3781 _cell_length_c 13.9940 _cell_angle_alpha 90.000 _cell_angle_beta 103.762 _cell_angle_gamma 90.000 _shelx_F_squared_multiplier 1.000 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 4 0 0 23324.00 23248.05 583.60 o 6 0 0 778.14 617.69 82.17 o 8 0 0 9009.22 8955.22 225.26 o 10 0 0 40039.08 40971.81 626.39 o 12 0 0 11253.60 10432.10 403.85 o 14 0 0 2761.74 2401.88 272.98 o 3 1 0 1499.08 1590.87 128.53 o 5 1 0 2870.36 2962.51 165.27 o 7 1 0 7472.44 7408.40 291.02 o 9 1 0 3956.89 4106.01 215.86 o 11 1 0 255.84 301.46 110.00 o 13 1 0 3635.31 3179.35 279.72 o 0 2 0 1740.05 1489.35 128.64 o 2 2 0 1719.52 1853.80 147.60 o 4 2 0 5125.67 5287.27 243.31 o 6 2 0 68.67 54.67 79.13 o 8 2 0 1007.36 976.54 120.59 o 10 2 0 1133.03 826.44 122.82 o 12 2 0 902.37 721.34 158.74 o 16 2 0 274.80 176.14 240.75 o 18 2 0 7948.30 9010.30 596.07 o 1 3 0 4829.58 5156.57 235.81 o 3 3 0 983.07 959.75 115.43 o 5 3 0 1086.76 1278.76 126.25 o 7 3 0 1523.29 1761.63 140.81 o 9 3 0 8853.74 8913.35 300.26 o 11 3 0 3969.12 4338.39 266.13 o 13 3 0 8613.83 8514.12 432.76 o 15 3 0 4787.20 3754.66 374.34 o 17 3 0 1273.60 899.10 300.04 o 0 4 0 465.45 584.75 105.29 o 2 4 0 480.25 707.10 105.27 o 4 4 0 14322.10 14454.53 353.03 o 6 4 0 294.43 299.56 91.52 o 8 4 0 14128.38 14790.17 368.41 o 10 4 0 21.89 15.71 119.07 o 12 4 0 4497.94 4032.75 319.99 o 14 4 0 15681.57 16777.22 682.70 o 16 4 0 111.65 598.73 295.86 o 1 5 0 963.49 753.83 132.39 o 3 5 0 2205.12 2313.02 175.86 o 5 5 0 72.82 102.71 92.33 o 7 5 0 12892.57 12776.43 419.12 o 9 5 0 18854.85 19246.06 603.02 o 11 5 0 5.10 -155.16 155.16 o 13 5 0 1809.36 1342.40 267.49 o 15 5 0 6681.34 5529.60 471.18 o 0 6 0 11142.96 11438.86 260.09 o 2 6 0 14555.96 14286.38 412.27 o 4 6 0 200.85 118.37 110.65 o 6 6 0 4949.61 4627.81 59.82 o 8 6 0 0.46 36.76 210.84 o 10 6 0 26.26 268.20 199.72 o 12 6 0 17097.61 17985.72 717.42 o 14 6 0 652.77 1307.29 313.30 o 16 6 0 1769.29 1765.32 375.69 o 1 7 0 804.93 477.65 160.70 o 3 7 0 1200.97 1220.07 187.66 o 5 7 0 1429.73 1928.42 246.13 o 7 7 0 10561.43 10893.78 532.75 o 9 7 0 2913.64 2749.64 283.41 o 11 7 0 56.15 511.67 240.43 o 13 7 0 628.97 1151.21 324.66 o 0 8 0 8424.85 8588.77 367.13 o 2 8 0 4917.89 4617.13 361.62 o 4 8 0 2597.49 2925.56 322.22 o 6 8 0 365.26 479.60 234.07 o 8 8 0 11122.65 10746.50 583.51 o 10 8 0 94.13 308.47 267.87 o 12 8 0 4666.77 4646.48 454.55 o 1 9 0 725.63 577.81 218.80 o 3 9 0 196.10 -64.78 199.12 o 5 9 0 2922.69 2883.93 326.67 o 7 9 0 671.26 1105.62 291.02 o 9 9 0 1334.89 1566.91 352.54 o 11 9 0 4380.69 4612.19 489.55 o 0 10 0 111.72 -215.32 215.32 o 2 10 0 1758.23 1848.58 326.40 o 4 10 0 203.05 185.43 252.33 o 6 10 0 3077.00 3776.83 417.00 o 8 10 0 3.35 -273.63 273.63 o 1 11 0 558.50 275.26 298.69 o 3 11 0 13702.24 12060.80 770.57 o -13 1 1 663.99 470.85 170.21 o -11 1 1 5975.98 5412.32 269.88 o -9 1 1 364.86 392.76 110.81 o -7 1 1 5138.38 4846.91 223.47 o -5 1 1 383.54 393.52 96.52 o -3 1 1 3207.30 3208.53 136.80 o 1 1 1 886.47 224.67 314.01 o 3 1 1 197.29 100.65 104.29 o 5 1 1 951.77 744.81 111.19 o 7 1 1 9867.55 9978.59 326.08 o 9 1 1 780.95 555.91 108.42 o 11 1 1 2414.17 2519.75 204.12 o 13 1 1 66.17 31.09 171.57 o -18 2 1 202.55 -148.20 270.86 o -16 2 1 281.16 238.25 243.31 o -14 2 1 327.60 -0.87 165.48 o -12 2 1 68.67 270.37 133.15 o -10 2 1 12141.95 11803.42 330.70 o -8 2 1 854.36 730.30 108.91 o -6 2 1 29023.17 29581.15 481.67 o -4 2 1 12575.60 12557.56 114.32 o -2 2 1 6999.55 7014.61 263.74 o 0 2 1 361.54 576.51 104.75 o 2 2 1 22557.95 22445.57 404.99 o 4 2 1 957.26 1187.30 126.41 o 6 2 1 1884.58 2247.32 152.22 o 8 2 1 203.20 191.46 86.19 o 10 2 1 5.89 -91.14 91.14 o 12 2 1 642.37 714.92 173.64 o 14 2 1 59.42 -173.04 173.04 o 16 2 1 8159.13 7977.89 520.74 o 18 2 1 324.30 577.48 322.27 o -17 3 1 67.84 -22.28 274.12 o -15 3 1 485.06 228.58 226.89 o -13 3 1 1107.90 1070.29 222.38 o -11 3 1 349.88 324.39 132.28 o -9 3 1 1063.00 1150.94 125.05 o -7 3 1 221.82 414.55 94.62 o -5 3 1 494.69 299.72 88.91 o -3 3 1 609.63 798.94 109.45 o -1 3 1 8318.39 8629.45 285.37 o 1 3 1 337.39 270.37 94.40 o 3 3 1 88.50 181.41 88.58 o 5 3 1 39.36 67.55 81.36 o 7 3 1 937.61 1070.45 119.02 o 9 3 1 2565.14 2493.89 167.49 o 11 3 1 2297.69 2221.88 206.62 o 13 3 1 313.13 593.95 184.34 o 15 3 1 25703.22 28026.53 871.82 o 17 3 1 626.64 948.45 314.23 o -16 4 1 9274.20 8942.92 563.84 o -14 4 1 798.50 1004.32 244.77 o -12 4 1 985.72 764.54 194.61 o -10 4 1 4321.23 4241.87 248.74 o -8 4 1 639.02 610.41 103.20 o -6 4 1 19917.42 19821.96 410.53 o -4 4 1 2375.64 2401.28 158.91 o -2 4 1 16487.00 17579.26 381.94 o 0 4 1 13843.33 14483.54 404.93 o 2 4 1 1094.83 1376.97 128.96 o 4 4 1 276.80 288.25 92.06 o 6 4 1 810.81 856.93 116.68 o 8 4 1 6532.60 5774.38 266.84 o 10 4 1 14097.45 14088.89 470.04 o 12 4 1 871.26 747.80 199.99 o 14 4 1 6228.30 5455.47 406.35 o 16 4 1 1370.91 666.45 306.02 o -17 5 1 280.95 120.81 313.90 o -15 5 1 6946.03 6855.65 498.14 o -13 5 1 3067.25 3638.47 332.16 o -11 5 1 706.37 1018.50 215.81 o -9 5 1 3596.50 3870.42 286.68 o -7 5 1 0.49 74.13 110.92 o -5 5 1 14032.85 13922.15 402.05 o -3 5 1 3186.62 3233.16 203.20 o -1 5 1 7486.13 8508.64 322.65 o 1 5 1 295.97 497.32 113.42 o 3 5 1 3135.71 3539.83 213.04 o 5 5 1 12900.81 14133.07 407.60 o 7 5 1 8405.07 8999.05 372.60 o 9 5 1 155.19 100.49 143.64 o 11 5 1 3581.11 3710.21 307.60 o 13 5 1 2931.48 2811.59 315.64 o 15 5 1 11066.08 12577.90 660.85 o -16 6 1 1752.23 1202.62 360.64 o -14 6 1 2499.34 2275.36 360.97 o -12 6 1 1505.16 1383.27 267.87 o -10 6 1 2587.98 2395.03 297.22 o -8 6 1 304.14 268.97 125.70 o -6 6 1 2394.48 2270.00 139.07 o -4 6 1 4220.06 4510.56 257.87 o -2 6 1 733.21 727.48 126.63 o 0 6 1 4473.23 4597.47 178.58 o 2 6 1 727.26 865.68 133.15 o 4 6 1 394.72 640.41 130.59 o 6 6 1 11.75 4.51 81.60 o 8 6 1 6095.48 6311.67 556.12 o 10 6 1 2248.55 2401.17 309.01 o 14 6 1 755.27 215.32 298.14 o -15 7 1 306.92 606.12 329.88 o -13 7 1 14020.62 16133.71 736.61 o -11 7 1 2189.08 2193.95 310.70 o -9 7 1 695.20 688.84 241.68 o -7 7 1 602.27 1099.31 238.91 o -5 7 1 503.87 299.83 176.08 o -3 7 1 3330.47 3481.90 269.50 o -1 7 1 17.41 350.75 135.27 o 1 7 1 15115.58 13579.88 512.65 o 3 7 1 3873.89 3529.72 278.52 o 5 7 1 3559.46 3351.52 298.69 o 7 7 1 1248.51 1357.29 255.59 o 9 7 1 9767.36 9872.72 538.24 o 11 7 1 13325.64 13231.42 672.91 o 13 7 1 1041.08 1557.50 341.84 o -12 8 1 2.60 -111.36 243.14 o -10 8 1 534.60 195.59 260.70 o -8 8 1 283.11 -38.91 217.17 o -6 8 1 2739.29 2730.56 344.61 o -4 8 1 3917.81 4180.30 368.63 o -2 8 1 62.80 374.12 188.69 o 0 8 1 2211.98 2114.73 193.07 o 2 8 1 120.87 -50.76 179.94 o 4 8 1 45.27 219.45 201.46 o 6 8 1 1779.50 1618.43 247.00 o 8 8 1 9612.95 9955.60 511.23 o 10 8 1 126.75 402.87 277.06 o 12 8 1 5369.30 5913.67 496.89 o -11 9 1 267.02 1005.29 331.51 o -9 9 1 2435.25 2010.42 358.52 o -7 9 1 108.27 407.21 254.56 o -5 9 1 4548.29 4573.55 378.25 o -3 9 1 0.91 295.43 214.50 o -1 9 1 19.44 -87.44 192.44 o 1 9 1 6062.47 5386.51 379.34 o 3 9 1 463.40 902.47 235.70 o 5 9 1 15453.41 15086.03 664.71 o 7 9 1 6349.59 6883.25 486.89 o 11 9 1 1949.26 1066.11 354.34 o -8 10 1 394.50 808.51 314.34 o -6 10 1 65.04 -185.21 247.38 o -4 10 1 9891.72 9311.33 559.06 o -2 10 1 920.73 229.99 255.70 o 0 10 1 6055.00 6845.39 344.43 o 2 10 1 8596.17 8701.40 539.44 o 4 10 1 668.74 510.91 274.45 o 6 10 1 133.73 370.37 286.73 o 8 10 1 217.55 -188.74 280.81 o -3 11 1 1988.70 2438.51 391.07 o -1 11 1 2321.42 1537.07 349.93 o 1 11 1 186.85 286.30 293.52 o 3 11 1 679.21 547.43 317.76 o -14 0 2 1829.01 1943.74 262.11 o -12 0 2 3269.02 3096.20 225.86 o -10 0 2 36306.81 35677.59 604.38 o -8 0 2 50179.91 49703.27 673.18 o -6 0 2 7098.07 7282.75 283.25 o -4 0 2 32507.75 33694.77 502.65 o -2 0 2 60.41 -289.66 289.66 o 2 0 2 308.81 9.95 121.63 o 4 0 2 15.95 129.45 98.26 o 6 0 2 185.58 122.99 95.21 o 8 0 2 901.95 843.02 120.43 o 10 0 2 1281.14 1096.70 138.69 o 12 0 2 15137.02 15924.48 539.82 o 14 0 2 19768.23 20439.99 731.50 o -13 1 2 230.72 60.05 151.68 o -11 1 2 3979.48 3445.81 212.00 o -9 1 2 1817.97 1752.55 152.60 o -7 1 2 2852.96 2932.95 192.28 o -5 1 2 8300.72 8381.90 275.97 o -3 1 2 115.90 78.48 95.00 o 3 1 2 4074.94 4110.25 193.04 o 5 1 2 8983.06 8963.57 290.70 o 7 1 2 3211.36 3192.67 186.03 o 9 1 2 43802.10 45136.14 659.76 o 11 1 2 508.44 307.33 135.76 o 13 1 2 627.73 465.04 198.36 o -18 2 2 8416.10 7961.21 552.32 o -16 2 2 141.21 268.14 231.51 o -14 2 2 1920.78 1533.97 231.24 o -12 2 2 1099.99 1023.17 164.29 o -10 2 2 2662.85 2310.25 158.36 o -8 2 2 578.13 340.91 93.37 o -6 2 2 14777.94 15443.90 361.56 o -4 2 2 1371.78 1485.77 135.27 o -2 2 2 9809.87 9660.50 292.27 o 2 2 2 160.44 172.39 100.81 o 4 2 2 9987.29 9538.00 307.33 o 6 2 2 1378.29 1318.33 129.89 o 8 2 2 52.17 -46.41 78.48 o 10 2 2 21015.66 22262.91 474.66 o 12 2 2 987.98 901.93 184.94 o 14 2 2 6015.63 5350.04 376.73 o 16 2 2 5305.57 5087.71 441.18 o 18 2 2 1116.18 1751.19 366.29 o -17 3 2 4743.00 4344.15 439.99 o -15 3 2 215.82 139.34 206.41 o -13 3 2 3198.29 3147.45 288.69 o -11 3 2 10504.47 10222.33 383.47 o -9 3 2 29304.09 28558.74 489.82 o -7 3 2 7498.46 8137.94 285.10 o -5 3 2 3445.05 3402.72 178.36 o -3 3 2 4357.10 4556.81 199.29 o -1 3 2 1030.24 1157.24 117.06 o 1 3 2 12300.43 12021.40 327.98 o 3 3 2 1103.42 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