#------------------------------------------------------------------------------
#$Date: 2010-03-05 20:15:21 +0200 (Fri, 05 Mar 2010) $
#$Revision: 1024 $
#$URL: file:///home/coder/svn-repositories/cod/hkl/2/2017519.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_2017519_Fobs
loop_
_publ_author_name
'Mohammadnezhad, Gholamhossein'
'Amini, Mostafa M.'
'Langer, Vratislav'
_publ_section_title
;
 Two polymorphs of a lead(II) complex with 8-hydroxy-2-methylquinoline
 and thiocyanate
;
_journal_coeditor_code           SF3124
_journal_issue                   2
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m44
_journal_page_last               m47
_journal_volume                  66
_journal_year                    2010
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                78.524
_cell_angle_beta                 69.771
_cell_angle_gamma                82.813
_cell_length_a                   7.8556
_cell_length_b                   8.4155
_cell_length_c                   9.1550
_exptl_crystal_F_000             388.00
_reflns_d_resolution_high        0.6551
_[local]_cod_data_source_file    sf3124Iasup2.hkl
_[local]_cod_data_source_block   Ia
#BEGIN Tags that were not found in dictionaries:
_shelx_title                     ' a in P-1'
_shelx_refln_list_code           4
_shelx_f_calc_maximum            198.06
_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'
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
1 0 0 12363.12 12526.38 359.61 o
2 0 0 239.45 271.04 11.75 o
3 0 0 9919.79 10474.53 337.34 o
4 0 0 8301.14 8772.63 256.78 o
5 0 0 1414.49 1563.48 53.93 o
6 0 0 5.20 13.76 14.47 o
7 0 0 2760.91 2946.79 110.10 o
8 0 0 4154.09 4361.05 158.35 o
9 0 0 1467.35 1425.72 92.45 o
10 0 0 33.97 62.83 80.49 o
11 0 0 1123.51 999.89 156.55 o
-10 1 0 759.50 714.92 71.43 o
-9 1 0 338.49 390.90 115.12 o
-8 1 0 2354.82 2387.62 117.72 o
-7 1 0 5205.51 5537.94 189.70 o
-6 1 0 948.05 1000.39 40.50 o
-5 1 0 444.42 497.76 24.26 o
-4 1 0 6165.34 6601.50 193.94 o
-3 1 0 9265.66 9650.37 279.17 o
-2 1 0 6159.89 6564.83 219.97 o
-1 1 0 696.11 695.92 22.27 o
0 1 0 10869.07 9863.33 284.20 o
1 1 0 18607.45 16107.23 1143.32 o
2 1 0 1503.76 1572.97 60.85 o
3 1 0 5080.28 5477.58 180.32 o
4 1 0 9963.98 10878.51 318.26 o
5 1 0 4180.66 4457.91 174.49 o
6 1 0 877.01 948.37 46.58 o
7 1 0 936.13 1014.20 52.29 o
8 1 0 4335.57 4295.57 159.05 o
9 1 0 3494.49 3498.74 278.18 o
10 1 0 232.13 186.71 69.87 o
11 1 0 576.93 428.50 148.97 o
-10 2 0 1694.04 1586.41 141.78 o
-9 2 0 33.08 26.87 35.05 o
-8 2 0 2219.12 2087.60 105.38 o
-7 2 0 5031.45 5153.96 186.15 o
-6 2 0 2641.72 2788.95 89.90 o
-5 2 0 532.62 577.37 25.82 o
-4 2 0 3124.25 3426.10 103.27 o
-3 2 0 16735.78 17641.02 507.06 o
-2 2 0 13295.49 13109.14 376.13 o
-1 2 0 2707.62 2692.88 92.93 o
0 2 0 15327.85 14018.61 402.41 o
1 2 0 22017.68 19384.51 556.85 o
2 2 0 9891.96 10061.41 291.89 o
3 2 0 186.45 227.85 28.60 o
4 2 0 7340.39 7626.43 253.30 o
5 2 0 5336.68 5629.36 192.92 o
6 2 0 3956.85 4234.04 151.13 o
7 2 0 13.03 -17.89 22.43 o
8 2 0 338.59 348.74 38.19 o
9 2 0 2592.33 2422.89 128.12 o
10 2 0 1090.63 1138.96 96.89 o
11 2 0 84.76 164.89 143.57 o
-10 3 0 2277.04 2210.14 123.05 o
-9 3 0 1132.72 1129.85 76.29 o
-8 3 0 57.39 71.77 31.66 o
-7 3 0 3191.79 3477.18 130.41 o
-6 3 0 3572.71 3758.09 136.08 o
-5 3 0 1499.80 1492.11 59.85 o
-4 3 0 167.47 188.46 12.23 o
-3 3 0 7657.07 7719.36 224.77 o
-2 3 0 14021.02 13500.59 389.70 o
-1 3 0 11940.70 10493.25 420.49 o
0 3 0 5594.84 5503.50 160.17 o
1 3 0 12120.55 10981.69 318.09 o
2 3 0 13401.69 12944.18 427.12 o
3 3 0 691.83 688.39 27.93 o
4 3 0 2903.21 3018.16 108.98 o
5 3 0 7297.16 7920.57 327.89 o
6 3 0 5109.78 5274.87 185.68 o
7 3 0 1023.33 1042.63 64.70 o
8 3 0 524.83 518.38 90.84 o
9 3 0 2079.64 2130.78 102.99 o
10 3 0 1633.27 1800.91 99.56 o
-10 4 0 2024.00 1998.33 149.05 o
-9 4 0 2107.78 2193.65 115.37 o
-8 4 0 172.08 159.35 32.39 o
-7 4 0 1441.74 1485.33 66.85 o
-6 4 0 4234.61 4441.36 158.89 o
-5 4 0 2843.86 2898.65 105.75 o
-4 4 0 476.53 484.61 26.86 o
-3 4 0 1120.46 1093.09 37.21 o
-2 4 0 11378.20 10449.34 304.35 o
-1 4 0 15450.19 13784.47 399.78 o
0 4 0 2841.74 2875.76 87.53 o
1 4 0 5421.74 5081.03 150.84 o
2 4 0 14525.24 13633.38 397.06 o
3 4 0 4411.17 4318.04 132.05 o
4 4 0 124.34 119.76 27.57 o
5 4 0 1060.61 1031.05 53.96 o
6 4 0 4637.90 5125.53 182.14 o
7 4 0 1536.30 1699.35 130.24 o
8 4 0 214.79 204.80 37.05 o
9 4 0 1018.62 1040.32 68.67 o
10 4 0 2057.74 2166.06 136.54 o
-9 5 0 2293.96 2107.94 126.49 o
-8 5 0 1368.64 1352.32 69.46 o
-7 5 0 149.55 180.27 25.71 o
-6 5 0 1937.59 1985.24 79.65 o
-5 5 0 5102.75 5100.93 179.21 o
-4 5 0 1260.49 1243.49 52.23 o
-3 5 0 769.29 720.81 27.70 o
-2 5 0 4775.39 4254.19 128.90 o
-1 5 0 14053.39 12717.99 369.75 o
0 5 0 2866.66 2611.23 81.53 o
1 5 0 455.93 434.34 21.44 o
2 5 0 10476.07 10349.82 303.45 o
3 5 0 9187.08 8901.95 264.07 o
4 5 0 777.74 752.93 41.71 o
5 5 0 477.98 449.70 34.98 o
6 5 0 2875.68 3202.87 125.08 o
7 5 0 2315.41 2546.68 178.26 o
8 5 0 1051.04 1050.43 65.80 o
9 5 0 98.90 135.46 44.86 o
10 5 0 1528.66 1492.45 114.49 o
-9 6 0 1667.39 1815.91 149.42 o
-8 6 0 1350.12 1407.29 113.55 o
-7 6 0 190.68 246.14 34.49 o
-6 6 0 1293.90 1371.92 61.42 o
-5 6 0 3293.43 3387.64 123.93 o
-4 6 0 5740.93 5260.30 184.10 o
-3 6 0 2698.06 2573.44 95.26 o
-2 6 0 444.81 447.69 26.00 o
-1 6 0 7087.47 6498.73 195.47 o
0 6 0 6724.94 6558.70 196.28 o
1 6 0 402.76 353.87 21.67 o
2 6 0 3987.96 3854.71 119.94 o
3 6 0 7718.44 7841.25 235.07 o
4 6 0 2685.55 2655.35 101.94 o
5 6 0 7.99 1.03 21.78 o
6 6 0 1157.15 1157.56 73.29 o
7 6 0 1895.72 1907.47 91.18 o
8 6 0 1031.32 1186.75 76.94 o
9 6 0 71.01 -38.46 103.62 o
-8 7 0 2426.08 2249.73 132.27 o
-7 7 0 679.22 687.40 61.65 o
-6 7 0 102.75 90.06 29.54 o
-5 7 0 2051.36 1824.09 98.34 o
-4 7 0 3291.80 3064.65 113.47 o
-3 7 0 1909.86 1738.61 69.60 o
-2 7 0 38.06 50.24 14.22 o
-1 7 0 3396.15 3217.37 115.50 o
0 7 0 6909.78 7066.91 212.32 o
1 7 0 2571.76 2633.97 87.60 o
2 7 0 600.86 624.42 32.29 o
3 7 0 5438.26 5466.13 168.76 o
4 7 0 4716.88 4804.00 212.29 o
5 7 0 2664.69 2496.76 102.37 o
6 7 0 80.59 73.69 33.28 o
7 7 0 785.65 758.89 58.62 o
8 7 0 1668.27 1696.90 116.99 o
9 7 0 387.41 410.85 86.21 o
-8 8 0 1354.56 1591.95 183.30 o
-7 8 0 1788.37 1727.78 108.22 o
-6 8 0 326.91 311.55 43.96 o
-5 8 0 475.82 451.67 44.92 o
-4 8 0 2117.32 2086.17 107.86 o
-3 8 0 2458.15 2162.60 108.93 o
-2 8 0 980.58 934.04 58.17 o
-1 8 0 505.09 465.42 37.36 o
0 8 0 5476.42 5564.52 173.77 o
1 8 0 4556.95 4580.84 145.58 o
2 8 0 262.87 266.71 24.59 o
3 8 0 1638.48 1699.65 75.71 o
4 8 0 2524.13 2469.34 101.15 o
5 8 0 556.40 567.66 46.01 o
6 8 0 13.57 2.08 32.98 o
7 8 0 441.56 307.96 65.13 o
8 8 0 1286.82 1219.78 113.23 o
-6 9 0 712.26 783.89 68.11 o
-5 9 0 8.37 -30.29 30.29 o
-4 9 0 1250.56 1302.05 148.87 o
-3 9 0 3107.04 3088.78 150.18 o
-2 9 0 1710.11 1779.05 117.38 o
-1 9 0 4.45 -20.51 21.08 o
0 9 0 1705.03 1750.70 92.95 o
1 9 0 5590.71 5754.34 210.14 o
2 9 0 2256.57 2469.63 145.08 o
3 9 0 33.24 57.70 29.93 o
4 9 0 1689.34 1783.03 85.90 o
5 9 0 2261.94 2224.31 102.08 o
6 9 0 354.02 351.35 69.13 o
7 9 0 11.14 -19.17 64.08 o
8 9 0 549.08 451.99 146.59 o
-5 10 0 250.42 262.19 47.41 o
-4 10 0 56.70 80.38 35.12 o
-3 10 0 968.17 958.20 68.64 o
-2 10 0 1736.99 1732.15 98.22 o
-1 10 0 592.65 604.25 51.43 o
0 10 0 495.42 613.19 92.20 o
1 10 0 2504.69 2881.89 189.59 o
2 10 0 2254.85 2678.54 137.13 o
3 10 0 154.27 103.20 37.66 o
4 10 0 565.45 622.87 60.27 o
5 10 0 1547.37 1619.39 163.32 o
6 10 0 698.69 618.98 113.83 o
-4 11 0 20.24 45.86 50.93 o
-3 11 0 570.53 718.76 65.33 o
-2 11 0 1491.93 1717.71 103.77 o
-1 11 0 1425.64 1491.20 93.91 o
0 11 0 13.04 1.87 34.58 o
1 11 0 873.56 1077.33 78.42 o
2 11 0 2043.87 2337.25 167.67 o
3 11 0 777.23 861.89 102.51 o
4 11 0 8.03 45.17 96.55 o
5 11 0 443.12 498.53 120.89 o
-2 12 0 782.10 924.25 95.66 o
-1 12 0 1204.69 1347.74 94.24 o
0 12 0 568.50 621.06 65.67 o
1 12 0 276.11 379.26 67.25 o
2 12 0 1668.89 1868.37 154.21 o
4 12 0 70.68 94.25 124.59 o
-3 -12 1 0.95 52.99 74.30 o
-2 -12 1 292.72 343.92 76.16 o
-1 -12 1 1116.10 1228.08 124.27 o
0 -12 1 318.41 455.78 75.51 o
1 -12 1 7.01 -20.45 50.17 o
-4 -11 1 927.45 855.11 80.71 o
-3 -11 1 256.70 286.57 58.01 o
-2 -11 1 87.66 121.60 49.19 o
-1 -11 1 1059.84 1507.13 130.64 o
0 -11 1 2585.46 2870.04 151.83 o
1 -11 1 529.78 504.60 55.71 o
2 -11 1 151.16 170.89 45.66 o
3 -11 1 1741.89 1679.92 106.13 o
-6 -10 1 8.57 55.20 94.77 o
-5 -10 1 717.56 821.93 91.47 o
-4 -10 1 2006.02 2034.63 120.80 o
-3 -10 1 633.54 649.46 62.77 o
-2 -10 1 74.66 37.22 38.86 o
-1 -10 1 700.52 853.09 58.53 o
0 -10 1 2404.75 2580.39 212.76 o
1 -10 1 1872.71 1892.25 106.24 o
2 -10 1 131.93 156.94 36.37 o
3 -10 1 1122.05 1016.77 72.00 o
4 -10 1 1778.17 1749.23 104.68 o
5 -10 1 755.46 714.18 67.61 o
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-6 -9 1 616.93 635.55 67.79 o
-5 -9 1 70.74 159.74 44.08 o
-4 -9 1 1826.38 1848.94 105.20 o
-3 -9 1 1707.01 1764.22 100.54 o
-2 -9 1 679.85 671.34 57.08 o
-1 -9 1 95.32 112.25 28.40 o
0 -9 1 1816.27 1823.11 86.09 o
1 -9 1 3143.35 3218.16 154.72 o
2 -9 1 1550.17 1495.78 84.86 o
3 -9 1 491.91 472.33 44.45 o
4 -9 1 2639.44 2578.84 132.27 o
5 -9 1 1568.08 1445.01 89.91 o
6 -9 1 214.20 198.78 43.58 o
-8 -8 1 231.87 207.64 105.73 o
-7 -8 1 2169.04 2240.52 113.91 o
-6 -8 1 1845.06 1611.67 85.93 o
-5 -8 1 335.59 297.58 41.25 o
-4 -8 1 810.99 749.79 50.38 o
-3 -8 1 3042.88 2971.74 142.02 o
-2 -8 1 1824.67 1776.90 78.78 o
-1 -8 1 239.71 239.01 27.01 o
0 -8 1 2058.59 2064.42 87.46 o
1 -8 1 4612.47 4598.58 175.08 o
2 -8 1 4443.53 4204.67 192.57 o
3 -8 1 136.89 133.27 27.55 o
4 -8 1 1249.86 1217.77 84.78 o
5 -8 1 4189.06 3956.25 188.74 o
6 -8 1 1052.97 1063.25 74.76 o
7 -8 1 3.66 -37.49 37.49 o
8 -8 1 562.59 726.52 136.68 o
-9 -7 1 813.01 703.68 147.56 o
-8 -7 1 0.41 -49.36 50.69 o
-7 -7 1 1563.83 1480.91 86.72 o
-6 -7 1 2878.01 2752.77 118.90 o
-5 -7 1 814.19 796.59 52.05 o
-4 -7 1 672.40 645.77 44.52 o
-3 -7 1 1539.49 1528.14 68.92 o
-2 -7 1 5170.16 5073.84 158.84 o
-1 -7 1 2337.07 2311.75 79.78 o
0 -7 1 35.54 36.07 15.45 o
1 -7 1 2613.60 2571.60 118.26 o
2 -7 1 6786.13 6138.83 222.41 o
3 -7 1 1440.89 1345.02 74.02 o
4 -7 1 512.50 468.45 39.19 o
5 -7 1 3249.38 3116.18 150.45 o
6 -7 1 2975.28 2926.49 147.26 o
7 -7 1 255.16 179.19 41.97 o
8 -7 1 183.21 209.93 51.87 o
9 -7 1 1090.18 980.59 163.08 o
-9 -6 1 1746.05 2077.62 289.56 o
-8 -6 1 1009.64 1088.15 196.78 o
-7 -6 1 325.52 359.77 47.82 o
-6 -6 1 3392.70 3365.06 135.83 o
-5 -6 1 3933.96 3742.32 142.42 o
-4 -6 1 79.05 138.07 25.16 o
-3 -6 1 3038.22 2830.66 109.51 o
-2 -6 1 5284.83 5046.85 166.79 o
-1 -6 1 5920.09 5733.27 173.21 o
0 -6 1 881.73 832.86 35.20 o
1 -6 1 583.52 556.62 27.79 o
2 -6 1 8228.30 7459.20 223.17 o
3 -6 1 4589.29 4130.90 145.60 o
4 -6 1 83.41 91.03 16.36 o
5 -6 1 1875.65 1845.06 96.75 o
6 -6 1 4514.11 4605.90 213.05 o
7 -6 1 1379.48 1416.48 89.07 o
8 -6 1 194.06 161.48 51.60 o
9 -6 1 382.60 309.35 58.94 o
-10 -5 1 332.69 415.93 124.59 o
-9 -5 1 1720.35 1764.96 101.38 o
-8 -5 1 1335.92 1284.74 75.66 o
-7 -5 1 9.82 -4.00 29.94 o
-6 -5 1 2428.71 2679.24 110.32 o
-5 -5 1 6050.52 5904.72 256.42 o
-4 -5 1 2088.90 1940.09 79.91 o
-3 -5 1 65.59 57.46 13.77 o
-2 -5 1 4668.60 4396.57 135.28 o
-1 -5 1 8602.47 8097.72 287.59 o
0 -5 1 5599.42 5355.95 159.54 o
1 -5 1 346.31 330.03 19.42 o
2 -5 1 5860.66 5402.03 162.16 o
3 -5 1 9338.42 8994.33 263.18 o
4 -5 1 3464.45 3459.96 122.89 o
5 -5 1 1956.46 1958.77 76.16 o
6 -5 1 4252.54 4178.23 151.37 o
7 -5 1 2737.27 2710.99 107.03 o
8 -5 1 448.45 386.94 51.55 o
9 -5 1 141.60 201.36 60.48 o
-10 -4 1 23.89 94.55 54.11 o
-9 -4 1 1428.08 1567.96 89.46 o
-8 -4 1 3361.35 3516.81 246.91 o
-7 -4 1 1019.09 1084.33 61.84 o
-6 -4 1 838.93 882.58 53.08 o
-5 -4 1 6931.39 7548.56 257.20 o
-4 -4 1 5398.19 5585.80 192.43 o
-3 -4 1 1527.87 1404.28 50.37 o
-2 -4 1 1649.59 1599.31 53.86 o
-1 -4 1 6932.14 6602.22 195.58 o
0 -4 1 5482.91 5132.91 152.52 o
1 -4 1 1684.83 1433.20 48.44 o
2 -4 1 2363.51 2129.83 67.55 o
3 -4 1 12427.60 11825.36 342.40 o
4 -4 1 8616.11 8604.81 361.99 o
5 -4 1 2146.80 2140.40 109.51 o
6 -4 1 2244.88 2325.82 90.20 o
7 -4 1 2941.21 3186.27 121.08 o
8 -4 1 1686.97 1798.94 81.43 o
9 -4 1 20.13 99.89 37.77 o
10 -4 1 364.28 295.61 77.69 o
-10 -3 1 135.39 69.17 64.34 o
-9 -3 1 431.04 462.73 52.86 o
-8 -3 1 4138.55 4353.89 167.17 o
-7 -3 1 3563.10 3769.85 144.21 o
-6 -3 1 8.62 34.20 22.49 o
-5 -3 1 5156.24 5605.47 194.34 o
-4 -3 1 10036.80 10779.34 354.87 o
-3 -3 1 2503.84 2488.03 90.89 o
-2 -3 1 24.26 26.01 8.55 o
-1 -3 1 4769.89 4418.56 130.93 o
0 -3 1 14145.02 13093.17 378.90 o
1 -3 1 11918.03 10579.03 515.75 o
2 -3 1 182.59 211.73 15.41 o
3 -3 1 6877.44 6879.07 200.17 o
4 -3 1 15028.92 15078.34 434.65 o
5 -3 1 2469.52 2512.92 79.15 o
6 -3 1 320.96 395.17 35.23 o
7 -3 1 2667.90 2816.05 109.21 o
8 -3 1 2730.59 2914.42 116.75 o
9 -3 1 401.21 426.31 47.33 o
10 -3 1 18.58 8.19 53.61 o
-10 -2 1 763.04 782.10 91.20 o
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-8 -2 1 905.98 971.77 60.98 o
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-6 -2 1 1751.23 1771.10 76.26 o
-5 -2 1 1909.67 1954.81 78.25 o
-4 -2 1 11707.13 12119.58 397.09 o
-3 -2 1 15618.32 16575.92 535.14 o
-2 -2 1 2316.75 2391.87 84.11 o
-1 -2 1 550.61 525.21 20.40 o
0 -2 1 5532.77 5020.93 147.10 o
1 -2 1 17027.53 14892.52 554.46 o
2 -2 1 4792.95 4697.84 137.06 o
3 -2 1 2231.54 2319.68 70.60 o
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6 -2 1 209.62 259.75 31.42 o
7 -2 1 1448.40 1446.18 65.43 o
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9 -2 1 1603.34 1607.13 91.95 o
10 -2 1 94.91 74.76 44.22 o
11 -2 1 157.60 91.43 55.21 o
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-8 -1 1 1564.90 1467.17 73.32 o
-7 -1 1 5603.45 5942.23 208.41 o
-6 -1 1 4952.90 5245.82 182.30 o
-5 -1 1 128.89 111.93 17.44 o
-4 -1 1 5373.74 5647.12 188.77 o
-3 -1 1 12221.14 12684.88 410.25 o
-2 -1 1 4940.20 4810.37 158.62 o
-1 -1 1 50.95 53.26 7.14 o
0 -1 1 3732.53 3382.28 116.87 o
1 -1 1 16478.75 15395.28 493.80 o
2 -1 1 16385.39 16836.02 481.76 o
3 -1 1 318.80 344.77 15.39 o
4 -1 1 7856.05 8630.73 251.75 o
5 -1 1 17604.48 19035.54 551.02 o
6 -1 1 2781.46 2948.07 94.53 o
7 -1 1 147.79 157.11 19.88 o
8 -1 1 2311.51 2420.14 117.11 o
9 -1 1 1807.07 1677.36 95.48 o
10 -1 1 1182.41 1101.07 82.35 o
11 -1 1 1.67 55.97 58.63 o
-10 0 1 1386.97 1254.78 98.08 o
-9 0 1 1101.63 1121.18 114.40 o
-8 0 1 18.17 30.87 33.52 o
-7 0 1 4620.79 4909.26 173.88 o
-6 0 1 8786.84 9296.73 308.89 o
-5 0 1 3454.94 3629.96 111.77 o
-4 0 1 1245.14 1313.32 44.35 o
-3 0 1 10990.71 11522.83 332.88 o
-2 0 1 10627.10 10868.19 313.72 o
-1 0 1 3083.38 3190.36 110.48 o
0 0 1 5433.92 4412.39 239.81 o
1 0 1 17930.37 16984.77 570.79 o
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