File name: Pandora272s1_Lauder_20260207_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T070424.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260207_L1_smca1c6d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260207 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20260206T191348.2Z 9533.801253 499 1 54.09 2 75.94 97.89 49.71 302.98 0.00 1 0.00 1 0 17 1.943e-01 1.642e-02 3.438e-02 2.502e-03 4.640543e-01 1.294746e-03 5.702551e-03 -6.000000e+00 1.135713e-01 231.18 -2.00 3.69 -2.00 319.48 0.00e+00 1.663343e-04 3.512306e-04 1.152921e-03 -6.000000e+00 4.868978e-03 279.43 -2.00 20.00 -2.00 318.85 0.00e+00 4.024 0.001 302.00 328.00 3 4.0301e+00 3.6575e-03 4.6360e-02 -6.0000e+00 2.8485e-01 1.9285e-02 4.2887e-03 2.6400e-02 -6.0000e+00 3.0785e-01 -5.7279e-02 3.3741e-03 1.2953e-02 -6.0000e+00 1.8249e-01 3.1225e-02 1.7559e-03 3.6186e-03 -6.0000e+00 7.7451e-02 1.2229e-04 6.8239e-04 7.1875e-05 4.2006e-05 -6.0000e+00 5.3446e-03 4.7889e-03 0.0000e+00 12 9 8 11 32 0 38.47 25.36 0.43 0.00479 0.00992 29 3 2 8 0 1864.990 19.99 25.36 20.19 35.00 33.75 0.9 963.81 -33466 -87039 -1559 17833 16557 -41284 -42182 -109612 -52135 -95984 -68353 -47959 5495 2829 -21038 15535 -39236 8586 -25259 -258 -15912 22922 -24374 9262 2360 19190 -9954 6913 -2438 -5163 -17553 24147 -338 13777 1155 21812 -1059 -9254 5829 12730 -2056 16857 -2188 989 3441 11065 4138 4122 1206 5569 6242 4333 577 -343 1341 1776 1416 -1535 -1979 4903 7803 4119 874 2400 -920 -914 5726 -2928 3010 15 2312 1441 -727 1457 -306 -812 1107 -1301 -2443 -1490 -2820 -619 -2848 -3848 -3258 -764 -685 -403 940 -851 1278 -1349 -488 -46 -1253 -1096 -930 1545 -492 1262 -254 -1328 -3260 -54 871 -738 -650 -18 -816 2 865 1198 -135 915 973 -133 -674 936 -493 1301 -265 -120 1028 741 812 915 -658 695 121 1135 412 -87 110 -392 -300 -215 -464 865 -71 -47 -350 -702 -894 -718 -3631 -29 265 226 -987 -1101 -6338 -1921 -5948 -3302 -2036 162 104 -1170 694 -3312 484 -2132 -18 -1320 1292 -2301 678 198 1437 -1020 573 -211 -471 -2034 2085 -42 1586 144 2182 -147 -1623 1068 2615 -501 3981 -594 266 907 2734 1099 1100 336 1542 1862 1449 216 -140 570 778 642 -720 -913 2081 3298 1949 474 1297 -534 -508 3122 -1598 1647 10 1620 1076 -559 1053 -210 -504 614 -716 -1442 -1000 -2211 -496 -2559 -3693 -3089 -760 -719 -437 1018 -915 1253 -1352 -455 -42 -1230 -1123 -1081 1856 -659 1675 -326 -1591 -3912 -62 1068 -915 -844 -24 -1130 3 1395 1908 -218 1484 1476 -191 -962 1360 -772 2126 -424 -200 1649 1152 1200 1380 -967 1003 178 1815 675 -152 200 -701 -570 -433 -916 1723 -146 -94 -703 -1352 -1662 SS 20260206T192242.1Z 9533.807431 504 1 6.36 2 74.38 96.36 50.99 300.74 0.00 1 0.00 1 0 17 1.729e-01 2.084e-02 1.102e-01 1.070e-02 4.272909e-01 5.544624e-03 5.238603e-03 -6.000000e+00 1.011723e-01 231.18 -2.00 3.69 -2.00 319.12 0.00e+00 -2.975023e-04 1.315749e-03 8.655863e-04 -6.000000e+00 4.407468e-03 279.43 -2.00 20.00 -2.00 318.48 0.00e+00 3.647 0.001 302.00 328.00 3 4.4862e+00 1.5331e-02 4.2090e-02 -6.0000e+00 2.5362e-01 4.3594e-02 1.7641e-02 2.3886e-02 -6.0000e+00 2.7411e-01 -1.0044e-01 1.2852e-02 1.1649e-02 -6.0000e+00 1.6241e-01 5.6656e-02 6.7202e-03 3.2466e-03 -6.0000e+00 6.8990e-02 1.1371e-04 1.0422e-03 3.1001e-04 3.4971e-05 -6.0000e+00 4.8136e-03 3.9654e-03 0.0000e+00 12 9 9 12 1 1 999.00 25.36 0.02 0.00397 0.01180 1 2 1 8 0 3176.590 20.00 25.36 20.60 35.25 34.00 0.9 966.04 79524 -39015 3683 9151 900000 -48369 -10732 -87556 -29075 -83353 -28308 -35121 -16229 10197 -15863 17049 -22956 24837 -25493 5542 -4722 33589 -13145 -13841 -7624 10855 -19287 44314 29256 -7705 -4803 11608 2704 8390 -14136 53101 536 -12318 8989 21383 -3844 7540 -888 3702 7896 5788 -10 2183 -6206 7148 4321 8318 5193 2401 3984 -1508 1611 -1308 -2323 7608 7391 5138 3578 1245 -1666 -1133 6206 -5609 1591 1862 570 -42 -1971 2269 1854 -308 3244 -3050 -4827 -660 -4417 -3795 -571 -2738 -2931 -1035 -1463 785 2331 -1333 202 -1340 -1665 -1442 -1155 304 -602 1488 -890 943 1506 -2285 -4654 1456 732 -44 -2101 39 -1162 551 831 -798 75 632 1435 587 570 320 -338 2183 -202 -144 1543 -792 1632 1832 -57 1859 830 133 533 -750 1580 -821 167 -268 -512 -246 -128 -325 -145 -180 -1538 996 -1791 115 258 900000 -2119 -347 -6851 -1426 -6878 -1506 -2125 -948 543 -1291 1138 -2467 1762 -3165 526 -507 2453 -1591 -1819 -1002 1246 -3038 3514 2533 -981 -656 1502 426 1322 -2655 4986 93 -2582 1842 4624 -1196 2217 -296 1197 2449 1845 -3 716 -2231 2312 1549 3132 2167 1107 1904 -720 766 -643 -1127 3593 3582 2510 1960 765 -1088 -701 3399 -3443 963 1277 407 -32 -1533 1628 1346 -206 1906 -1838 -3118 -467 -3435 -3308 -527 -2528 -2901 -1082 -1619 880 2608 -1505 209 -1301 -1632 -1374 -1164 314 -710 1816 -1211 1267 1912 -2788 -5729 1673 853 -55 -2815 54 -1632 823 1264 -1291 119 1015 2135 825 789 459 -518 3479 -317 -237 2436 -1236 2359 2700 -82 2600 1183 209 844 -1273 2708 -1493 302 -515 -1018 -498 -249 -653 -277 -329 -2749 SS 20260206T192743.7Z 9533.810922 507 1 17.31 2 73.50 95.50 51.73 299.51 0.00 1 0.00 1 0 17 4.251e-02 7.486e-03 5.849e-03 1.083e-03 4.137102e-01 5.583739e-04 5.118684e-03 -6.000000e+00 2.484766e-02 231.18 -2.00 3.69 -2.00 318.10 0.00e+00 9.553066e-04 9.893121e-05 3.613463e-04 -6.000000e+00 1.065220e-03 279.43 -2.00 20.00 -2.00 317.43 0.00e+00 3.464 0.000 302.00 328.00 3 2.0695e+00 1.5030e-03 4.0137e-02 -6.0000e+00 6.2321e-02 2.6259e-02 1.6904e-03 2.2709e-02 -6.0000e+00 6.7352e-02 -2.7113e-02 1.1021e-03 1.1099e-02 -6.0000e+00 3.9927e-02 1.0184e-02 5.7165e-04 3.1874e-03 -6.0000e+00 1.6946e-02 1.5117e-03 5.9849e-05 3.0512e-05 3.3461e-05 -6.0000e+00 1.1693e-03 4.4953e-03 0.0000e+00 12 9 1 12 1 1 62.04 25.36 0.32 0.00450 0.00495 71 23 1 8 0 240.270 20.00 25.36 20.91 35.25 33.75 1.0 968.24 -16359 -10319 -10041 -8193 -525 -18692 -15843 -18881 -9363 -16437 -14857 -12492 -7547 -2727 -3162 -1654 -3017 702 -355 1776 644 746 -664 843 -872 1393 -579 -258 -1720 -2348 -1583 2243 871 1138 -3899 -441 -3852 -2374 -539 939 -419 660 14 1085 427 1571 1184 585 -1348 805 1257 1411 1033 1613 1366 1050 1191 436 -9 739 1183 1194 1727 2173 1209 332 197 -1249 102 520 796 633 223 567 124 -200 -943 -1644 -1452 -1247 -1321 -1122 -2065 -2542 -1450 -588 -183 91 542 484 299 190 -516 -548 -284 -127 171 963 486 142 -168 -1006 -1771 -659 -560 -888 -595 -356 -227 397 625 520 379 370 37 -27 -22 180 361 514 212 448 567 525 605 653 64 342 509 166 292 -3 -253 -193 -16 -115 -135 326 189 -103 -343 -432 -948 -893 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