File name: Pandora30s1_Juelich_20201005_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T154808.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 30 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora30_OF_v4d20190910.txt Instrument calibration file used: Pandora30s1_CF_v3d20191023.txt Level 1 file used: Pandora30s1_Juelich_20201005_L1_smca1c3d20191023p1-8.txt Full location name: Juelich JULEY Short location name: Juelich Country of location: Germany Location latitude [deg]: 50.9080 Location longitude [deg]: 6.4130 Location altitude [m]: 94 Local noon date: 20201005 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: 219 360 Nominal wavelengths inside fitting window [nm]: 305.0309 305.1726 305.3142 305.4558 305.5975 305.7391 305.8807 306.0223 306.1639 306.3054 306.4470 306.5885 306.7301 306.8716 307.0131 307.1546 307.2961 307.4376 307.5790 307.7205 307.8619 308.0034 308.1448 308.2862 308.4276 308.5690 308.7104 308.8518 308.9931 309.1345 309.2758 309.4171 309.5585 309.6998 309.8411 309.9823 310.1236 310.2649 310.4061 310.5474 310.6886 310.8298 310.9710 311.1122 311.2534 311.3945 311.5357 311.6769 311.8180 311.9591 312.1002 312.2413 312.3824 312.5235 312.6646 312.8057 312.9467 313.0877 313.2288 313.3698 313.5108 313.6518 313.7928 313.9337 314.0747 314.2156 314.3566 314.4975 314.6384 314.7793 314.9202 315.0611 315.2020 315.3428 315.4837 315.6245 315.7653 315.9062 316.0470 316.1877 316.3285 316.4693 316.6101 316.7508 316.8915 317.0323 317.1730 317.3137 317.4544 317.5950 317.7357 317.8764 318.0170 318.1576 318.2983 318.4389 318.5795 318.7201 318.8606 319.0012 319.1418 319.2823 319.4228 319.5634 319.7039 319.8444 319.9849 320.1253 320.2658 320.4062 320.5467 320.6871 320.8275 320.9679 321.1083 321.2487 321.3891 321.5295 321.6698 321.8101 321.9505 322.0908 322.2311 322.3714 322.5117 322.6519 322.7922 322.9324 323.0727 323.2129 323.3531 323.4933 323.6335 323.7737 323.9138 324.0540 324.1941 324.3343 324.4744 324.6145 324.7546 324.8947 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20201005T105414.0Z 7583.454329 396 1 40.06 2 56.25 171.48 103.46 315.49 0.00 1 0.00 1 0 25 5.624e-02 2.214e-02 1.010e-02 3.431e-03 2.754317e-01 1.722389e-03 3.635685e-03 -6.000000e+00 3.194838e-02 225.81 -2.00 3.80 -2.00 317.07 0.00e+00 1.357614e-03 2.304403e-04 3.494092e-04 -6.000000e+00 1.384405e-03 277.75 -2.00 20.00 -2.00 316.46 0.00e+00 1.794 0.000 302.00 328.00 3 6.1240e+00 4.4936e-03 2.3357e-02 -6.0000e+00 7.9195e-02 1.1079e-01 5.0433e-03 1.5093e-02 -6.0000e+00 8.5978e-02 -2.4788e-02 3.0416e-03 7.5408e-03 -6.0000e+00 5.1142e-02 8.7960e-03 1.5074e-03 2.2366e-03 -6.0000e+00 2.1979e-02 1.3290e-04 -1.6066e-03 9.6074e-05 2.3596e-05 -6.0000e+00 1.4831e-03 -7.7180e-03 0.0000e+00 12 9 9 12 41 1 100.00 21.57 -0.43 -0.00772 -0.01979 22 7 1 5 0 1734.310 26.73 20.00 21.57 21.27 33.7 988.16 15293 -3287 -9350 17068 11781 -963 -24632 -7733 20086 -14256 -16152 -9508 15044 -392 -8283 -833 -4999 3842 17455 -7165 4810 7029 8211 -8381 4780 2713 -6944 3340 -12456 11801 3657 3767 2533 1205 -5813 -42 -3861 1075 4043 -1734 5336 -646 196 1153 -3032 720 -1256 5208 -3577 52 6105 -4060 -1395 2858 1096 319 1529 309 -5004 1916 3438 1207 183 2075 -381 508 -1382 -4600 -1569 -321 1787 2044 -264 -802 -1226 2969 -2574 1469 2398 -5264 655 -739 -2584 -275 0 -268 2436 1666 1796 -693 2231 1604 -606 194 -370 -433 519 1869 931 37 -10257 1725 -1693 -1457 -3162 -2419 -1286 -1618 806 1203 1240 1443 -29 1219 1090 61 -1308 262 -146 679 2203 727 1663 1195 1815 262 -1624 -465 -1875 326 -137 1826 -17 737 -1012 -303 579 732 569 308 -1641 -2052 1551 -454 -1435 1941 1253 -106 -3504 -1031 2277 -2430 -2790 -1533 2095 -74 -1858 -194 -1284 935 3863 -2097 1280 1807 2089 -2631 1390 838 -2368 974 -3956 3004 1008 1134 841 423 -2059 -13 -1363 420 1754 -934 2946 -379 117 691 -1889 432 -756 3001 -2102 31 3590 -2714 -961 1984 797 238 1145 233 -3710 1372 2494 922 154 1829 -344 418 -1116 -3733 -1266 -291 1656 1963 -258 -753 -1116 2419 -2000 1048 1794 -4613 609 -735 -2778 -302 0 -324 3013 2047 2277 -861 2579 1691 -625 195 -386 -501 635 2396 1261 50 -13945 2056 -2004 -1739 -4157 -3187 -1750 -2305 1187 1814 1955 2266 -44 1745 1490 80 -1766 354 -213 1031 3315 1083 2373 1697 2433 338 -2045 -598 -2642 462 -203 2694 -27 1138 -1687 -501 971 1244 960 520 -2710 -3271 SS 20201005T130936.4Z 7583.548338 486 1 4.88 2 60.48 211.01 113.03 347.08 0.00 1 0.00 1 0 17 1.532e-02 7.022e-03 8.071e-03 2.986e-03 2.795240e-01 1.504928e-03 3.684118e-03 -6.000000e+00 8.696464e-03 225.80 -2.00 3.80 -2.00 316.83 0.00e+00 2.908872e-04 1.903675e-04 6.389832e-05 -6.000000e+00 3.770195e-04 277.73 -2.00 20.00 -2.00 316.21 0.00e+00 2.021 0.000 302.00 328.00 3 3.8354e+00 3.9229e-03 2.5257e-02 -6.0000e+00 2.1556e-02 6.1811e-03 4.3927e-03 1.5445e-02 -6.0000e+00 2.3409e-02 1.4755e-02 2.6202e-03 7.6624e-03 -6.0000e+00 1.3924e-02 -8.9147e-03 1.2864e-03 2.1855e-03 -6.0000e+00 5.9792e-03 1.0999e-03 -7.9371e-04 8.3464e-05 2.4724e-05 -6.0000e+00 4.0413e-04 -2.6519e-03 0.0000e+00 12 9 1 12 1 1 56.72 21.56 0.00 -0.00265 -0.00862 6 17 1 5 0 671.840 26.73 19.99 21.56 21.92 34.1 988.95 936 1226 -5628 3089 -3958 -7259 -5617 -797 1599 -2678 -5013 -2427 3553 -1715 -846 144 -1436 208 3041 913 227 493 1850 -1185 1852 1462 -1390 1304 -1620 939 2269 1484 1883 -456 -3124 -1682 -2291 -149 975 -612 -509 -1003 -188 125 -247 554 -175 44 -2025 231 999 -490 359 1182 933 1043 483 -288 -686 660 1412 1696 1812 1390 -260 -875 -262 -1058 496 393 531 232 203 -82 -20 321 -1294 -659 -196 -2527 -1019 -1042 -2179 -1141 -568 -36 473 476 615 340 495 -355 -8 362 0 18 533 724 -4 -280 1315 -1102 -177 -551 -1116 -928 -517 -434 383 1016 471 664 198 -276 -245 -379 -216 -434 -187 227 81 308 346 682 227 -130 -276 455 254 224 -23 -53 -179 459 -175 -4 399 153 182 42 -497 -1003 111 163 -840 407 -524 -921 -727 -111 234 -438 -838 -399 613 -345 -195 37 -376 56 828 264 68 146 547 -383 619 490 -481 435 -518 286 722 522 689 -178 -1175 -602 -891 -64 480 -346 -304 -632 -117 78 -155 358 -112 28 -1268 142 648 -336 250 861 704 777 369 -220 -515 503 1066 1380 1556 1239 -234 -753 -214 -859 416 364 518 228 199 -79 -19 272 -1043 -527 -162 -2270 -985 -1076 -2347 -1242 -642 -42 581 583 766 405 572 -387 -9 369 0 21 652 949 -5 -365 1638 -1321 -209 -675 -1414 -1232 -697 -597 542 1491 711 995 289 -393 -328 -500 -290 -602 -265 336 121 448 499 956 305 -171 -358 595 352 322 -34 -79 -269 707 -281 -6 662 258 305 69 -810 -1584 SS 20201005T131500.1Z 7583.552084 489 1 14.14 2 60.93 212.46 113.19 348.43 0.00 1 0.00 1 0 17 1.170e-02 6.030e-03 3.094e-03 1.067e-03 2.853279e-01 5.372449e-04 3.744192e-03 -6.000000e+00 6.641822e-03 225.80 -2.00 3.80 -2.00 317.01 0.00e+00 5.752949e-04 7.129243e-05 9.664436e-05 -6.000000e+00 2.878515e-04 277.73 -2.00 20.00 -2.00 316.40 0.00e+00 2.049 0.000 302.00 328.00 3 2.9237e+00 1.4038e-03 2.5660e-02 -6.0000e+00 1.6463e-02 1.4406e-02 1.5746e-03 1.5733e-02 -6.0000e+00 1.7876e-02 7.8199e-03 9.4532e-04 7.8123e-03 -6.0000e+00 1.0633e-02 -6.0699e-03 4.6838e-04 2.2578e-03 -6.0000e+00 4.5682e-03 2.6314e-03 -4.1760e-04 2.9875e-05 2.4709e-05 -6.0000e+00 3.0843e-04 -5.8978e-03 0.0000e+00 12 1 1 12 9 1 99.98 21.56 0.18 -0.00590 -0.00904 74 62 1 5 0 185.930 26.73 19.99 21.56 22.24 33.9 988.90 2173 -2073 -804 -1866 -5169 -3639 -5744 147 952 -1268 -3944 -1763 -492 -464 540 -406 -421 304 1236 991 1314 29 1094 655 733 1321 -356 -87 -1642 312 945 1260 2131 -653 -2071 -2189 -1832 -788 -6 -488 -674 -430 -590 -287 -321 145 -493 -596 -1248 -717 1026 429 924 1029 810 1240 673 165 -467 376 950 1513 1575 1756 153 -258 -533 -993 743 416 605 306 159 452 -312 -315 -977 -1012 -551 -1169 -936 -1232 -1889 -1379 -685 -389 478 415 676 475 488 -54 -159 191 -196 -36 698 619 137 -245 -272 -1034 -267 -461 -1108 -844 -588 -410 195 795 689 519 447 -73 -65 -199 -148 -172 80 -142 108 257 570 468 517 -81 119 437 100 104 -132 -195 -83 37 9 -144 524 227 58 -77 -480 -822 239 -270 -108 -244 -621 -399 -667 18 132 -192 -612 -270 -83 -84 112 -95 -105 78 329 274 373 8 312 198 218 409 -112 -28 -502 92 292 394 723 -237 -717 -731 -659 -329 -3 -268 -380 -254 -361 -177 -198 89 -299 -355 -735 -424 632 287 612 718 584 912 507 125 -346 274 712 1220 1305 1551 137 -213 -434 -800 600 384 574 302 156 422 -287 -259 -779 -780 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