File name: Pandora272s1_Lauder_20251127_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T063930.7Z 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_20251127_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: 20251127 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 20251126T213214.2Z 9461.897387 800 1 8.61 2 43.29 71.35 99.65 125.66 0.00 1 0.00 1 0 17 9.160e-03 7.571e-03 2.608e-03 1.815e-03 1.882109e-01 9.490806e-04 2.403923e-03 -6.000000e+00 5.349314e-03 230.86 -2.00 3.69 -2.00 314.87 0.00e+00 4.389420e-04 7.652283e-05 3.175013e-05 -6.000000e+00 2.269376e-04 276.69 -2.00 20.00 -2.00 314.37 0.00e+00 1.372 0.000 302.00 328.00 3 4.5912e+00 2.4466e-03 1.6686e-02 -6.0000e+00 1.3419e-02 1.8286e-02 2.7012e-03 1.0256e-02 -6.0000e+00 1.4509e-02 -4.6831e-03 1.5463e-03 5.0035e-03 -6.0000e+00 8.5899e-03 -1.4226e-03 6.8143e-04 1.4077e-03 -6.0000e+00 3.6418e-03 1.1906e-03 1.2221e-04 5.1355e-05 1.8499e-05 -6.0000e+00 2.5181e-04 9.0223e-05 0.0000e+00 12 9 1 12 1 1 99.84 25.44 0.29 0.00009 0.00101 9 7 1 8 0 860.800 20.00 25.44 20.69 35.25 34.00 1.0 968.68 -1068 316 164 -565 234 -2312 -981 -1602 338 -557 -1882 -1550 -527 -300 73 -24 -185 445 278 883 998 1097 1147 519 629 1535 322 362 -43 417 862 1320 1248 1105 -2367 -2093 -2975 -2742 -496 10 -1202 -181 -677 455 -248 -133 -262 -172 -1291 -547 616 454 689 1265 796 625 1044 70 152 818 1022 1388 1254 1777 704 -263 188 -1190 -315 379 483 787 676 607 277 -383 -545 -1632 -1139 -1095 -1222 -745 -1635 -2600 -1383 -581 16 394 534 639 -21 58 -363 -376 -411 -288 639 1077 716 509 -78 -987 -1838 -511 -351 -957 -626 -298 -276 231 719 715 434 280 -20 -353 -157 73 -152 698 151 238 649 334 657 591 92 393 477 373 508 -44 -205 -277 218 171 -123 235 77 -208 -248 -549 -1150 -356 113 60 -194 76 -722 -315 -527 121 -212 -712 -583 -213 -126 32 -12 -92 225 145 443 509 552 583 278 349 870 186 197 -23 212 451 722 684 628 -1307 -1104 -1704 -1687 -334 8 -954 -148 -547 367 -200 -107 -215 -137 -1001 -414 476 373 565 1082 706 538 908 61 131 726 885 1271 1186 1777 687 -250 169 -1083 -277 354 480 823 717 628 282 -372 -496 -1389 -963 -1016 -1162 -747 -1779 -2866 -1543 -693 19 476 656 792 -26 66 -393 -395 -421 -319 742 1281 889 633 -96 -1186 -2079 -592 -423 -1197 -786 -390 -364 319 1005 1022 604 377 -25 -432 -193 89 -197 936 206 326 870 450 862 737 113 468 590 472 650 -58 -277 -371 305 245 -177 346 116 -311 -358 -799 -1636 SS 20251126T213304.8Z 9461.897973 802 1 7.89 2 43.15 71.15 99.54 125.50 0.00 1 0.00 1 0 17 1.394e-02 9.720e-03 5.971e-03 3.793e-03 1.885974e-01 1.977667e-03 2.375963e-03 -6.000000e+00 8.143779e-03 230.86 -2.00 3.69 -2.00 315.24 0.00e+00 4.762005e-04 1.722072e-04 2.505971e-05 -6.000000e+00 3.454599e-04 276.69 -2.00 20.00 -2.00 314.71 0.00e+00 1.369 0.000 302.00 328.00 3 5.6810e+00 5.1116e-03 1.6641e-02 -6.0000e+00 2.0429e-02 2.5247e-02 5.6516e-03 1.0214e-02 -6.0000e+00 2.2088e-02 -5.0908e-03 3.2412e-03 4.9773e-03 -6.0000e+00 1.3077e-02 -1.3189e-03 1.4512e-03 1.4130e-03 -6.0000e+00 5.5448e-03 4.0010e-04 2.0245e-04 1.0780e-04 1.7576e-05 -6.0000e+00 3.8330e-04 -6.9453e-04 0.0000e+00 12 9 9 12 33 1 99.79 25.44 0.12 -0.00069 0.00083 3 3 1 8 0 1971.340 20.00 25.44 20.80 35.00 33.75 1.0 969.06 -2967 2025 1410 -2907 -1146 -787 686 -3643 1280 -1180 -4154 -217 -3613 -2207 1238 1348 -313 3108 -287 1497 1288 1349 -829 489 2487 2809 467 352 -2410 -251 -21 2009 1908 -2039 -3738 -542 -4911 -2792 214 38 -1390 946 -501 601 -685 1275 606 489 -947 -522 438 1410 546 137 464 1139 1129 -157 -1781 1276 1197 1517 2208 2027 109 326 -1237 -1240 -380 486 180 1181 687 945 422 -1096 -546 -2047 -266 -1389 -2555 -132 -2173 -3016 -1709 -78 -350 536 766 -270 751 88 -178 -703 -634 -597 239 1538 880 1499 -350 -833 -1741 -448 672 -879 -230 114 -690 258 413 187 220 789 376 343 -1038 -95 1015 354 -343 86 838 307 151 596 244 -314 372 43 70 -67 304 -113 3 89 -400 384 218 181 -194 -690 -1006 -851 599 428 -863 -321 -207 185 -1031 381 -380 -1353 -68 -1270 -855 518 568 -139 1358 -134 704 617 639 -406 247 1276 1482 254 180 -1162 -114 -10 968 978 -1127 -1972 -265 -2701 -1591 140 27 -1045 723 -399 479 -550 998 467 364 -737 -398 341 1083 443 117 409 1008 955 -135 -1524 1114 1070 1348 2097 1937 107 312 -1098 -1115 -345 459 178 1227 726 972 411 -1039 -490 -1725 -220 -1274 -2493 -131 -2366 -3275 -1948 -95 -426 672 974 -339 913 98 -191 -707 -647 -658 273 1824 1131 1913 -433 -1016 -1999 -506 814 -1100 -298 147 -935 363 584 270 309 1081 497 418 -1308 -116 1300 469 -480 120 1144 407 199 741 305 -382 466 54 94 -93 403 -154 4 128 -600 585 340 278 -291 -1010 -1433 SS 20251126T213419.3Z 9461.898835 804 1 54.24 2 42.94 70.85 99.37 125.27 0.00 1 0.00 1 0 17 8.316e-03 7.020e-03 6.820e-04 4.848e-04 1.882379e-01 2.536556e-04 2.397460e-03 -6.000000e+00 4.856904e-03 230.86 -2.00 3.69 -2.00 314.76 0.00e+00 3.507973e-04 2.007211e-05 2.841841e-05 -6.000000e+00 2.060383e-04 276.69 -2.00 20.00 -2.00 314.27 0.00e+00 1.364 0.000 302.00 328.00 3 3.9258e+00 6.5304e-04 1.6618e-02 -6.0000e+00 1.2184e-02 2.1034e-02 7.2141e-04 1.0230e-02 -6.0000e+00 1.3173e-02 -5.1328e-03 4.1296e-04 4.9889e-03 -6.0000e+00 7.7990e-03 -1.2035e-03 1.8114e-04 1.3942e-03 -6.0000e+00 3.3067e-03 2.3308e-03 6.3842e-05 1.3704e-05 1.8564e-05 -6.0000e+00 2.2861e-04 -3.2345e-04 0.0000e+00 11 8 0 10 0 0 99.98 25.44 0.35 -0.00032 0.00016 164 17 1 8 0 330.720 19.99 25.44 20.88 35.25 33.75 1.0 969.41 -911 115 169 -1215 -657 -1465 -1017 -691 654 -508 -1445 -1247 -889 -744 343 494 45 699 441 1153 951 856 986 772 516 984 504 162 -203 338 871 1106 1383 392 -2477 -2006 -2712 -1891 -627 -286 -795 -459 -668 359 -485 -159 -305 -433 -992 -450 513 566 861 936 754 664 1053 389 249 372 721 1004 1346 1749 766 -214 -189 -1077 -159 581 603 718 511 668 310 -3 -668 -1355 -1109 -923 -1193 -1140 -1724 -2526 -1185 -603 -214 262 639 469 327 297 -264 -411 -125 73 480 954 732 322 -39 -837 -1595 -618 -371 -680 -579 -435 -356 251 664 620 434 235 -151 -204 -272 52 189 604 152 363 494 308 546 546 -31 334 477 262 372 47 -167 -298 44 113 -83 312 153 -161 -260 -540 -980 -316 43 64 -439 -222 -470 -339 -235 243 -201 -568 -488 -353 -329 158 248 22 349 228 607 510 454 529 434 286 560 290 93 -107 181 451 600 795 224 -1441 -1112 -1542 -1155 -426 -217 -639 -367 -550 296 -400 -130 -245 -350 -779 -346 403 452 718 818 655 585 937 349 219 325 641 907 1304 1727 768 -208 -175 -958 -143 555 615 745 539 685 312 -3 -596 -1170 -954 -834 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