File name: Pandora272s1_Lauder_20260405_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260405T125311.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 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_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260405_L1_smca1c2d20241202p1-8.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: 20260405 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: OoB based on session 1 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1840 305.3244 305.4648 305.6052 305.7456 305.8860 306.0263 306.1667 306.3070 306.4473 306.5877 306.7280 306.8683 307.0086 307.1488 307.2891 307.4293 307.5696 307.7098 307.8500 307.9902 308.1304 308.2706 308.4108 308.5510 308.6911 308.8313 308.9714 309.1115 309.2516 309.3917 309.5318 309.6719 309.8119 309.9520 310.0920 310.2321 310.3721 310.5121 310.6521 310.7921 310.9320 311.0720 311.2120 311.3519 311.4918 311.6317 311.7717 311.9115 312.0514 312.1913 312.3312 312.4710 312.6109 312.7507 312.8905 313.0303 313.1701 313.3099 313.4496 313.5894 313.7292 313.8689 314.0086 314.1483 314.2880 314.4277 314.5674 314.7071 314.8467 314.9864 315.1260 315.2656 315.4052 315.5448 315.6844 315.8240 315.9636 316.1031 316.2427 316.3822 316.5217 316.6612 316.8007 316.9402 317.0797 317.2192 317.3586 317.4981 317.6375 317.7769 317.9163 318.0557 318.1951 318.3345 318.4738 318.6132 318.7525 318.8918 319.0312 319.1705 319.3097 319.4490 319.5883 319.7276 319.8668 320.0060 320.1453 320.2845 320.4237 320.5629 320.7020 320.8412 320.9804 321.1195 321.2586 321.3977 321.5368 321.6759 321.8150 321.9541 322.0932 322.2322 322.3713 322.5103 322.6493 322.7883 322.9273 323.0663 323.2052 323.3442 323.4831 323.6221 323.7610 323.8999 324.0388 324.1777 324.3166 324.4554 324.5943 324.7331 324.8719 --------------------------------------------------------------------------------------- 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 20260404T222004.6Z 9590.930608 580 1 14.91 2 60.34 42.30 91.54 237.77 0.00 1 0.00 1 0 17 1.891e-02 9.344e-03 6.349e-03 2.977e-03 2.398142e-01 1.509713e-03 3.032555e-03 -6.000000e+00 1.083492e-02 225.99 -2.00 3.69 -2.00 316.27 0.00e+00 4.098549e-04 1.678855e-04 8.840436e-05 -6.000000e+00 4.710352e-04 278.00 -2.00 20.00 -2.00 315.66 0.00e+00 2.012 0.000 302.00 328.00 3 4.9264e+00 3.9067e-03 2.3004e-02 -6.0000e+00 2.6854e-02 3.2358e-02 4.3656e-03 1.2766e-02 -6.0000e+00 2.9144e-02 -1.1152e-02 2.5456e-03 6.3041e-03 -6.0000e+00 1.7334e-02 2.4969e-03 1.2021e-03 1.8078e-03 -6.0000e+00 7.4276e-03 4.2779e-04 3.5483e-04 8.5447e-05 2.1451e-05 -6.0000e+00 5.1949e-04 2.2519e-02 1.0973e-04 12 9 9 12 9 1 97.80 25.32 0.09 0.02252 0.02519 5 2 1 8 0 2484.870 20.00 25.32 16.76 35.25 33.75 1.0 949.59 -314 -583 399 500 6991 -4101 -2672 -6133 4 -5416 -10636 -3357 1230 -1710 666 1035 -1805 1487 -1688 2846 -2140 2754 -71 1092 2005 1303 1178 -715 990 652 -550 3061 2018 2583 -6574 209 -2816 -3628 696 988 -1441 1617 -839 611 523 37 24 -600 -2748 -242 1562 1182 1359 71 918 429 1216 83 -789 906 2195 1621 2194 1743 303 -876 261 -2156 217 501 1491 285 -297 860 85 -682 -703 -1357 -1988 -1156 -1647 -1032 -1791 -2646 -1237 -156 -33 161 637 279 167 -187 -462 -294 -534 -476 170 1375 1015 1027 -193 -823 -2147 -312 28 -596 -490 -65 -538 -56 551 332 113 658 631 -39 -704 332 -59 656 -170 307 839 634 672 759 86 224 428 -356 562 -108 -199 -239 -354 -57 -117 257 129 -146 248 -527 -996 -56 -113 78 91 1157 -662 -450 -1182 1 -1208 -2467 -739 288 -468 202 314 -587 483 -588 977 -784 951 -26 413 783 531 482 -281 352 229 -205 1175 843 1110 -2901 84 -1265 -1742 381 588 -966 1096 -601 436 372 26 17 -411 -1875 -161 1065 864 975 54 722 344 986 68 -639 716 1755 1390 1899 1619 287 -779 226 -1850 189 456 1399 285 -301 835 83 -605 -599 -1089 -1635 -982 -1580 -1025 -1930 -2840 -1396 -187 -40 200 799 341 201 -206 -494 -297 -556 -511 201 1696 1350 1362 -246 -981 -2547 -365 33 -764 -655 -86 -752 -78 813 503 168 954 840 -51 -904 435 -79 932 -241 453 1211 886 887 1002 109 277 554 -495 776 -157 -294 -343 -537 -87 -185 415 212 -237 387 -841 -1549 SS 20260404T222947.0Z 9590.937349 582 1 53.15 2 59.22 39.83 92.91 236.07 0.00 1 0.00 1 0 17 4.368e-02 1.682e-02 7.333e-03 3.038e-03 2.372943e-01 1.540402e-03 2.941166e-03 -6.000000e+00 2.502382e-02 225.99 -2.00 3.69 -2.00 316.68 0.00e+00 7.558420e-04 1.867352e-04 9.294706e-05 -6.000000e+00 1.088384e-03 278.00 -2.00 20.00 -2.00 316.06 0.00e+00 1.946 0.000 302.00 328.00 3 6.1317e+00 4.0030e-03 2.2359e-02 -6.0000e+00 6.2018e-02 7.2293e-02 4.4822e-03 1.2550e-02 -6.0000e+00 6.7316e-02 -2.8703e-02 2.6354e-03 6.1810e-03 -6.0000e+00 4.0038e-02 1.5146e-02 1.2642e-03 1.8900e-03 -6.0000e+00 1.7150e-02 1.3465e-04 3.2702e-04 8.8112e-05 2.0621e-05 -6.0000e+00 1.2004e-03 2.2190e-02 -1.5972e-05 12 9 8 11 8 0 99.90 25.31 0.00 0.02219 0.02465 17 2 1 8 0 3126.060 19.99 25.31 17.19 35.25 33.75 1.0 951.51 5586 152 3660 272 24966 -5489 -140 -14060 1727 -16642 -19575 -6522 1439 -2298 1964 2582 -10417 3913 -4516 4503 406 2769 -4035 4858 1781 5192 1382 1494 3050 2717 -4129 3843 1512 10166 -13400 4558 -1128 -5070 2222 3223 -3557 6564 -1452 436 1170 904 1077 618 -6178 728 2571 1345 1929 -387 988 95 359 -1216 -2878 3706 4943 1892 1198 1628 -2442 -3059 3749 -4970 2214 27 1631 132 -553 2230 -702 -604 -1096 -3106 -2424 -1141 -2446 -872 -2553 -3128 -1419 505 -2 143 1679 -599 975 -1065 -649 -479 -448 -674 -769 1630 494 3064 526 -640 -2849 886 508 -354 13 1043 -555 -299 599 -620 -159 1125 1607 -155 -1861 322 -923 725 -116 129 1040 134 1465 952 -1229 -158 -108 -1165 1631 -79 201 -362 -417 192 -264 151 -102 248 105 -307 -952 842 26 617 44 2781 -797 -20 -2582 298 -3614 -4303 -1285 292 -548 507 725 -3142 1160 -1371 1414 134 883 -1406 1625 638 1855 513 519 963 847 -1451 1326 574 3644 -5161 1570 -448 -2183 1057 1777 -2294 3983 -983 293 774 598 696 389 -4066 445 1616 912 1367 -271 705 69 265 -911 -2147 2798 3784 1460 1007 1452 -2274 -2652 2807 -3921 1686 24 1547 133 -566 2150 -652 -506 -905 -2451 -1938 -917 -2235 -867 -2775 -3296 -1567 589 -3 183 2139 -758 1125 -1146 -688 -479 -462 -763 -891 2048 673 4046 674 -772 -3273 984 615 -460 18 1463 -768 -437 916 -981 -243 1594 2238 -203 -2428 424 -1309 1010 -169 187 1464 197 2011 1250 -1566 -195 -140 -1623 2328 -120 285 -528 -643 310 -443 259 -178 423 174 -491 -1486 SS 20260404T235102.7Z 9590.993781 644 1 54.15 2 52.40 16.75 103.11 220.80 0.00 1 0.00 1 0 17 9.054e-03 7.176e-03 1.018e-03 6.813e-04 1.946738e-01 3.481087e-04 2.494148e-03 -6.000000e+00 5.188285e-03 225.98 -2.00 3.69 -2.00 315.06 0.00e+00 3.676522e-04 3.001093e-05 3.440368e-05 -6.000000e+00 2.255486e-04 277.99 -2.00 20.00 -2.00 314.55 0.00e+00 1.635 0.000 302.00 328.00 3 3.9939e+00 8.8978e-04 1.8696e-02 -6.0000e+00 1.2859e-02 3.5680e-02 9.8909e-04 1.0379e-02 -6.0000e+00 1.3955e-02 -3.1730e-03 5.6676e-04 5.1162e-03 -6.0000e+00 8.3002e-03 -1.5908e-03 2.5391e-04 1.4602e-03 -6.0000e+00 3.5569e-03 1.6701e-03 1.9727e-04 1.9304e-05 1.8861e-05 -6.0000e+00 2.4875e-04 2.1633e-02 9.1092e-05 11 8 0 10 0 0 99.96 25.31 0.35 0.02163 0.02312 118 12 1 8 0 458.860 19.99 25.31 20.25 35.25 33.75 0.9 964.79 -270 154 -576 -1942 -624 -1732 -623 -524 716 -1298 -2735 -1513 -821 -246 762 441 -206 656 313 1392 869 576 1127 796 680 1286 551 -534 -124 430 612 1654 1387 533 -3341 -1984 -2568 -1773 -111 120 -819 -157 -627 342 -343 -201 -273 -620 -1257 -434 590 593 916 930 867 768 837 137 95 376 968 1231 1605 1622 547 -331 -192 -1055 92 580 499 599 403 719 165 -146 -678 -1296 -1011 -1114 -1363 -964 -1811 -2672 -1162 -597 -223 348 752 464 474 119 -397 -455 -29 -3 445 948 669 490 -18 -868 -1611 -583 -389 -743 -579 -321 -205 211 495 570 418 378 -29 -208 -215 -45 223 541 83 355 595 420 620 542 39 282 367 55 414 37 -129 -167 -11 4 -143 326 121 -94 -259 -538 -943 -84 51 -197 -623 -188 -505 -189 -161 240 -466 -976 -538 -295 -99 338 199 -96 312 154 698 444 292 577 401 356 691 299 -274 -62 208 307 863 726 289 -1761 -1065 -1410 -1040 -72 86 -646 -122 -502 273 -274 -160 -212 -491 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