File name: Pandora272s1_Lauder_20260328_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T071956.8Z 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_20260328_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: 20260328 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 20260327T222009.7Z 9582.930668 474 1 11.39 2 57.92 44.63 151.02 134.18 0.00 1 0.00 1 0 17 1.052e-02 7.505e-03 3.003e-03 1.883e-03 2.049960e-01 9.652430e-04 2.625407e-03 -6.000000e+00 6.048386e-03 226.81 -2.00 3.69 -2.00 315.32 0.00e+00 3.519329e-04 8.729921e-05 3.284940e-05 -6.000000e+00 2.625098e-04 278.41 -2.00 20.00 -2.00 314.76 0.00e+00 1.876 0.000 302.00 328.00 3 4.4023e+00 2.4747e-03 2.0948e-02 -6.0000e+00 1.5017e-02 3.2648e-02 2.7484e-03 1.1013e-02 -6.0000e+00 1.6287e-02 -4.5667e-03 1.5820e-03 5.4120e-03 -6.0000e+00 9.6833e-03 -2.2003e-04 7.1694e-04 1.5425e-03 -6.0000e+00 4.1422e-03 8.7296e-04 1.4575e-04 5.3493e-05 2.0018e-05 -6.0000e+00 2.8909e-04 7.3632e-03 0.0000e+00 12 9 1 12 1 1 98.59 25.49 0.27 0.00736 0.00846 9 5 1 8 0 1138.460 19.99 25.49 25.62 35.25 33.75 0.7 985.29 246 65 -628 -1500 1992 -2377 -1020 -2726 217 -1930 -4373 -1563 -322 -596 199 1114 -965 1146 -227 1235 1054 430 830 1361 830 1753 553 56 647 632 517 1282 1376 1445 -3535 -1219 -3136 -2439 -408 77 -945 523 -971 419 120 349 -241 -123 -1923 -473 395 795 901 1174 1022 612 592 7 -488 59 1234 887 1202 1982 313 -506 -328 -1169 -49 482 533 678 477 827 128 -45 -167 -1084 -1068 -816 -1194 -977 -1789 -2585 -1090 -673 -256 368 714 426 383 179 -455 -240 219 30 505 816 773 820 -62 -1097 -1837 -660 93 -939 -415 -493 -297 233 324 337 334 605 -233 -317 33 246 70 553 29 217 553 402 738 565 2 208 435 41 482 62 -347 -166 214 182 -281 345 -16 -253 -214 -412 -859 66 19 -189 -424 520 -616 -274 -819 65 -619 -1414 -494 -110 -214 80 483 -413 492 -102 564 490 199 389 665 424 917 294 28 297 301 240 623 714 775 -1867 -607 -1723 -1428 -261 55 -702 399 -774 333 95 274 -187 -92 -1422 -341 293 625 706 965 870 530 521 6 -426 50 1077 787 1094 1906 307 -484 -288 -1043 -42 463 541 694 494 830 127 -43 -148 -905 -899 -721 -1130 -975 -1935 -2821 -1249 -794 -305 453 890 519 450 201 -488 -251 224 33 592 977 996 1052 -76 -1320 -2164 -770 112 -1175 -539 -647 -407 322 455 484 467 817 -302 -393 42 304 92 755 40 299 775 545 978 713 3 253 552 54 632 84 -483 -236 307 269 -430 519 -24 -384 -325 -610 -1241 SS 20260327T222403.2Z 9582.933370 476 1 3.51 2 57.45 43.63 150.54 132.73 0.00 1 0.00 1 0 17 8.858e-03 7.100e-03 1.560e-03 1.074e-03 2.012380e-01 5.525176e-04 2.586482e-03 -6.000000e+00 5.092610e-03 226.81 -2.00 3.69 -2.00 314.95 0.00e+00 4.514701e-04 4.643449e-05 2.195725e-05 -6.000000e+00 2.210260e-04 278.41 -2.00 20.00 -2.00 314.43 0.00e+00 1.852 0.000 302.00 328.00 3 2.2793e+00 1.4123e-03 2.0650e-02 -6.0000e+00 1.2644e-02 2.2180e-02 1.5677e-03 1.0827e-02 -6.0000e+00 1.3713e-02 -3.2223e-03 8.9847e-04 5.3123e-03 -6.0000e+00 8.1531e-03 -1.2088e-03 3.9922e-04 1.5231e-03 -6.0000e+00 3.4876e-03 7.5435e-03 7.9995e-05 3.0376e-05 1.9863e-05 -6.0000e+00 2.4341e-04 7.3005e-03 0.0000e+00 12 9 1 12 1 1 91.33 25.50 0.34 0.00730 0.00790 25 42 1 8 0 134.690 20.00 25.50 25.76 35.25 33.75 0.7 985.85 -247 297 -532 -1127 -2391 -2265 -959 -56 598 -495 -1990 -1323 -1229 -823 814 595 31 1009 452 1423 1007 802 1336 624 405 930 589 482 -61 439 767 989 1648 -82 -2478 -1765 -2582 -1819 -659 -489 -729 -647 -529 454 -315 -318 -276 -509 -1139 -326 550 909 862 1083 855 798 946 402 287 405 547 908 1367 1837 835 -258 -539 -938 -78 411 488 692 446 685 230 -119 -633 -1430 -1326 -913 -1003 -1193 -1754 -2603 -1150 -613 -246 201 907 420 553 313 -303 -477 -9 278 460 1090 715 45 6 -959 -1320 -622 -224 -787 -447 -631 -398 254 559 701 283 304 -260 -60 -96 28 353 466 236 326 413 263 375 488 159 504 537 280 308 111 -231 -258 61 -40 -151 266 94 -189 -162 -474 -902 -81 105 -193 -384 -773 -694 -304 -18 214 -178 -757 -503 -484 -343 356 285 15 487 227 728 526 415 698 329 222 502 320 258 -32 220 397 515 911 -46 -1383 -944 -1440 -1104 -433 -349 -554 -512 -416 358 -248 -250 -220 -392 -888 -249 418 731 704 898 734 695 836 346 251 351 484 826 1294 1788 824 -245 -487 -841 -69 393 486 705 461 706 231 -112 -570 -1247 -1164 -825 -986 -1222 -1890 -2874 -1299 -722 -298 245 1117 506 651 345 -324 -493 -9 300 532 1320 889 57 7 -1153 -1525 -716 -272 -975 -562 -814 -535 349 790 988 398 409 -337 -75 -118 36 449 625 323 447 557 351 483 612 195 614 666 362 407 149 -316 -352 85 -58 -223 401 141 -288 -239 -695 -1318 SS 20260327T222907.8Z 9582.936896 479 1 48.55 2 56.83 42.31 149.89 130.90 0.00 1 0.00 1 0 17 8.534e-03 6.978e-03 3.456e-04 2.391e-04 1.986198e-01 1.229385e-04 2.554125e-03 -6.000000e+00 4.906252e-03 226.81 -2.00 3.69 -2.00 314.92 0.00e+00 4.135924e-04 1.030639e-05 2.624442e-05 -6.000000e+00 2.129412e-04 278.41 -2.00 20.00 -2.00 314.41 0.00e+00 1.822 0.000 302.00 328.00 3 1.9672e+00 3.1405e-04 2.0334e-02 -6.0000e+00 1.2182e-02 2.2303e-02 3.4842e-04 1.0684e-02 -6.0000e+00 1.3211e-02 -3.2888e-03 2.0000e-04 5.2472e-03 -6.0000e+00 7.8548e-03 -1.5495e-03 8.8883e-05 1.4995e-03 -6.0000e+00 3.3600e-03 1.0652e-02 6.9242e-05 6.7710e-06 1.9740e-05 -6.0000e+00 2.3450e-04 7.4269e-03 0.0000e+00 12 9 1 12 1 1 99.97 25.50 0.34 0.00743 0.00795 642 75 2 8 0 75.490 19.99 25.50 25.92 35.25 34.00 0.8 987.47 -471 -130 -167 -1571 -1922 -1793 -1269 -205 479 -522 -1638 -1380 -994 -524 500 372 211 555 858 1377 1203 692 1240 856 637 996 527 48 -181 469 798 1093 1443 60 -2223 -2139 -2525 -1694 -614 -441 -764 -630 -592 396 -374 -186 -357 -457 -731 -403 457 571 877 1088 808 734 851 467 303 346 704 993 1482 1704 717 -126 -360 -971 -126 584 486 595 418 631 286 -130 -522 -1295 -1082 -918 -1158 -1142 -1833 -2670 -1198 -668 -207 271 597 528 401 169 -271 -378 -6 167 470 1016 677 202 -71 -863 -1464 -599 -436 -730 -571 -467 -303 301 643 659 370 201 -222 -226 -99 90 264 524 161 330 472 323 466 514 75 450 547 307 297 19 -226 -254 64 68 -107 353 130 -187 -272 -548 -947 -162 -45 -59 -529 -608 -574 -397 -70 168 -195 -610 -515 -383 -225 226 175 103 276 439 688 611 349 633 460 340 547 292 26 -92 240 422 579 813 34 -1258 -1167 -1428 -1040 -407 -317 -583 -500 -467 313 -296 -151 -285 -353 -569 -309 361 462 716 931 693 637 750 413 264 299 620 898 1394 1650 704 -119 -322 -866 -115 552 494 618 440 644 284 -121 -466 -1122 -942 -851 -1129 -1156 -1951 -2909 -1334 -776 -247 333 725 642 465 189 -286 -396 -6 183 534 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