File name: Pandora141s1_Calakmul_20250131_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250201T062349.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 141 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250131_L1_smca1c3d20231011p1-8.txt Full location name: Calakmul Atmospheric Observatory Short location name: Calakmul Country of location: Mexico Location latitude [deg]: 18.5956 Location longitude [deg]: -89.4137 Location altitude [m]: 275 Local noon date: 20250131 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB session based on session 2 First and last pixel inside fitting window: 238 379 Nominal wavelengths inside fitting window [nm]: 305.1074 305.2483 305.3892 305.5302 305.6711 305.8120 305.9528 306.0937 306.2346 306.3754 306.5163 306.6571 306.7979 306.9387 307.0795 307.2203 307.3611 307.5018 307.6426 307.7833 307.9240 308.0647 308.2054 308.3461 308.4868 308.6275 308.7681 308.9088 309.0494 309.1900 309.3306 309.4712 309.6118 309.7524 309.8930 310.0335 310.1741 310.3146 310.4551 310.5956 310.7361 310.8766 311.0171 311.1575 311.2980 311.4384 311.5788 311.7192 311.8596 312.0000 312.1404 312.2808 312.4211 312.5615 312.7018 312.8421 312.9824 313.1227 313.2630 313.4033 313.5435 313.6838 313.8240 313.9643 314.1045 314.2447 314.3849 314.5251 314.6652 314.8054 314.9455 315.0857 315.2258 315.3659 315.5060 315.6461 315.7862 315.9262 316.0663 316.2063 316.3463 316.4864 316.6264 316.7664 316.9063 317.0463 317.1863 317.3262 317.4662 317.6061 317.7460 317.8859 318.0258 318.1657 318.3055 318.4454 318.5852 318.7250 318.8649 319.0047 319.1445 319.2842 319.4240 319.5638 319.7035 319.8433 319.9830 320.1227 320.2624 320.4021 320.5418 320.6814 320.8211 320.9607 321.1003 321.2400 321.3796 321.5192 321.6588 321.7983 321.9379 322.0774 322.2170 322.3565 322.4960 322.6355 322.7750 322.9145 323.0539 323.1934 323.3328 323.4723 323.6117 323.7511 323.8905 324.0299 324.1692 324.3086 324.4479 324.5873 324.7266 324.8659 --------------------------------------------------------------------------------------- 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 20250131T145205.2Z 9162.619505 120 1 30.24 2 60.62 123.18 81.93 103.31 0.00 1 0.00 1 0 17 7.977e-03 5.497e-03 5.421e-04 2.145e-04 2.342402e-01 1.142486e-04 2.568117e-03 -6.000000e+00 4.837249e-03 224.80 -2.00 3.11 -2.00 316.77 0.00e+00 3.074086e-04 1.485242e-05 1.476478e-04 -6.000000e+00 2.200379e-04 290.52 -2.00 20.00 -2.00 315.96 0.00e+00 2.029 0.000 302.00 328.00 3 7.5224e-01 2.9617e-04 2.2219e-02 -6.0000e+00 1.1894e-02 -3.7958e-03 3.3057e-04 1.0701e-02 -6.0000e+00 1.2813e-02 7.2508e-03 1.9502e-04 5.2737e-03 -6.0000e+00 7.6921e-03 -6.2085e-03 9.4771e-05 1.5065e-03 -6.0000e+00 3.3602e-03 2.6997e-02 -3.7199e-04 6.8690e-06 2.0631e-05 -6.0000e+00 2.4603e-04 -6.7129e-02 1.2216e-04 10 0 0 10 0 0 99.99 19.93 0.16 -0.06713 -0.06992 2897 2897 1 5 0 10.340 26.00 20.01 19.93 32.85 37.3 985.36 365 -87 -862 -1949 -2654 -1739 -1030 491 383 -807 -1806 -1561 -796 -105 192 -234 -20 221 319 479 642 597 666 990 1085 737 229 -282 214 536 903 1570 1116 -610 -2001 -2267 -1979 -872 -324 -663 -995 -818 -629 -575 -400 -418 -604 -676 -474 -103 264 668 884 708 607 741 681 340 296 487 1034 1413 1805 1329 621 -38 -338 -4 750 1010 560 424 431 257 134 -202 -715 -785 -753 -762 -1105 -1555 -1841 -1671 -1158 -644 -261 157 126 319 265 210 -23 325 348 464 500 422 125 -158 -533 -796 -299 -98 -562 -653 -738 -321 125 634 554 437 194 15 106 311 407 509 297 -58 -87 -130 -80 83 200 121 362 499 409 288 -68 -302 -258 52 -109 -42 113 59 -15 -162 -198 -403 52 -14 -139 -304 -381 -233 -141 73 63 -142 -326 -287 -158 -23 44 -59 -5 61 92 142 194 181 204 315 364 257 80 -95 67 164 283 524 400 -228 -737 -821 -759 -381 -154 -366 -608 -528 -388 -359 -249 -259 -398 -435 -298 -65 171 459 596 501 445 555 518 260 224 366 793 1147 1570 1144 541 -31 -280 -3 623 864 525 418 428 249 122 -180 -582 -605 -594 -660 -1001 -1558 -1987 -1786 -1311 -774 -312 193 155 381 316 230 -24 335 371 504 600 522 164 -209 -670 -992 -354 -118 -722 -842 -999 -453 174 930 851 680 294 21 148 408 525 679 422 -83 -128 -191 -115 122 279 160 489 670 542 407 -101 -437 -383 81 -176 -67 187 99 -25 -273 -324 -674 SS 20250131T145235.6Z 9162.619856 120 2 30.38 2 60.52 123.26 81.82 103.35 0.00 1 0.00 1 0 17 4.654e-02 9.703e-03 4.292e-02 1.040e-02 2.351440e-01 5.534710e-03 2.544690e-03 -6.000000e+00 2.823816e-02 224.80 -2.00 3.11 -2.00 318.05 0.00e+00 -1.012417e-03 9.796895e-04 2.269357e-04 -6.000000e+00 1.284292e-03 290.52 -2.00 20.00 -2.00 317.19 0.00e+00 2.023 0.000 302.00 328.00 3 5.4221e+00 1.4716e-02 2.2224e-02 -6.0000e+00 6.9437e-02 -8.2628e-02 1.6648e-02 1.0993e-02 -6.0000e+00 7.4782e-02 9.5172e-02 1.0321e-02 5.3126e-03 -6.0000e+00 4.4893e-02 -3.4851e-02 5.2502e-03 1.8586e-03 -6.0000e+00 1.9627e-02 2.5520e-04 -6.8646e-05 3.4558e-04 2.2267e-05 -6.0000e+00 1.4351e-03 -6.9226e-02 2.3603e-04 12 8 8 10 0 0 94.80 19.93 0.51 -0.06923 -0.06974 2897 2897 1 5 0 10.340 26.11 20.01 19.93 32.96 37.3 985.36 16786 22626 -10757 -5869 -21857 8087 2400 21210 9743 4644 -9664 -12692 -997 -3058 877 2622 -5331 1111 1054 5735 1853 -4382 -7647 -1000 546 -2892 6794 2967 4213 8248 -181 -5598 515 -2759 270 -1415 6687 5783 2730 6241 -1862 -1831 -3917 -2860 1860 2597 196 -163 57 -1728 -2829 -1144 -882 838 408 398 1995 -494 -2219 472 -544 1139 1807 1956 1065 25 60 -1863 -82 -578 -76 1369 611 1047 1055 1285 -2326 -3272 -2375 -1646 34 340 -141 -734 -660 -671 -362 23 -458 1786 919 421 -186 -63 522 1315 -313 -1159 581 117 795 -377 -604 -968 -894 -475 -658 -417 -267 1176 811 1083 -859 -218 -702 -316 141 -450 1015 268 275 334 -751 552 -207 -38 200 32 282 -721 -101 -105 86 -131 -539 330 770 199 236 88 -240 -714 1173 1644 -1070 -546 -2175 601 193 1610 900 475 -1139 -1572 -120 -419 130 416 -954 195 192 1041 358 -903 -1653 -214 122 -693 1508 659 884 1630 -39 -1362 127 -719 67 -354 1648 1635 925 2349 -827 -860 -1936 -1422 890 1231 94 -77 26 -819 -1402 -592 -482 473 240 240 1209 -308 -1394 289 -345 749 1269 1442 798 18 41 -1252 -57 -439 -62 1167 531 885 846 950 -1630 -2203 -1618 -1213 27 298 -132 -732 -698 -755 -428 28 -564 2105 1032 440 -181 -60 503 1360 -361 -1463 763 155 1000 -449 -693 -1132 -1106 -620 -901 -595 -398 1827 1318 1781 -1402 -335 -1010 -429 189 -622 1464 412 435 529 -1178 828 -300 -52 266 43 389 -1064 -155 -166 139 -221 -953 606 1455 385 462 169 -453 -1313 SS 20250131T145305.9Z 9162.620207 120 3 30.21 2 60.42 123.34 81.70 103.39 0.00 1 0.00 1 0 25 3.469e-01 7.040e-02 3.043e-01 7.685e-02 2.210837e-01 4.049119e-02 4.243518e-03 -6.000000e+00 2.112248e-01 224.80 -2.00 3.11 -2.00 317.91 0.00e+00 -5.691736e-03 6.898620e-03 2.667463e-03 -6.000000e+00 9.801036e-03 290.52 -2.00 20.00 -2.00 317.06 0.00e+00 2.017 0.000 302.00 328.00 3 7.7951e+00 1.0687e-01 2.4599e-02 -6.0000e+00 5.1882e-01 -2.5196e-01 1.2072e-01 2.2735e-02 -6.0000e+00 5.5905e-01 8.7628e-02 7.4222e-02 4.8870e-03 -6.0000e+00 3.3516e-01 5.4064e-02 3.7769e-02 7.7714e-03 -6.0000e+00 1.4682e-01 2.5902e-05 9.2502e-04 2.5421e-03 8.0744e-05 -6.0000e+00 1.0710e-02 -6.5980e-02 1.0643e-04 12 8 8 10 0 0 2.78 19.93 1.84 -0.06598 -0.05903 2897 2897 1 5 0 10.340 26.11 20.01 19.93 32.96 37.3 985.36 122492 900000 -665 -33752 44386 900000 48712 164307 100547 41583 -37034 -43367 12350 -15265 57100 -5058 46851 -22333 9947 246748 34787 -18220 -39753 -1953 29469 -4893 24323 59099 39668 48194 -3739 -40745 -6801 -12657 -3254 35612 45222 45934 29356 46410 -13092 -2257 -16794 -765 2682 4413 18017 465 -4231 -5216 -16418 -18610 -6460 18327 41876 -171 -924 7747 -10399 -11566 -4809 -8755 12313 13535 6722 -6428 22852 -8285 5101 -7736 -7208 13707 3786 2953 16674 12528 -10295 -3445 -14362 -3412 14159 574 11385 11132 11258 -4657 813 -7196 6284 3020 5106 2472 -7888 7489 -2549 3344 -6767 -1456 -624 -6258 2152 -4649 -3307 -7034 -2431 -1770 -1087 -8205 -3906 2380 -3522 6809 1874 -955 -7086 -2570 -3835 3114 8852 3188 6568 3229 6173 6314 4384 -5056 -2739 -859 3590 -1204 -1768 794 899 3211 1824 -1804 -850 3176 -677 -658 -4453 -1871 9176 900000 -76 -4836 3325 900000 3649 12308 7532 4064 -7003 -8765 1677 -2820 6355 -995 6267 -5377 1894 18483 5718 -4675 -12527 -481 6000 -1375 5390 9461 7025 7680 -921 -14266 -1903 -3788 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