File name: Pandora127s1_Mainz-MPIC_20250908_L2Fit_fwvt1c5d20250721p1-8.txt
File generation date: 20250908T233351.3Z
Data description: Level 2 spectral fitting results file
Data file version: fwvt1c5p1-8
Local principal investigator: Thomas Wagner
Network principal investigator: Alexander Cede
Instrument type: Pandora
Instrument number: 127
Spectrometer number: 1
Processing software version used: BlickP v1.8.75
Instrument operation file used: Pandora127_OF_v4d20210611.txt
Instrument calibration file used: Pandora127s1_CF_v6d20250721.txt
Level 1 file used: Pandora127s1_Mainz-MPIC_20250908_L1_smca1c5d20250721p1-8.txt
Full location name: Max-Planck-Institute for Chemistry, Mainz
Short location name: Mainz-MPIC
Country of location: Germany
Location latitude [deg]: 49.9910
Location longitude [deg]: 8.2280
Location altitude [m]: 125
Local noon date: 20250908
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: None
First and last pixel inside fitting window: 1649 1799
Nominal wavelengths inside fitting window [nm]: 492.0932 492.2135 492.3339 492.4542 492.5745 492.6948 492.8151 492.9353 493.0556 493.1758 493.2960 493.4162 493.5364 493.6565 493.7767 493.8968 494.0169 494.1370 494.2571 494.3771 494.4972 494.6172 494.7372 494.8572 494.9772 495.0971 495.2170 495.3370 495.4569 495.5767 495.6966 495.8165 495.9363 496.0561 496.1759 496.2957 496.4155 496.5352 496.6549 496.7746 496.8943 497.0140 497.1337 497.2533 497.3730 497.4926 497.6122 497.7317 497.8513 497.9708 498.0904 498.2099 498.3294 498.4488 498.5683 498.6877 498.8072 498.9266 499.0459 499.1653 499.2847 499.4040 499.5233 499.6426 499.7619 499.8812 500.0004 500.1197 500.2389 500.3581 500.4773 500.5964 500.7156 500.8347 500.9538 501.0729 501.1920 501.3110 501.4301 501.5491 501.6681 501.7871 501.9061 502.0250 502.1440 502.2629 502.3818 502.5007 502.6196 502.7384 502.8573 502.9761 503.0949 503.2137 503.3324 503.4512 503.5699 503.6886 503.8073 503.9260 504.0447 504.1633 504.2820 504.4006 504.5192 504.6378 504.7563 504.8749 504.9934 505.1119 505.2304 505.3489 505.4673 505.5858 505.7042 505.8226 505.9410 506.0593 506.1777 506.2960 506.4144 506.5327 506.6509 506.7692 506.8875 507.0057 507.1239 507.2421 507.3603 507.4785 507.5966 507.7147 507.8328 507.9509 508.0690 508.1871 508.3051 508.4231 508.5412 508.6591 508.7771 508.8951 509.0130 509.1309 509.2488 509.3667 509.4846 509.6025 509.7203 509.8381 509.9559
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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: Water vapor slant column amount [moles per square meter], -9e99=fitting not successful
Column 23: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor 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: Water vapor effective temperature [K]
Column 28: Independent uncertainty of water vapor 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 water vapor 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 water vapor 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 water vapor fitting wavelength [nm], -9=fitting not successful
Column 32: Diffuse correction applied before fitting at effective fitting wavelength for water vapor [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction
Column 33: Nitrogen dioxide slant column amount [moles per square meter], -9e99=fitting not successful
Column 34: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen 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: Nitrogen dioxide effective temperature [K]
Column 39: Independent uncertainty of nitrogen 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 nitrogen 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 nitrogen 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 nitrogen dioxide fitting wavelength [nm], -9=fitting not successful
Column 43: Diffuse correction applied before fitting at effective fitting wavelength for nitrogen dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction
Column 44: Ozone slant column amount [moles per square meter], -9e99=fitting not successful
Column 45: 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 46: 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 47: 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 48: 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 49: Ozone effective temperature [K]
Column 50: 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 51: 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 52: 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 53: Effective ozone fitting wavelength [nm], -9=fitting not successful
Column 54: 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 55: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting
Column 56: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting
Column 57: Lower limit used for wavelength scaling [nm]
Column 58: Upper limit used for wavelength scaling [nm]
Column 59: Order of smoothing polynomial
Column 60: Smoothing polynomial coefficient, order 0
Column 61: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 62: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 63: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 64: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful
Column 65: Smoothing polynomial coefficient, order 1
Column 66: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 67: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 68: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 69: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful
Column 70: Mean value of measured data inside fitting window [same units as measurements]
Column 71: Wavelength change polynomial coefficient, order 0
Column 72: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 73: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 74: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 75: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful
Column 76: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination
Column 77: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination
Column 78: 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 79: 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 80: 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 81: 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 82: 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 83: 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 84: Atmospheric variability [%], 999=no atmospheric variability was determined
Column 85: Wavelength effective temperature [°C], 999=no effective temperature given
Column 86: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher)
Column 87: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination
Column 88: Retrieved total wavelength shift [nm], -9=no wavelength change fitting
Column 89: Number of bright count cycles
Column 90: Number of dark count cycles
Column 91: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions
Column 92: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions
Column 93: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal
Column 94: Integration time [ms]
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: Temperature at electronics board 1 [°C], 999=no temperature signal
Column 99: Temperature at electronics board 2 [°C], 999=no temperature signal
Column 100: Humidity in head sensor [%], -9=no humidity signal
Column 101: Pressure in head sensor [hPa], -9=no pressure signal
Columns 102-252: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting
Columns 253-403: 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
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SQ 20250908T084442.2Z 9382.364377 312 1 48.14 2 55.67 129.20 118.34 304.20 0.00 1 0.00 1 0 15 3.360e-03 3.338e-03 6.762e-04 6.744e-04 3.430400e+03 4.050773e+01 2.512115e+02 -6.000000e+00 1.808273e+02 281.55 -2.00 20.00 -2.00 505.27 0.00e+00 6.955545e-04 1.825715e-05 4.176280e-05 -6.000000e+00 9.275726e-05 281.55 -2.00 20.00 -2.00 500.40 0.00e+00 2.786474e-03 1.323908e-02 2.448732e-02 -6.000000e+00 6.576606e-02 229.63 -2.00 3.76 -2.00 502.01 0.00e+00 1.768 0.000 489.00 513.00 1 6.7828e+00 1.0131e-03 3.3939e-03 -6.0000e+00 5.0313e-03 4.4863e-03 2.6347e-04 6.0493e-04 -6.0000e+00 1.3162e-03 1.7077e-03 2.8187e-04 6.0052e-05 3.2640e-05 -6.0000e+00 3.0988e-04 3.2724e-03 -5.3371e-05 10 0 0 10 0 0 98.83 20.85 1.97 0.00327 0.00523 39 9 1 2 0 1234.300 20.01 20.85 26.95 25.68 25.58 0.0 988.73 -701 -467 -179 -72 105 601 534 496 475 277 346 60 -182 -315 -428 -420 -189 186 131 -103 207 232 148 379 168 328 314 231 -288 -527 -366 -491 -126 288 39 35 212 -3 -115 -96 -44 -139 115 302 354 372 308 274 111 -142 -474 -590 -1597 -514 -232 -267 -52 -62 154 39 248 450 404 414 355 165 228 -30 -208 -309 -396 -55 -193 101 183 -125 -222 -130 -368 -453 -481 -403 -350 -231 14 -363 -91 -173 -89 -156 -60 389 360 320 406 480 299 -151 -283 -611 -664 -558 -356 -17 -151 -150 -51 -434 -300 -294 -10 -6 164 370 203 426 609 627 377 402 171 44 16 228 40 112 198 213 192 443 263 -125 -51 -330 -432 -264 -69 -45 -111 74 1 102 221 265 324 359 -43 -142 -340 -331 -366 -683 -464 -184 -73 108 632 571 535 509 294 360 61 -185 -317 -428 -423 -193 195 140 -112 224 250 160 411 175 341 325 248 -301 -534 -364 -491 -129 304 40 36 219 -3 -121 -101 -47 -147 117 310 367 386 318 279 111 -146 -474 -575 -1549 -497 -231 -274 -52 -63 156 39 250 454 410 420 357 163 223 -30 -208 -306 -388 -54 -191 101 177 -120 -221 -127 -355 -436 -465 -392 -343 -228 14 -351 -88 -167 -86 -151 -58 381 359 321 403 468 285 -141 -271 -573 -617 -523 -343 -16 -150 -150 -50 -425 -290 -283 -9 -6 164 374 207 435 625 646 388 409 171 44 15 222 40 110 194 209 188 431 256 -120 -48 -308 -401 -247 -65 -44 -110 74 1 99 215 258 317 350 -42 -140 -328 -315 -349
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SQ 20250908T100523.3Z 9382.420408 358 1 48.58 2 47.50 152.74 126.86 324.88 0.00 1 0.00 1 0 15 3.471e-03 3.421e-03 4.972e-04 4.955e-04 3.034057e+03 2.947450e+01 2.206437e+02 -6.000000e+00 1.868092e+02 281.55 -2.00 20.00 -2.00 505.25 0.00e+00 6.731566e-04 1.337338e-05 3.993481e-05 -6.000000e+00 9.582929e-05 281.55 -2.00 20.00 -2.00 500.37 0.00e+00 -2.506052e-02 9.713494e-03 2.192133e-02 -6.000000e+00 6.795211e-02 229.62 -2.00 3.76 -2.00 501.97 0.00e+00 1.478 0.000 489.00 513.00 1 6.2545e+00 7.4262e-04 2.9466e-03 -6.0000e+00 5.1984e-03 7.9797e-03 1.9359e-04 5.3467e-04 -6.0000e+00 1.3602e-03 3.0262e-03 4.3075e-04 4.4485e-05 3.0535e-05 -6.0000e+00 3.2017e-04 3.7606e-03 -6.5822e-05 10 0 0 10 0 0 99.97 20.96 2.05 0.00376 0.00675 77 18 1 2 0 630.870 20.00 20.96 29.54 25.79 25.68 0.0 1001.56 -577 -563 -120 58 128 510 442 543 442 361 268 80 -271 -379 -555 -335 -177 22 123 -85 261 25 180 162 349 297 449 141 -322 -353 -428 -381 -145 436 35 93 167 73 -169 -129 -107 -133 180 300 413 371 405 286 168 -118 -441 -644 -1689 -642 -409 -188 -55 117 -46 75 226 411 291 413 377 222 195 -41 -82 -432 -284 -273 -119 87 12 -66 -199 -247 -320 -432 -421 -328 -509 -265 -20 -233 -208 -150 -115 -206 25 296 524 271 477 375 266 -105 -273 -662 -820 -566 -447 68 -57 -90 -69 -262 -367 -286 -57 -32 186 242 329 407 657 568 448 313 237 -5 54 331 166 182 180 357 52 483 205 -68 -70 -296 -437 -306 -16 -262 -22 111 154 56 259 305 282 326 -73 -198 -427 -431 -419 -554 -553 -121 61 131 530 468 578 469 377 275 81 -272 -394 -574 -348 -178 23 130 -91 279 27 193 174 375 319 479 149 -332 -352 -419 -375 -146 453 38 100 178 77 -176 -133 -110 -138 188 318 442 398 432 301 174 -119 -433 -617 -1613 -612 -400 -190 -56 121 -48 78 234 427 304 431 391 227 196 -41 -81 -420 -273 -263 -115 86 12 -65 -195 -237 -303 -408 -399 -313 -491 -257 -20 -231 -207 -149 -114 -205 25 298 513 267 467 376 262 -101 -256 -611 -750 -522 -424 67 -55 -88 -67 -251 -364 -283 -55 -31 183 241 329 409 662 575 453 312 233 -5 52 315 160 176 174 343 50 462 195 -65 -65 -284 -416 -292 -15 -250 -21 109 152 56 258 305 282 325 -72 -191 -404 -401 -391
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