File name: Pandora25s1_HoustonTX_20231013_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20241218T040841.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20231013_L1_smca1c9d20230101p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20231013 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20231013T131007.9Z 8686.548703 75 1 49.49 2 80.54 104.69 67.83 105.35 0.00 1 0.00 1 0 25 3.498e-01 5.659e-03 1.456e-01 1.613e-03 6.360586e-01 8.603359e-04 6.755560e-03 -6.000000e+00 2.022482e-01 227.07 -2.00 3.24 -2.00 320.85 0.00e+00 1.878378e-03 3.948495e-04 7.127920e-04 -6.000000e+00 9.263584e-03 291.48 -2.00 20.00 -2.00 320.15 0.00e+00 5.790 0.002 302.00 328.00 3 5.8187e-01 2.8800e-03 6.5314e-02 -6.0000e+00 4.9995e-01 1.6394e-02 3.8755e-03 3.2133e-02 -6.0000e+00 5.4151e-01 -1.1076e-02 3.7020e-03 1.5914e-02 -6.0000e+00 3.2451e-01 -4.1836e-03 1.8037e-03 6.2468e-03 -6.0000e+00 1.3958e-01 5.1243e-04 -8.4597e-04 4.5323e-05 6.0006e-05 -6.0000e+00 9.7925e-03 5.6386e-03 0.0000e+00 10 0 0 10 0 0 5.61 24.81 0.33 0.00564 -0.00072 218 46 1 5 0 227.010 27.26 20.00 24.81 30.19 30.5 1083.71 -117570 -104159 -117726 -22761 -110058 -103993 213498 -119667 80965 -46084 -115502 -9625 -98888 -37241 -54529 -48095 -2253 20587 -15193 -10451 -16112 -29533 -37330 -9088 -23810 -14817 -12613 -20186 -5311 -15251 10013 -2014 940 -838 -10586 3708 7090 22198 -3467 -3743 -4593 3144 -2622 728 3217 -239 -4774 -1683 2902 2277 5231 261 1264 2700 2123 1375 2459 -2646 227 371 1966 186 1174 1372 511 1255 1011 935 2263 1506 397 406 246 -432 930 513 -2302 -263 244 -259 -886 -1240 -1691 -889 -914 -961 -134 -29 453 871 1034 934 423 652 115 386 133 399 -10 -232 -68 -804 -204 -249 -690 -877 -814 -825 60 152 -11 -25 164 267 282 558 698 201 -269 -517 -693 -172 38 97 237 463 309 1233 178 64 69 30 38 260 26 -308 -148 45 -252 -309 163 -124 161 -706 -641 -893 -72 -779 -704 336 -1113 127 -283 -1388 -51 -1499 -394 -866 -860 -29 236 -272 -190 -320 -684 -999 -203 -674 -409 -348 -589 -134 -465 284 -77 41 -39 -536 164 340 1102 -252 -328 -461 316 -295 82 360 -28 -612 -217 377 322 802 44 231 532 449 308 563 -639 52 84 456 49 345 453 180 432 345 331 874 626 185 198 120 -201 393 196 -913 -103 99 -125 -502 -807 -1138 -634 -698 -785 -115 -26 398 738 820 694 304 478 94 340 137 439 -12 -285 -78 -905 -209 -254 -755 -1024 -944 -1025 81 216 -17 -39 263 436 438 826 1029 310 -441 -845 -1137 -287 61 151 355 667 457 1851 283 108 129 57 75 553 56 -710 -335 104 -585 -730 362 -261 343 SS 20231013T131925.4Z 8686.555155 80 1 49.47 2 78.60 105.94 65.95 106.74 0.00 1 0.00 1 0 25 1.339e-01 4.902e-03 2.209e-02 8.399e-04 5.485984e-01 4.384419e-04 5.903950e-03 -6.000000e+00 7.738238e-02 227.07 -2.00 3.24 -2.00 320.13 0.00e+00 1.668386e-03 1.569225e-04 2.232103e-04 -6.000000e+00 3.544470e-03 291.48 -2.00 20.00 -2.00 319.35 0.00e+00 4.886 0.001 302.00 328.00 3 3.7809e-01 1.3270e-03 5.5171e-02 -6.0000e+00 1.9129e-01 2.7278e-02 1.6524e-03 2.6659e-02 -6.0000e+00 2.0719e-01 -1.9008e-02 1.4194e-03 1.3233e-02 -6.0000e+00 1.2416e-01 -1.0541e-03 7.2825e-04 4.3874e-03 -6.0000e+00 5.3400e-02 1.5933e-03 -8.0692e-04 2.4008e-05 4.7091e-05 -6.0000e+00 3.7470e-03 6.0839e-03 0.0000e+00 10 0 0 10 0 0 98.79 24.80 0.27 0.00608 0.00002 413 88 1 5 0 119.760 27.26 20.00 24.80 31.08 30.7 1090.09 -47692 -54011 -42566 -43711 -51069 -73698 -13015 -43540 -13292 -34538 -40178 -20507 -27087 -12546 -16315 -4108 -5720 -719 -9363 -1218 -8290 -3639 -10739 -5910 -7759 -6195 -7455 -8987 -3357 -7727 787 -2299 1361 -3233 -3830 -4348 -731 2396 -637 -1157 -1246 -174 -1388 164 351 257 -587 184 186 935 1314 1363 1227 1810 763 963 1010 -382 718 144 760 815 1853 1447 1135 319 858 226 1232 1012 290 708 -18 161 -81 -15 -1070 -300 -341 -386 -955 -925 -1619 -1303 -1003 -777 -117 -230 285 534 875 863 685 660 486 316 418 258 -149 -304 -267 -510 -192 -75 -883 -1186 -841 -625 -215 771 56 73 182 233 253 485 492 192 -27 -318 -616 -200 126 68 219 325 343 985 472 200 81 -198 -51 118 -98 -99 -149 78 -168 -168 -16 -130 48 -476 -660 -491 -491 -574 -1043 -122 -577 -147 -512 -664 -316 -553 -278 -463 -121 -191 -25 -353 -45 -336 -143 -477 -274 -397 -330 -408 -484 -168 -433 47 -166 108 -285 -329 -377 -68 258 -80 -174 -210 -31 -265 32 69 51 -120 38 40 212 328 351 346 549 247 325 351 -135 245 49 266 313 793 643 527 145 379 103 607 571 171 436 -11 95 -47 -8 -523 -145 -181 -239 -647 -711 -1291 -1102 -905 -747 -111 -227 280 506 820 752 568 553 446 313 474 315 -188 -389 -339 -592 -217 -85 -1018 -1459 -1087 -815 -302 1130 86 119 296 365 390 709 717 292 -43 -517 -1013 -320 203 106 327 467 500 1450 730 330 139 -364 -97 228 -202 -207 -322 172 -359 -362 -33 -264 94 SS 20231013T133003.3Z 8686.562539 86 1 32.08 2 76.39 107.41 63.82 108.39 0.00 1 0.00 1 0 25 6.537e-02 4.881e-03 1.568e-02 1.084e-03 4.745749e-01 5.581959e-04 5.154833e-03 -6.000000e+00 3.779256e-02 227.07 -2.00 3.24 -2.00 319.44 0.00e+00 1.066359e-03 1.581340e-04 2.003493e-04 -6.000000e+00 1.731017e-03 291.48 -2.00 20.00 -2.00 318.60 0.00e+00 4.147 0.001 302.00 328.00 3 1.2854e+00 1.5925e-03 4.7034e-02 -6.0000e+00 9.3421e-02 2.1377e-02 1.8967e-03 2.2993e-02 -6.0000e+00 1.0119e-01 -1.1855e-02 1.4632e-03 1.1237e-02 -6.0000e+00 6.0638e-02 -1.2388e-03 7.6908e-04 3.4435e-03 -6.0000e+00 2.6081e-02 1.4015e-03 -6.1151e-04 3.1439e-05 3.7046e-05 -6.0000e+00 1.8299e-03 5.6799e-03 0.0000e+00 12 1 1 12 1 1 99.96 24.80 0.20 0.00568 0.00108 166 55 1 5 0 192.030 27.26 20.00 24.80 31.74 30.5 1092.56 -42457 -3411 -29015 -3675 -28678 -23898 -9893 -19721 -5585 -14705 -21247 -10260 -10825 -7200 -5720 -7548 2982 1290 -3101 -3416 -1385 -2890 -4022 -824 -1454 -1677 -5125 -2827 -4238 -2781 423 3536 732 -132 -3406 -89 -378 2818 -1088 -1435 -935 -1038 -429 122 637 339 -807 -249 279 680 1509 916 997 1460 586 784 769 -79 249 281 679 1105 1086 1573 562 220 88 -20 851 670 289 345 112 102 322 -52 -843 -565 115 -596 -860 -1049 -1651 -1270 -1095 -717 -303 -14 50 352 576 804 637 720 818 468 401 450 54 -339 -256 -748 -96 -79 -531 -1023 -706 -648 -49 140 79 136 201 318 90 548 392 250 -106 -356 -641 -331 -82 240 320 500 424 1011 579 259 108 -172 4 164 -21 -254 -125 50 -82 -223 -99 -134 -53 -987 -61 -698 -65 -604 -478 -188 -474 -131 -405 -649 -312 -369 -290 -274 -424 165 79 -212 -246 -100 -214 -316 -68 -130 -147 -469 -262 -387 -262 41 378 91 -17 -442 -11 -53 453 -207 -325 -234 -278 -119 34 181 98 -237 -74 84 213 480 323 381 596 254 352 354 -37 113 127 315 523 573 907 337 127 49 -12 517 439 209 248 81 74 215 -31 -502 -330 72 -411 -648 -893 -1462 -1188 -1093 -727 -323 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