File name: Pandora38s1_BayonneNJ_20231021_L2Fit_fout2c5d20230101p1-8.txt File generation date: 20231024T191957.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 38 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora38_OF_v4d20201028.txt Instrument calibration file used: Pandora38s1_CF_v5d20230101.txt Level 1 file used: Pandora38s1_BayonneNJ_20231021_L1_smca1c5d20230101p1-8.txt Full location name: Bayonne NJDEP (USEPA AQS ID 34-017-0006) Short location name: BayonneNJ Country of location: USA Location latitude [deg]: 40.6703 Location longitude [deg]: -74.1261 Location altitude [m]: 3 Local noon date: 20231021 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: 259 401 Nominal wavelengths inside fitting window [nm]: 305.1040 305.2447 305.3854 305.5261 305.6667 305.8074 305.9480 306.0886 306.2292 306.3698 306.5104 306.6510 306.7916 306.9321 307.0727 307.2132 307.3537 307.4942 307.6347 307.7752 307.9157 308.0561 308.1966 308.3370 308.4775 308.6179 308.7583 308.8987 309.0391 309.1794 309.3198 309.4601 309.6005 309.7408 309.8811 310.0214 310.1617 310.3020 310.4423 310.5825 310.7228 310.8630 311.0032 311.1434 311.2836 311.4238 311.5640 311.7042 311.8443 311.9844 312.1246 312.2647 312.4048 312.5449 312.6850 312.8250 312.9651 313.1052 313.2452 313.3852 313.5252 313.6652 313.8052 313.9452 314.0852 314.2251 314.3651 314.5050 314.6449 314.7848 314.9247 315.0646 315.2045 315.3443 315.4842 315.6240 315.7639 315.9037 316.0435 316.1833 316.3231 316.4628 316.6026 316.7423 316.8821 317.0218 317.1615 317.3012 317.4409 317.5806 317.7202 317.8599 317.9995 318.1391 318.2788 318.4184 318.5580 318.6975 318.8371 318.9767 319.1162 319.2558 319.3953 319.5348 319.6743 319.8138 319.9533 320.0927 320.2322 320.3716 320.5110 320.6505 320.7899 320.9293 321.0686 321.2080 321.3474 321.4867 321.6261 321.7654 321.9047 322.0440 322.1833 322.3226 322.4618 322.6011 322.7403 322.8795 323.0188 323.1580 323.2972 323.4363 323.5755 323.7147 323.8538 323.9930 324.1321 324.2712 324.4103 324.5494 324.6884 324.8275 324.9666 --------------------------------------------------------------------------------------- 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 20231021T144612.6Z 8694.615424 158 1 7.88 2 57.87 146.09 127.44 96.08 0.00 1 0.00 1 0 17 1.974e-02 7.523e-03 1.642e-02 5.890e-03 2.615022e-01 3.013262e-03 3.154969e-03 -6.000000e+00 1.150694e-02 225.46 -2.00 3.51 -2.00 317.01 0.00e+00 6.883987e-04 4.143319e-04 5.972660e-05 -6.000000e+00 5.160592e-04 283.77 -2.00 20.00 -2.00 316.27 0.00e+00 1.873 0.000 302.00 328.00 3 5.3183e+00 7.8859e-03 2.2979e-02 -6.0000e+00 2.8404e-02 5.0271e-02 8.8763e-03 1.3347e-02 -6.0000e+00 3.0870e-02 -3.2651e-03 5.2447e-03 6.5817e-03 -6.0000e+00 1.8442e-02 -2.9073e-04 2.5268e-03 1.9561e-03 -6.0000e+00 7.7967e-03 2.8566e-04 6.6861e-04 1.8066e-04 2.4297e-05 -6.0000e+00 5.8137e-04 -7.2413e-03 2.1512e-04 12 9 1 12 1 1 99.94 21.95 0.28 -0.00724 -0.00222 3 6 1 5 0 1968.540 26.94 19.99 21.95 20.91 34.8 989.76 -196 2214 -10303 -7292 -8708 9128 147 -2242 3375 -4948 1625 3389 3492 -2510 2510 -75 -1630 3225 -1860 -1573 1798 2190 -10 -733 2627 538 274 -980 2099 781 -622 2729 -1443 -2159 -1260 -587 -2000 184 -1512 -1473 -17 28 -671 -523 373 -589 678 -1922 -463 248 944 1863 2036 244 -595 1828 377 -541 41 -418 1356 1559 1372 534 250 1057 14 -1056 -298 702 -271 905 132 226 808 -275 -589 -222 -129 -646 -672 -2405 -1759 -1051 -1085 -839 37 -312 469 -228 461 -181 -199 -423 954 -273 2128 679 841 -328 -67 -112 -618 -356 -152 -1306 -548 -426 -396 728 770 364 336 -362 32 -683 -51 -344 30 -162 73 287 -311 1123 -541 695 704 -98 812 656 439 -463 204 90 221 -496 -146 482 -419 -152 -583 -44 -228 -25 297 -1571 -1002 -1104 944 18 -309 480 -792 244 526 608 -532 572 -19 -409 862 -504 -438 489 593 -3 -220 802 172 86 -295 625 235 -187 859 -505 -765 -423 -196 -743 78 -726 -809 -10 17 -424 -332 235 -372 415 -1179 -276 149 593 1238 1428 171 -432 1324 280 -402 30 -306 1012 1248 1187 460 212 882 11 -834 -251 614 -259 886 129 211 742 -230 -451 -174 -101 -564 -618 -2467 -1910 -1128 -1245 -1023 44 -386 573 -284 529 -190 -205 -430 1010 -304 2572 864 1118 -433 -83 -135 -720 -428 -195 -1700 -741 -603 -561 1081 1196 570 506 -512 44 -891 -66 -465 44 -234 107 416 -441 1585 -738 940 913 -129 1068 921 648 -674 302 139 358 -808 -244 813 -715 -252 -937 -71 -365 SS 20231021T145052.2Z 8694.618660 161 1 49.62 2 57.39 147.32 126.60 96.74 0.00 1 0.00 1 0 17 2.010e-02 8.134e-03 2.371e-02 6.329e-03 2.663290e-01 3.227259e-03 3.191854e-03 -6.000000e+00 1.171106e-02 225.46 -2.00 3.51 -2.00 317.85 0.00e+00 -9.374516e-05 5.407493e-04 1.522607e-04 -6.000000e+00 5.256911e-04 283.77 -2.00 20.00 -2.00 317.08 0.00e+00 1.849 0.000 302.00 328.00 3 6.2208e+00 8.5741e-03 2.2932e-02 -6.0000e+00 2.8906e-02 9.2793e-02 9.7208e-03 1.3563e-02 -6.0000e+00 3.1427e-02 -2.6953e-03 5.9729e-03 6.7090e-03 -6.0000e+00 1.8774e-02 -4.4936e-03 2.9747e-03 1.9049e-03 -6.0000e+00 7.9284e-03 1.1571e-04 -1.1631e-04 1.9820e-04 2.3516e-05 -6.0000e+00 5.9253e-04 -5.1899e-03 1.0808e-05 11 8 0 10 0 0 99.96 21.95 -0.02 -0.00519 -0.00606 27 6 1 5 0 1837.360 27.05 19.98 21.95 21.16 34.9 991.64 3957 -11057 -2040 1653 5176 625 -165 2270 -3231 -2545 -3922 4756 -2103 2570 3273 -11 -1884 1908 3613 -3526 1335 1403 2393 -2771 392 4793 -2879 5331 -2704 -494 -4552 3862 2413 -3024 -28 -5022 -114 -3063 -471 -1170 -1766 934 -1208 596 -1615 -84 -155 -1413 -1303 801 709 1420 1072 -693 -459 2091 1470 1071 -852 1972 634 2027 2949 1339 445 -131 -740 -978 833 -1076 502 125 1321 -252 990 -947 -2497 -804 -1768 -794 -1238 -1271 -1529 -1394 190 -711 435 579 764 -422 47 -263 -921 -535 206 -69 1312 1154 858 429 -177 -998 -1470 -726 -918 60 -830 -428 -246 1239 633 982 608 -408 -843 -747 -342 -259 -153 -475 162 -367 319 560 453 496 544 831 -495 139 -492 -292 114 -102 414 46 384 -502 638 -61 -277 -271 -465 352 -1223 -206 149 410 51 -15 218 -359 -291 -456 533 -283 378 539 -2 -369 374 721 -778 284 298 518 -667 96 1154 -733 1176 -612 -109 -1110 936 632 -838 -7 -1361 -33 -1054 -188 -536 -882 474 -640 311 -860 -44 -79 -711 -646 395 370 784 628 -432 -294 1331 952 690 -550 1238 418 1415 2198 1061 350 -96 -513 -674 606 -890 442 114 1181 -219 785 -690 -1686 -564 -1321 -603 -1054 -1185 -1522 -1460 209 -841 534 727 950 -509 52 -267 -871 -495 201 -74 1540 1484 1157 569 -221 -1162 -1652 -838 -1137 77 -1134 -610 -369 1940 1041 1618 966 -610 -1166 -979 -446 -352 -221 -726 250 -563 472 791 664 690 727 1117 -715 213 -729 -443 177 -165 701 81 699 -938 1177 -110 -485 -457 -773 SS 20231021T145533.2Z 8694.621912 164 1 4.41 2 56.92 148.57 125.76 97.39 0.00 1 0.00 1 0 17 2.100e-02 9.730e-03 1.708e-02 7.414e-03 2.561389e-01 3.817001e-03 3.131391e-03 -6.000000e+00 1.223599e-02 225.46 -2.00 3.51 -2.00 316.50 0.00e+00 7.355215e-04 4.611481e-04 5.977497e-05 -6.000000e+00 5.493044e-04 283.77 -2.00 20.00 -2.00 315.78 0.00e+00 1.826 0.000 302.00 328.00 3 5.0274e+00 9.8977e-03 2.2458e-02 -6.0000e+00 3.0202e-02 5.2680e-02 1.1107e-02 1.3117e-02 -6.0000e+00 3.2836e-02 -6.0772e-03 6.4581e-03 6.4693e-03 -6.0000e+00 1.9616e-02 -3.9383e-04 3.0336e-03 1.9069e-03 -6.0000e+00 8.2838e-03 4.0414e-04 -1.4350e-04 2.2537e-04 2.4499e-05 -6.0000e+00 6.1915e-04 -5.9361e-03 -2.8958e-05 12 9 9 12 1 1 999.00 21.93 0.29 -0.00594 -0.00701 1 5 1 5 0 2203.140 26.94 20.00 21.93 21.45 34.9 993.49 4946 3716 -9006 -3957 143 6173 -4921 -2322 2102 -7456 7217 560 -1214 -5136 1128 -4235 2292 2680 222 1709 -2409 2147 -1243 4604 -1087 3084 897 -1210 4841 -1072 2556 2948 1355 -4781 -2959 630 -1730 483 -3323 618 -2021 -950 -62 -1562 -1857 275 739 -663 1435 -467 -462 12 -334 1649 1341 1177 709 1816 60 -72 1024 1145 1007 1106 1057 -724 2173 -135 1002 266 622 810 -56 -758 -1649 1169 -1077 -381 -269 55 -966 -2539 -2325 -2140 186 411 -975 -177 -71 1051 -119 593 -1601 1322 876 308 1599 252 -36 -409 -241 -742 266 170 -1395 428 -1390 -42 -397 590 669 -178 -586 648 -150 -273 220 -614 98 113 -552 -326 773 712 -79 943 585 616 870 223 824 -16 564 -118 629 -881 -29 80 -646 398 -513 547 -1487 767 624 -1713 -662 21 831 -791 -406 382 -1538 1288 112 -279 -1305 303 -1301 689 833 73 572 -848 722 -443 1629 -398 1188 346 -449 1605 -376 919 1140 529 -1989 -1153 255 -736 236 -1872 382 -1306 -634 -42 -1080 -1285 185 485 -431 900 -303 -316 9 -243 1227 1029 922 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