File name: Pandora64s1_NewHavenCT_20240520_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240521T045712.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240520_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240520 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240520T132543.5Z 8906.559531 287 1 46.59 2 47.56 100.48 146.80 330.83 0.00 1 0.00 1 0 17 1.551e-02 1.028e-02 5.544e-03 2.700e-03 2.247624e-01 1.467240e-03 2.688752e-03 -6.000000e+00 9.509862e-03 231.46 -2.00 3.52 -2.00 316.19 0.00e+00 6.847164e-04 1.605586e-04 1.378487e-04 -6.000000e+00 4.158843e-04 284.00 -2.00 20.00 -2.00 315.49 0.00e+00 1.479 0.000 302.00 328.00 3 6.2028e+00 3.8286e-03 1.8987e-02 -6.0000e+00 2.3822e-02 8.9256e-02 4.2484e-03 1.1653e-02 -6.0000e+00 2.5674e-02 -1.2770e-02 2.4502e-03 5.6597e-03 -6.0000e+00 1.5258e-02 -2.7922e-03 1.1238e-03 1.5867e-03 -6.0000e+00 6.4497e-03 1.8068e-04 1.3482e-04 8.3780e-05 2.0083e-05 -6.0000e+00 4.6146e-04 -5.0436e-03 1.1703e-04 12 8 8 10 0 0 99.90 21.55 0.20 -0.00504 -0.00403 13 3 1 5 0 3583.180 26.00 20.00 21.55 23.59 39.1 1030.55 57 -2510 -994 -6343 1365 -498 -1135 -165 4235 1046 -5753 841 -1635 -1883 1920 253 -974 2177 -591 3506 2049 829 1582 1742 -641 270 -361 34 -1249 -4445 212 660 2535 294 -4921 -2782 -1441 -1162 -64 1065 -690 -425 -139 -1044 -352 15 -1199 -60 -724 -3323 1330 1968 2420 1248 1226 -5 1529 -189 813 54 491 1839 1632 2636 812 -1772 -942 -1418 376 1180 1148 554 -301 696 45 -1527 -558 -2285 -1681 -534 -1651 -1180 -1674 -1816 142 -349 688 306 1111 582 259 -103 -1677 -1328 -55 981 -402 1297 1100 -700 -614 -1202 -2336 -170 174 -2002 -17 601 53 835 1482 648 292 109 -496 -899 251 -548 250 864 149 271 602 419 1033 739 -1784 397 667 -106 427 -1016 -819 -123 762 325 -227 540 442 -596 -283 -965 11 -504 -207 -1260 229 -85 -209 -33 883 230 -1330 194 -410 -531 582 83 -331 748 -214 1259 749 304 597 685 -266 114 -148 13 -457 -1692 82 266 1074 125 -2066 -1191 -679 -605 -39 684 -478 -304 -101 -765 -256 11 -843 -40 -485 -2322 941 1458 1866 971 966 -4 1235 -154 644 44 413 1634 1476 2445 733 -1574 -793 -1192 340 1123 1155 574 -308 674 42 -1309 -460 -1871 -1407 -492 -1620 -1256 -1799 -2060 163 -426 868 393 1397 694 298 -109 -1743 -1381 -60 1119 -488 1682 1457 -907 -746 -1429 -2756 -209 219 -2675 -22 823 77 1215 2207 955 426 147 -649 -1137 320 -737 343 1234 216 384 827 568 1331 949 -2259 509 869 -146 586 -1437 -1184 -185 1157 513 -368 852 718 -949 -437 -1455 SS 20240520T133532.7Z 8906.566351 290 1 48.23 2 45.75 102.45 147.65 334.82 0.00 1 0.00 1 0 17 2.274e-02 1.040e-02 3.467e-03 1.857e-03 2.108125e-01 1.009416e-03 2.542041e-03 -6.000000e+00 1.394561e-02 231.46 -2.00 3.52 -2.00 315.92 0.00e+00 7.480968e-04 1.040645e-04 7.033052e-05 -6.000000e+00 6.098392e-04 284.00 -2.00 20.00 -2.00 315.24 0.00e+00 1.431 0.000 302.00 328.00 3 5.6641e+00 2.6276e-03 1.8179e-02 -6.0000e+00 3.4933e-02 6.2359e-02 2.9119e-03 1.1011e-02 -6.0000e+00 3.7648e-02 -9.5499e-03 1.6707e-03 5.3405e-03 -6.0000e+00 2.2373e-02 -2.4397e-04 7.5655e-04 1.5284e-03 -6.0000e+00 9.4590e-03 3.3684e-04 3.0284e-04 5.7373e-05 1.9268e-05 -6.0000e+00 6.7655e-04 -5.3358e-03 1.3706e-04 12 8 8 10 0 0 99.97 21.55 -0.08 -0.00534 -0.00306 24 6 1 5 0 2009.380 26.00 19.97 21.55 24.25 38.9 1033.63 360 1329 2997 -621 -22140 -1017 -2202 1559 2205 561 -3164 -1039 -105 621 1376 1412 -636 1816 1403 2961 2089 1060 2540 1546 232 1331 -79 -1907 -556 -2424 964 -274 2045 -38 -3887 -3031 -1650 -1500 284 234 -875 -872 163 -1600 -422 75 154 -115 -525 -1890 1749 970 1520 1251 814 295 1432 5 192 123 719 1043 1664 2196 1111 -1534 -778 -1494 538 1438 762 526 188 500 301 -1439 -898 -2449 -1432 -677 -1283 -1191 -1839 -2146 -196 -531 490 403 949 847 189 243 -1665 -471 550 733 -158 1360 949 -638 -665 -1625 -2132 164 72 -1413 -266 19 -146 722 1282 654 143 244 -508 -710 312 -268 468 882 106 -58 776 133 832 843 -1197 444 740 226 559 -672 -670 -481 743 -261 -438 348 521 -299 -80 -1171 81 306 677 -131 -5283 -196 -459 346 525 139 -794 -271 -30 199 463 505 -237 686 545 1170 834 424 1036 664 104 603 -35 -804 -219 -979 398 -120 935 -17 -1732 -1395 -795 -841 176 155 -624 -642 122 -1211 -315 55 109 -80 -375 -1327 1255 738 1201 992 657 244 1179 4 156 102 615 954 1539 2091 1021 -1380 -663 -1271 491 1386 782 533 195 494 285 -1252 -750 -2026 -1263 -631 -1271 -1235 -2010 -2482 -230 -640 609 510 1179 1030 221 260 -1755 -492 584 849 -194 1727 1232 -808 -822 -1895 -2551 197 89 -1848 -362 26 -208 1041 1892 952 205 334 -649 -909 403 -352 631 1240 152 -81 1089 178 1096 1058 -1474 555 979 305 779 -929 -948 -711 1110 -407 -677 544 807 -468 -121 -1747 SS 20240520T134455.7Z 8906.572867 293 1 24.49 2 44.04 104.41 148.35 338.77 0.00 1 0.00 1 0 17 1.147e-02 8.319e-03 1.178e-03 7.342e-04 1.997745e-01 4.015870e-04 2.414430e-03 -6.000000e+00 7.031957e-03 231.47 -2.00 3.52 -2.00 315.35 0.00e+00 4.033370e-04 3.679394e-05 3.266900e-05 -6.000000e+00 3.075370e-04 284.00 -2.00 20.00 -2.00 314.71 0.00e+00 1.389 0.000 302.00 328.00 3 3.4106e+00 1.0390e-03 1.7476e-02 -6.0000e+00 1.7615e-02 2.8048e-02 1.1477e-03 1.0414e-02 -6.0000e+00 1.8986e-02 -1.7313e-03 6.5671e-04 5.0553e-03 -6.0000e+00 1.1283e-02 -2.8949e-03 2.9135e-04 1.4092e-03 -6.0000e+00 4.7686e-03 3.4610e-03 7.1171e-05 2.2578e-05 1.9415e-05 -6.0000e+00 3.4136e-04 -5.2406e-03 5.4883e-05 12 9 1 12 1 1 99.96 21.55 0.12 -0.00524 -0.00471 80 39 1 5 0 302.210 26.00 20.01 21.55 25.10 38.9 1038.45 1186 -582 404 -2763 -5679 -1193 -415 862 1711 494 -2966 -1279 7 -91 1195 530 -873 1151 395 2030 1106 -277 733 1038 110 1109 277 -767 -838 26 1626 296 2081 254 -4510 -2288 -1811 -1007 233 180 -1158 -1200 -207 -1155 -385 188 -555 -100 -780 -411 1245 1096 845 1416 128 982 1211 671 221 304 683 1181 1285 2048 528 -1551 -417 -1852 604 1424 399 362 -166 497 304 -804 -814 -2073 -553 -305 -1169 -707 -1913 -2063 -393 -400 111 61 875 395 367 428 -835 -123 918 245 -54 1242 801 -391 -391 -1403 -1622 229 448 -1332 -311 -667 -333 296 869 351 171 84 -248 -128 481 -216 595 624 -100 -182 678 58 979 996 -808 506 986 426 503 -430 -769 -365 482 -187 -563 378 205 -544 -48 -754 319 -165 113 -778 -1503 -302 -112 253 497 148 -901 -405 3 -35 472 223 -380 510 181 944 520 -131 356 524 54 550 144 -373 -387 12 774 149 1100 134 -2337 -1210 -993 -599 161 132 -909 -920 -161 -901 -298 143 -435 -76 -583 -310 979 858 692 1205 112 865 1075 592 194 269 597 1101 1204 1967 516 -1417 -379 -1605 560 1379 413 384 -174 495 294 -709 -701 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