File name: Pandora64s1_NewHavenCT_20240930_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20241001T045158.3Z 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 v1.8.60 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240930_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: 20240930 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 20240930T131707.2Z 9039.553556 177 1 7.40 2 64.20 120.36 42.78 133.15 0.00 1 0.00 1 0 17 1.286e-02 7.840e-03 1.911e-03 6.679e-04 2.947226e-01 3.554201e-04 3.563259e-03 -6.000000e+00 7.762873e-03 227.46 -2.00 3.52 -2.00 317.05 0.00e+00 4.591929e-04 4.907212e-05 1.344834e-04 -6.000000e+00 3.471808e-04 285.73 -2.00 20.00 -2.00 316.29 0.00e+00 2.283 0.000 302.00 328.00 3 1.0311e+00 9.3185e-04 2.7432e-02 -6.0000e+00 1.9246e-02 3.6025e-03 1.0434e-03 1.5223e-02 -6.0000e+00 2.0806e-02 -1.3833e-03 6.1867e-04 7.4675e-03 -6.0000e+00 1.2419e-02 -3.7094e-03 2.9975e-04 2.1015e-03 -6.0000e+00 5.2950e-03 1.3565e-02 -2.8910e-04 2.0665e-05 2.6299e-05 -6.0000e+00 3.8248e-04 4.3060e-04 -2.8097e-05 12 9 1 12 1 1 97.86 21.47 0.22 0.00043 -0.00174 130 206 1 5 0 56.420 25.90 20.00 21.47 22.88 40.2 1007.45 340 -1681 104 -4705 -5558 -3205 -1189 -1273 427 -1558 -4185 -2879 36 -790 1491 227 -351 630 757 1271 909 -835 798 421 511 825 243 -1268 -963 -118 1556 93 2529 -809 -4899 -2600 -1793 -1083 518 59 -1005 -722 -55 -722 -221 225 -344 -132 -504 -60 1250 815 922 1672 235 998 1098 756 109 403 636 1428 1262 2358 385 -1235 -453 -1510 783 1584 337 471 -202 537 -62 -857 -1108 -2105 -685 -296 -1281 -732 -2115 -1892 -555 -393 74 258 901 404 363 288 -906 -21 793 356 -36 1182 641 -455 -510 -1556 -1732 316 308 -1377 -245 -771 -220 388 823 393 292 178 -228 -172 488 -299 673 373 -66 -203 772 45 1059 740 -853 579 1071 394 441 -533 -684 -394 419 -202 -409 418 138 -471 39 -744 41 -218 13 -575 -635 -364 -144 -172 62 -238 -604 -449 6 -159 333 56 -90 156 194 337 243 -228 225 126 159 263 76 -378 -277 -35 489 32 914 -298 -1780 -974 -697 -492 257 33 -573 -427 -33 -439 -134 136 -205 -78 -296 -37 803 526 628 1190 173 749 833 569 82 304 477 1148 1091 1997 320 -1025 -362 -1231 655 1462 317 452 -191 505 -54 -717 -872 -1665 -586 -269 -1239 -735 -2269 -2047 -639 -457 90 315 1079 480 398 307 -966 -21 878 417 -44 1517 844 -582 -639 -1919 -2101 384 400 -1812 -337 -1072 -311 579 1222 602 427 252 -316 -230 665 -413 987 548 -97 -293 1121 63 1456 977 -1109 778 1476 579 653 -815 -1042 -630 678 -340 -681 703 230 -792 63 -1223 SS 20240930T132053.4Z 9039.556173 180 1 3.93 2 63.59 121.16 42.29 134.29 0.00 1 0.00 1 0 17 1.424e-02 7.902e-03 4.366e-03 1.526e-03 2.892533e-01 8.146806e-04 3.491004e-03 -6.000000e+00 8.595750e-03 227.46 -2.00 3.52 -2.00 316.99 0.00e+00 5.561849e-04 1.108613e-04 1.172341e-04 -6.000000e+00 3.844128e-04 285.73 -2.00 20.00 -2.00 316.23 0.00e+00 2.235 0.000 302.00 328.00 3 2.0569e+00 2.1323e-03 2.6864e-02 -6.0000e+00 2.1311e-02 1.3625e-02 2.3857e-03 1.4917e-02 -6.0000e+00 2.3037e-02 2.5073e-04 1.4164e-03 7.3257e-03 -6.0000e+00 1.3751e-02 -4.3779e-03 6.8505e-04 2.0858e-03 -6.0000e+00 5.8636e-03 5.1062e-03 -6.8596e-05 4.7372e-05 2.5529e-05 -6.0000e+00 4.2348e-04 4.7017e-04 2.8967e-06 12 9 1 12 1 1 99.84 21.46 0.13 0.00047 -0.00005 26 80 1 5 0 145.260 25.90 20.00 21.46 23.21 40.0 1008.43 -198 -410 -1547 -3124 -9324 -3156 -3253 1112 195 -2057 -3755 -2753 -447 -304 633 -66 -1075 1373 186 1637 846 -914 1087 650 1352 1360 94 -1157 -811 -386 1570 807 2404 -517 -4342 -2760 -832 -1611 466 1 -830 -1026 86 -1115 -170 238 -865 -3 -356 -605 1239 1071 857 1349 515 670 1464 315 366 397 631 1552 1604 2263 893 -1463 -557 -1706 708 1382 293 236 -453 611 -224 -794 -888 -2101 -819 -403 -1303 -552 -1946 -2080 -370 -375 294 412 802 671 369 248 -835 206 724 222 16 1294 585 -483 -403 -1638 -1786 337 52 -1260 -348 -792 -223 384 755 383 74 174 -93 -369 582 -72 736 446 -65 -217 650 110 1022 644 -755 592 1126 204 438 -481 -580 -459 519 -127 -531 276 233 -476 21 -727 -24 -51 -197 -367 -1081 -350 -392 143 28 -307 -571 -454 -83 -64 139 -16 -269 354 50 453 237 -261 319 203 436 450 31 -359 -242 -118 512 283 836 -182 -1507 -995 -331 -710 239 1 -486 -627 54 -700 -106 147 -531 -2 -214 -377 814 705 597 983 386 486 1064 229 278 289 481 1268 1331 1948 749 -1233 -452 -1411 600 1292 279 230 -434 581 -197 -670 -704 -1675 -706 -369 -1267 -556 -2091 -2264 -426 -438 355 503 963 795 406 265 -847 211 802 260 19 1653 767 -616 -503 -2011 -2158 407 67 -1648 -477 -1094 -326 568 1156 581 107 244 -127 -490 783 -98 1065 647 -95 -323 933 150 1387 839 -1010 784 1591 296 638 -723 -900 -720 855 -210 -899 472 394 -784 34 -1171 SS 20240930T132442.7Z 9039.558827 183 1 48.34 2 62.98 121.98 41.80 135.48 0.00 1 0.00 1 0 17 1.226e-02 7.773e-03 6.925e-04 2.428e-04 2.837037e-01 1.293523e-04 3.422946e-03 -6.000000e+00 7.404309e-03 227.46 -2.00 3.52 -2.00 317.03 0.00e+00 4.142032e-04 1.783627e-05 1.242717e-04 -6.000000e+00 3.311107e-04 285.73 -2.00 20.00 -2.00 316.27 0.00e+00 2.189 0.000 302.00 328.00 3 9.6509e-01 3.3884e-04 2.6327e-02 -6.0000e+00 1.8357e-02 3.5657e-03 3.7940e-04 1.4637e-02 -6.0000e+00 1.9843e-02 1.1430e-03 2.2495e-04 7.1768e-03 -6.0000e+00 1.1845e-02 -5.2553e-03 1.0896e-04 2.0225e-03 -6.0000e+00 5.0515e-03 1.6145e-02 7.0594e-05 7.5501e-06 2.5346e-05 -6.0000e+00 3.6474e-04 2.0621e-05 2.5961e-05 11 8 0 10 0 0 99.98 21.45 0.19 0.00002 0.00055 1298 312 1 5 0 37.240 25.90 20.01 21.45 23.40 40.1 1009.83 494 -1216 -213 -4042 -5725 -2473 -1494 186 426 -907 -4168 -2042 -508 -390 744 596 -930 851 358 1610 698 -443 585 814 284 1037 229 -1274 -1161 -50 1430 66 2260 -495 -4767 -2500 -1766 -1015 309 196 -868 -843 -114 -753 -130 155 -519 -9 -599 -163 1302 821 900 1478 263 913 1187 628 233 404 668 1425 1388 2348 560 -1349 -337 -1563 753 1531 328 449 -155 524 31 -900 -985 -2110 -572 -416 -1182 -723 -2116 -1974 -458 -396 130 212 961 450 366 340 -749 19 842 298 -42 1204 591 -459 -490 -1637 -1772 239 374 -1338 -291 -762 -220 388 877 385 252 68 -288 -154 472 -195 620 445 -94 -258 616 14 976 784 -881 619 976 401 503 -541 -694 -344 497 -156 -438 373 151 -424 22 -781 61 -148 -28 -505 -674 -286 -186 25 58 -129 -613 -321 -90 -79 169 146 -240 228 92 425 187 -120 165 242 88 328 71 -377 -331 -14 442 22 802 -178 -1691 -915 -722 -450 161 108 -513 -518 -71 -475 -82 97 -319 -5 -362 -102 804 540 625 1073 197 656 860 453 167 292 506 1158 1143 1999 466 -1126 -270 -1277 629 1410 306 429 -145 492 27 -753 -773 -1664 -487 -375 -1127 -752 -2230 -2201 -517 -472 161 253 1179 523 413 354 -783 20 910 340 -53 1562 787 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