File name: Pandora64s1_NewHavenCT_20240517_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240518T045555.1Z 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_20240517_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: 20240517 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 20240517T115228.3Z 8903.494772 186 1 48.48 2 65.37 85.06 132.06 346.89 0.00 1 0.00 1 0 17 4.150e-02 8.308e-03 6.880e-03 1.256e-03 3.734177e-01 6.785413e-04 4.404533e-03 -6.000000e+00 2.543279e-02 231.28 -2.00 3.52 -2.00 318.08 0.00e+00 9.891037e-04 1.227444e-04 2.568460e-04 -6.000000e+00 1.111501e-03 283.69 -2.00 20.00 -2.00 317.35 0.00e+00 2.383 0.000 302.00 328.00 3 3.7750e+00 1.8298e-03 3.1089e-02 -6.0000e+00 6.3686e-02 4.1039e-02 2.0623e-03 1.9580e-02 -6.0000e+00 6.8648e-02 -7.4449e-03 1.3305e-03 9.5735e-03 -6.0000e+00 4.0795e-02 -3.0826e-03 6.7831e-04 2.7966e-03 -6.0000e+00 1.7249e-02 6.7433e-04 4.0436e-04 3.8734e-05 3.1339e-05 -6.0000e+00 1.2346e-03 -5.3841e-03 1.3533e-04 11 8 0 10 0 0 99.96 21.60 0.15 -0.00538 -0.00235 62 15 1 5 0 781.860 26.00 20.00 21.60 22.06 39.0 1023.03 -1144 -6741 123 -8838 -43636 -2363 -5727 -3263 -1940 -3168 -6680 -2979 -868 -1874 344 1865 -756 2932 -1101 3429 2737 2047 2120 2155 -486 829 -898 -1268 -1059 -2188 1275 928 2670 631 -4319 -2402 -1671 -1042 -157 173 -947 -450 -696 -1210 -517 492 -459 -49 -1238 -1060 1721 1481 1299 1135 288 1014 989 272 283 356 407 1148 1554 2470 1280 -1530 -321 -1455 700 1483 591 626 118 571 266 -1000 -537 -2229 -1070 -438 -1445 -1115 -1844 -2003 -383 -455 198 251 1110 660 433 432 -760 -314 893 272 -57 1118 727 -541 -434 -1749 -1999 196 325 -1391 -411 -640 -146 534 879 442 144 172 -345 -395 496 -81 631 687 -81 -340 517 74 977 629 -1147 524 949 254 366 -574 -706 -301 567 -153 -469 405 270 -447 133 -728 -58 -389 7 -491 -3197 -128 -348 -199 -128 -222 -493 -236 -79 -203 42 249 -110 438 -178 556 451 341 373 403 -90 157 -170 -248 -202 -443 255 203 630 152 -1038 -596 -465 -340 -56 71 -420 -208 -333 -584 -250 236 -220 -24 -604 -539 862 797 745 690 181 652 645 176 181 230 259 789 1152 1921 982 -1134 -230 -1073 560 1238 528 573 105 484 208 -759 -383 -1624 -852 -370 -1376 -1103 -1942 -2118 -429 -539 231 296 1281 761 463 454 -767 -324 945 323 -71 1449 971 -704 -554 -2094 -2334 238 420 -1813 -561 -922 -214 831 1366 687 217 252 -499 -555 705 -116 953 1071 -127 -520 762 110 1372 850 -1532 725 1417 388 565 -921 -1175 -503 997 -269 -842 732 483 -807 231 -1227 SS 20240517T125518.8Z 8903.538412 235 1 48.17 2 53.58 95.49 132.88 7.30 0.00 1 0.00 1 0 17 1.746e-02 8.513e-03 2.301e-03 1.012e-03 2.616550e-01 5.493159e-04 3.134593e-03 -6.000000e+00 1.070005e-02 231.29 -2.00 3.52 -2.00 316.46 0.00e+00 4.619777e-04 6.434580e-05 7.255517e-05 -6.000000e+00 4.676868e-04 283.70 -2.00 20.00 -2.00 315.76 0.00e+00 1.680 0.000 302.00 328.00 3 4.2763e+00 1.4373e-03 2.1816e-02 -6.0000e+00 2.6794e-02 3.4887e-02 1.5981e-03 1.3624e-02 -6.0000e+00 2.8885e-02 -4.1552e-03 9.2664e-04 6.6250e-03 -6.0000e+00 1.7165e-02 -2.7472e-03 4.3137e-04 1.8469e-03 -6.0000e+00 7.2550e-03 9.7058e-04 5.3384e-05 3.1274e-05 2.3359e-05 -6.0000e+00 5.1977e-04 -4.8461e-03 5.7586e-05 11 8 0 10 0 0 99.89 21.53 0.17 -0.00485 -0.00444 51 12 1 5 0 944.340 26.00 20.00 21.53 24.14 39.3 1033.42 399 -63 728 -1755 -15546 -532 -1469 -475 1668 -335 -4276 -1918 -299 -1117 1553 618 -541 1513 726 2090 1811 257 1521 932 852 786 530 -1322 -472 -1787 1923 -207 2512 -285 -4280 -2566 -1592 -1480 597 66 -608 -1257 203 -1187 -126 37 -405 0 -270 -941 1446 968 1169 1100 177 631 1325 581 493 484 310 1365 1203 2482 615 -1547 -616 -1555 437 1472 285 415 -298 552 36 -862 -861 -2268 -865 -184 -1361 -1045 -2057 -1832 -567 -265 172 261 997 562 269 535 -918 -73 726 443 -62 1382 643 -400 -482 -1497 -1886 308 471 -1406 -364 -526 -349 355 788 496 377 97 -440 -176 375 -151 620 582 8 -210 618 112 935 731 -966 440 1023 266 553 -575 -709 -446 531 -147 -364 419 275 -589 63 -825 65 -11 124 -278 -2602 -77 -232 -83 309 -65 -858 -405 -70 -280 426 184 -168 484 241 711 620 89 543 329 312 295 194 -495 -168 -654 728 -79 1009 -116 -1708 -1054 -726 -740 346 41 -404 -823 135 -796 -84 24 -276 0 -179 -642 973 693 878 867 135 492 1038 453 380 377 254 1190 1065 2260 548 -1368 -520 -1326 382 1415 279 416 -295 542 33 -750 -698 -1835 -749 -168 -1326 -1110 -2216 -2081 -655 -323 208 321 1254 669 310 567 -965 -77 781 525 -77 1781 851 -515 -609 -1779 -2206 375 588 -1858 -482 -728 -490 522 1196 743 538 133 -592 -228 494 -209 875 824 11 -307 871 151 1242 930 -1258 563 1389 368 798 -822 -1044 -687 827 -238 -581 677 441 -955 99 -1263 SS 20240517T130015.6Z 8903.541848 238 1 49.08 2 52.66 96.38 132.78 8.91 0.00 1 0.00 1 0 17 3.636e-02 1.140e-02 5.356e-03 2.158e-03 2.598244e-01 1.165673e-03 3.098294e-03 -6.000000e+00 2.229025e-02 231.29 -2.00 3.52 -2.00 316.69 0.00e+00 1.228293e-03 1.450043e-04 1.306658e-04 -6.000000e+00 9.739025e-04 283.70 -2.00 20.00 -2.00 315.98 0.00e+00 1.644 0.000 302.00 328.00 3 5.6752e+00 3.0642e-03 2.1481e-02 -6.0000e+00 5.5818e-02 6.4062e-02 3.4121e-03 1.3546e-02 -6.0000e+00 6.0158e-02 -1.5807e-02 1.9907e-03 6.5886e-03 -6.0000e+00 3.5750e-02 2.5384e-03 9.3816e-04 1.9939e-03 -6.0000e+00 1.5122e-02 2.4546e-04 8.4266e-04 6.6923e-05 2.2976e-05 -6.0000e+00 1.0811e-03 -5.9166e-03 2.2498e-04 12 8 8 10 0 0 99.98 21.54 0.05 -0.00592 0.00042 16 4 1 5 0 3067.110 26.00 20.00 21.54 24.32 39.2 1034.11 -1449 3187 4407 3695 -38316 2907 -1747 2383 2742 803 -4589 -515 -2613 893 828 3574 -1661 3039 -676 4170 2697 1140 2448 2903 1183 773 -313 -1089 -1617 -3780 541 783 2508 109 -3681 -686 -1680 -1185 513 57 -113 -733 186 -1762 482 -192 230 -565 -240 -1534 1937 724 1867 1198 739 -149 1789 -590 200 -130 390 1608 1552 2525 2095 -1673 -1060 -1580 756 1038 778 267 39 51 232 -1150 -592 -2960 -1153 -666 -1670 -744 -2225 -2217 47 -532 234 -18 1218 909 -7 535 -1583 -880 -131 760 -246 1721 952 -568 -887 -1420 -2160 176 443 -1371 -1056 547 -224 836 1107 599 438 179 -641 -631 313 -42 533 781 -122 333 850 353 918 485 -1161 787 788 140 89 -620 -797 -317 530 163 -307 379 412 -558 -343 -902 -214 471 647 523 -7159 381 -256 372 462 134 -800 -93 -546 205 214 967 -489 894 -202 1230 810 345 760 940 403 270 -108 -353 -532 -1294 181 277 939 41 -1359 -257 -709 -553 278 33 -70 -478 124 -1191 319 -127 148 -360 -150 -995 1295 495 1326 897 565 -117 1395 -465 155 -102 318 1338 1380 2223 1853 -1417 -858 -1284 660 963 766 271 39 49 210 -952 -473 -2384 -991 -611 -1639 -760 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