File name: Pandora55s1_QueensNY_20210413_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T182733.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210413_L1_smca1c11d20210101p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20210413 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210413T125057.1Z 7773.535383 150 1 6.24 2 62.29 102.29 73.30 89.03 0.00 1 0.00 1 0 25 1.633e-02 6.873e-03 1.094e-02 3.210e-03 3.305670e-01 1.673714e-03 3.976557e-03 -6.000000e+00 9.711481e-03 228.44 -2.00 3.51 -2.00 317.27 0.00e+00 -2.398122e-05 2.402020e-04 9.511336e-05 -6.000000e+00 4.241529e-04 280.15 -2.00 20.00 -2.00 316.59 0.00e+00 2.139 0.000 302.00 328.00 3 3.3994e+00 4.4162e-03 2.7472e-02 -6.0000e+00 2.4166e-02 2.9621e-02 4.9525e-03 1.7052e-02 -6.0000e+00 2.6182e-02 -1.2629e-03 2.9812e-03 8.3817e-03 -6.0000e+00 1.5580e-02 -3.8740e-03 1.4589e-03 2.3369e-03 -6.0000e+00 6.5213e-03 1.3424e-03 -4.8047e-04 9.8113e-05 2.9651e-05 -6.0000e+00 4.8730e-04 -2.3092e-03 4.7408e-06 12 9 1 12 1 1 91.97 22.75 0.17 -0.00231 -0.00592 5 9 1 5 0 1011.630 25.68 20.00 22.75 15.32 27.9 1071.08 -3013 -1486 3001 -10905 -2864 2281 -4341 5544 1416 -3228 -2827 -2699 243 -119 2294 -1401 -2938 -1757 3218 354 3319 -1024 1495 -1123 -789 -705 13 -597 649 -1150 -305 1171 2545 -1852 -1455 3176 -642 -321 1709 -200 -998 -613 -1282 -1316 -1451 -488 -1403 1296 -654 913 213 571 469 122 1647 916 1564 698 609 816 1439 1154 900 -130 -677 -892 395 1036 1434 1163 -234 201 14 -809 -404 -674 407 1240 917 -287 -269 -1080 -1051 -1147 -1226 -1152 -500 -616 -812 -672 39 23 375 1200 1133 1294 832 1054 -480 -938 -706 -266 38 515 497 -616 -533 -275 -190 251 -139 -560 -38 68 255 201 563 1025 471 -53 -369 -743 -295 -411 406 3 458 1409 928 508 639 -209 638 124 -7 -336 -79 -20 -201 -902 -148 -5 -178 45 -274 -149 303 -1228 -282 203 -418 536 158 -401 -361 -354 34 -19 405 -284 -644 -401 733 86 805 -261 377 -299 -221 -207 4 -174 180 -316 -85 346 805 -634 -497 1023 -217 -119 709 -95 -523 -339 -735 -768 -852 -285 -823 740 -376 521 125 350 302 82 1136 648 1126 508 442 586 1033 852 700 -107 -578 -759 321 813 1127 968 -210 188 13 -775 -375 -600 338 976 715 -235 -237 -1029 -1060 -1205 -1334 -1300 -584 -742 -992 -818 46 26 406 1242 1169 1384 948 1277 -620 -1252 -935 -339 46 610 598 -773 -692 -367 -260 354 -204 -850 -58 102 371 281 764 1381 651 -76 -545 -1114 -438 -603 581 4 622 1858 1230 698 916 -311 965 191 -12 -545 -132 -34 -344 -1558 -252 -8 -290 73 SS 20210413T125715.1Z 7773.539759 153 1 50.28 2 61.12 103.46 72.12 90.01 0.00 1 0.00 1 0 25 1.152e-02 6.525e-03 2.252e-03 7.219e-04 3.186194e-01 3.766932e-04 3.834353e-03 -6.000000e+00 6.851326e-03 228.44 -2.00 3.51 -2.00 317.12 0.00e+00 -1.276104e-04 5.191296e-05 1.085864e-04 -6.000000e+00 2.991934e-04 280.15 -2.00 20.00 -2.00 316.44 0.00e+00 2.061 0.000 302.00 328.00 3 2.8098e+00 9.9135e-04 2.6459e-02 -6.0000e+00 1.7049e-02 2.5858e-02 1.1106e-03 1.6412e-02 -6.0000e+00 1.8469e-02 -3.0932e-03 6.6219e-04 8.0663e-03 -6.0000e+00 1.0991e-02 -1.9069e-03 3.2072e-04 2.2495e-03 -6.0000e+00 4.6015e-03 2.6672e-03 -1.1827e-04 2.2083e-05 2.8781e-05 -6.0000e+00 3.4367e-04 -2.1969e-03 7.3239e-05 11 8 0 10 0 0 99.97 22.75 0.18 -0.00220 -0.00309 122 23 1 5 0 412.000 25.68 20.00 22.75 15.58 27.8 1072.52 -3388 -1522 -47 -6233 -3492 1063 -1884 3300 -862 -698 -2909 818 -798 422 1414 -1029 -1806 -2150 1828 386 -108 826 1848 698 377 -529 618 -663 193 1177 826 1766 1041 -1707 -1252 1294 243 108 451 -506 -1663 -1216 -1365 -1069 -754 -488 -849 -386 -593 648 546 551 596 919 980 691 1016 433 850 995 1503 1446 1218 180 -553 -344 341 250 1644 942 -53 -432 -584 -629 -655 -205 318 911 1347 337 -49 -613 -1448 -1132 -1150 -1137 -868 -507 -607 -681 -201 253 450 1407 1481 1317 952 820 -359 -567 -431 -543 13 846 100 -826 -468 -623 -145 -35 -124 -420 -305 -169 -48 513 863 834 602 -164 -706 -548 -256 -165 151 226 503 1257 1022 471 697 61 303 143 283 -167 -220 80 -421 -406 -240 -271 -269 9 -346 -171 -5 -751 -385 107 -198 361 -109 -94 -410 115 -123 72 273 -224 -423 -527 451 100 -29 220 495 195 111 -164 193 -205 57 336 241 545 349 -609 -445 441 85 42 196 -250 -906 -698 -809 -642 -453 -294 -510 -229 -350 379 327 345 392 627 692 498 747 321 628 726 1098 1084 962 150 -477 -296 281 199 1304 793 -48 -410 -566 -607 -614 -183 266 724 1057 276 -44 -585 -1469 -1193 -1254 -1288 -1019 -613 -744 -833 -239 289 487 1457 1524 1410 1084 995 -463 -753 -570 -692 16 999 120 -1038 -607 -832 -198 -49 -181 -636 -465 -254 -70 713 1161 1118 826 -234 -1041 -818 -380 -240 216 314 678 1649 1349 644 992 89 455 218 441 -269 -364 135 -718 -694 -406 -449 -436 14 SS 20210413T131008.9Z 7773.548714 164 1 15.80 2 58.76 105.93 69.71 92.03 0.00 1 0.00 1 0 25 9.535e-03 6.495e-03 1.408e-03 5.713e-04 2.956826e-01 2.991852e-04 3.575101e-03 -6.000000e+00 5.671170e-03 228.44 -2.00 3.51 -2.00 316.65 0.00e+00 -9.979698e-05 3.640375e-05 7.660114e-05 -6.000000e+00 2.476476e-04 280.15 -2.00 20.00 -2.00 315.99 0.00e+00 1.921 0.000 302.00 328.00 3 1.3922e+00 7.8101e-04 2.4603e-02 -6.0000e+00 1.4112e-02 1.5919e-02 8.7230e-04 1.5201e-02 -6.0000e+00 1.5288e-02 -3.9932e-03 5.0920e-04 7.4695e-03 -6.0000e+00 9.0974e-03 -1.0536e-03 2.3917e-04 2.0826e-03 -6.0000e+00 3.8091e-03 1.3161e-02 -1.3378e-04 1.7501e-05 2.7656e-05 -6.0000e+00 2.8446e-04 -3.3648e-03 4.1899e-05 12 9 1 12 9 1 99.95 22.74 0.18 -0.00336 -0.00437 149 92 1 5 0 104.090 25.68 20.00 22.74 16.06 27.9 1075.82 -1285 -2744 -2952 -4712 -2185 -1769 -349 37 553 -1026 -765 579 487 581 -10 -438 -977 146 317 548 -435 1191 1356 890 445 -61 130 -864 797 1417 1200 1584 1809 -1215 -805 276 254 334 400 -598 -1310 -1059 -1260 -986 -916 -493 -886 -737 -587 378 630 494 978 693 756 605 920 266 598 842 1449 1384 1127 517 -763 -111 137 546 1164 1014 94 -343 -775 -611 -662 -224 396 725 1518 367 46 -764 -1503 -1247 -1160 -1184 -839 -557 -567 -643 -242 295 453 1302 1523 1353 1011 753 -289 -510 -434 -556 32 772 51 -760 -386 -724 -135 -50 -139 -362 -250 -118 -122 579 817 787 597 -53 -647 -429 -291 -298 219 215 496 1435 1016 429 565 -10 227 187 248 -204 -163 144 -405 -503 -265 -230 -278 12 -175 -426 -481 -763 -318 -240 -47 6 92 -187 -142 109 92 126 -2 -115 -278 43 97 175 -144 392 450 289 154 -22 49 -315 271 492 398 564 700 -482 -316 110 104 144 194 -327 -776 -676 -800 -638 -596 -319 -572 -467 -383 244 396 330 698 501 572 452 702 207 459 635 1092 1087 917 457 -685 -98 117 458 974 884 88 -336 -757 -613 -636 -206 341 596 1209 314 41 -735 -1540 -1312 -1290 -1355 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