File name: Pandora64s1_NewHavenCT_20230926_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240123T150029.4Z 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_20230926_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: 20230926 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 20230926T173427.1Z 8669.732258 367 1 48.45 2 44.22 198.62 134.38 72.81 0.00 1 0.00 1 0 17 1.379e-02 8.741e-03 2.076e-03 1.277e-03 1.730996e-01 6.871880e-04 2.120876e-03 -6.000000e+00 8.350587e-03 228.00 -2.00 3.52 -2.00 315.42 0.00e+00 4.216613e-04 6.513999e-05 4.352244e-05 -6.000000e+00 3.734636e-04 286.32 -2.00 20.00 -2.00 314.74 0.00e+00 1.393 0.000 302.00 328.00 3 5.0981e+00 1.7676e-03 1.6554e-02 -6.0000e+00 2.0726e-02 3.0176e-02 1.9592e-03 8.9546e-03 -6.0000e+00 2.2386e-02 -1.4255e-03 1.1233e-03 4.3812e-03 -6.0000e+00 1.3361e-02 -2.7535e-03 5.0251e-04 1.2424e-03 -6.0000e+00 5.7007e-03 6.7889e-04 1.7922e-04 3.9513e-05 1.7131e-05 -6.0000e+00 4.1020e-04 -4.0665e-03 8.9308e-05 11 8 0 10 0 0 99.97 21.52 0.12 -0.00407 -0.00272 59 14 1 5 0 821.080 26.00 20.01 21.52 24.15 38.3 1014.69 1068 8 641 -1761 -10305 -1615 243 967 1652 917 -2847 -991 17 -234 1497 957 -760 1114 591 2078 1113 146 1539 1208 490 1125 597 -1114 -731 -741 1891 81 2342 -232 -4253 -2349 -1311 -1421 358 -218 -975 -1225 -210 -1580 -655 -304 -635 -372 -909 -1084 1640 1208 870 1316 121 661 1218 371 302 110 601 1232 974 2183 851 -1428 -288 -1255 829 1681 462 776 -100 669 60 -789 -600 -1986 -751 -232 -1188 -1024 -2158 -1958 -488 -204 100 191 1028 704 344 320 -1145 -397 554 513 -146 1148 608 -307 -646 -1378 -1791 234 150 -1399 -473 -389 -236 433 986 352 145 141 -363 -349 632 -141 482 325 -6 -86 590 145 1010 1009 -843 775 1058 379 414 -619 -602 -386 471 -221 -417 400 237 -616 -57 -772 303 2 187 -471 -2732 -392 62 269 492 280 -877 -315 6 -90 585 396 -325 483 263 939 508 67 716 587 247 573 296 -519 -321 -324 842 38 1146 -114 -2029 -1146 -706 -835 243 -157 -746 -969 -168 -1275 -522 -238 -481 -273 -652 -787 1224 949 714 1120 105 582 1076 327 263 97 522 1138 952 2171 814 -1274 -255 -1112 743 1655 462 791 -101 679 56 -713 -500 -1627 -652 -210 -1189 -1052 -2348 -2244 -565 -249 127 247 1300 842 400 341 -1205 -414 579 583 -173 1456 788 -386 -767 -1626 -2095 286 187 -1843 -619 -527 -334 609 1412 496 203 190 -456 -422 773 -182 634 450 -8 -118 788 193 1277 1279 -1045 974 1330 502 567 -826 -822 -550 704 -329 -635 617 364 -928 -83 -1159 SS 20230926T204003.8Z 8669.861155 488 1 48.12 2 68.44 247.54 100.99 103.11 0.00 1 0.00 1 0 17 3.354e-02 8.190e-03 5.721e-03 1.389e-03 3.229390e-01 7.417731e-04 3.893359e-03 -6.000000e+00 2.029443e-02 227.99 -2.00 3.52 -2.00 317.74 0.00e+00 5.781884e-04 1.225380e-04 2.305234e-04 -6.000000e+00 9.077786e-04 286.30 -2.00 20.00 -2.00 316.95 0.00e+00 2.696 0.000 302.00 328.00 3 3.8174e+00 1.9737e-03 3.1719e-02 -6.0000e+00 5.0368e-02 1.9515e-02 2.2224e-03 1.6828e-02 -6.0000e+00 5.4411e-02 -2.3208e-03 1.3786e-03 8.2371e-03 -6.0000e+00 3.2477e-02 -3.6132e-03 6.9243e-04 2.3158e-03 -6.0000e+00 1.3851e-02 5.3529e-04 -5.0072e-04 4.3295e-05 2.8026e-05 -6.0000e+00 9.9756e-04 -4.1902e-03 -3.5342e-05 11 8 0 10 0 0 89.05 21.67 0.11 -0.00419 -0.00795 39 9 1 5 0 1233.670 26.11 20.00 21.67 24.44 38.3 1015.72 -824 -1106 -758 -3175 -35283 -3211 -3170 -6692 2234 219 -5591 -2683 419 -2229 1760 148 -769 2147 626 2789 1863 545 2334 930 776 301 557 -1167 107 -2284 1953 672 1502 -506 -4316 -3234 -1561 -1223 4 -59 -585 -1094 205 -1640 -436 512 113 78 -604 -1021 1311 674 923 1308 492 879 1127 304 391 372 859 1296 1433 2402 1019 -1360 -273 -1101 878 1762 373 543 -205 552 -107 -991 -711 -1987 -934 -127 -1316 -1297 -1928 -1787 -444 -647 1 293 885 564 159 367 -851 -251 750 425 -79 1197 517 -351 -488 -1589 -2041 130 310 -1428 -374 -473 -173 450 1010 289 196 204 -156 -141 518 -172 418 550 -255 -131 664 80 1054 909 -827 589 1054 233 346 -507 -562 -458 517 -100 -500 241 242 -368 74 -761 -64 -83 -63 -248 -3234 -237 -254 -624 209 20 -543 -279 49 -309 268 25 -138 396 122 554 377 112 496 213 186 75 135 -272 24 -541 485 182 407 -139 -1167 -911 -487 -448 2 -27 -287 -564 108 -879 -232 270 59 41 -316 -556 753 388 561 838 325 595 771 207 263 254 613 935 1113 1945 812 -1035 -200 -823 713 1489 339 505 -188 479 -91 -770 -518 -1462 -747 -107 -1251 -1280 -2024 -1878 -496 -767 1 347 1082 654 171 386 -856 -257 827 494 -97 1586 673 -466 -611 -1962 -2474 155 397 -1938 -506 -672 -249 687 1531 438 298 290 -218 -191 711 -249 613 837 -391 -196 963 116 1457 1265 -1136 797 1530 347 541 -782 -897 -768 875 -177 -903 422 438 -645 124 -1312 SS 20230926T204522.5Z 8669.864844 491 1 48.36 2 69.37 248.56 100.05 103.90 0.00 1 0.00 1 0 25 1.480e-02 7.035e-03 2.524e-03 5.149e-04 3.363293e-01 2.748081e-04 4.038938e-03 -6.000000e+00 8.952929e-03 227.98 -2.00 3.52 -2.00 318.06 0.00e+00 3.638932e-04 4.979209e-05 1.769915e-04 -6.000000e+00 4.004722e-04 286.30 -2.00 20.00 -2.00 317.28 0.00e+00 2.809 0.000 302.00 328.00 3 1.6824e+00 7.3525e-04 3.3055e-02 -6.0000e+00 2.2220e-02 5.9646e-03 8.3039e-04 1.7552e-02 -6.0000e+00 2.4004e-02 3.4719e-03 5.2899e-04 8.5878e-03 -6.0000e+00 1.4327e-02 -6.9095e-03 2.7018e-04 2.4084e-03 -6.0000e+00 6.1101e-03 4.0101e-03 -4.2121e-04 1.6060e-05 2.8651e-05 -6.0000e+00 4.4008e-04 -3.6250e-03 -1.6540e-05 11 8 0 10 0 0 97.02 21.65 0.17 -0.00362 -0.00679 523 126 1 5 0 92.460 26.11 20.00 21.65 24.40 38.3 1015.52 347 -1293 -193 -4200 -11211 -2563 -2645 -90 -388 -19 -3913 -1037 -323 208 591 1088 -1189 964 -309 1573 448 -513 592 913 128 849 -119 -1721 -1182 -704 1192 -177 1670 -725 -4972 -2824 -1688 -1355 140 -104 -1032 -1108 -340 -891 -432 28 -570 -214 -582 -484 1219 1213 759 1336 247 951 1110 547 237 397 671 1262 1381 2283 782 -1246 -130 -1304 688 1584 366 616 -55 544 65 -785 -746 -1889 -494 -315 -1099 -805 -1888 -1927 -378 -408 297 215 958 516 356 420 -652 1 806 323 -165 1117 584 -361 -448 -1493 -1748 228 363 -1432 -299 -767 -277 332 731 318 171 123 -187 -147 436 -198 492 301 -191 -314 593 72 904 784 -955 449 931 312 435 -536 -604 -299 429 -71 -448 311 284 -430 88 -595 21 -86 -13 -270 -718 -154 -173 -6 -31 -2 -339 -97 -35 24 77 155 -182 153 -52 270 79 -91 110 181 27 182 -25 -351 -233 -144 262 -43 432 -192 -1301 -763 -470 -444 54 -42 -457 -513 -162 -427 -207 13 -270 -101 -276 -238 639 681 454 785 150 592 700 344 147 250 442 898 994 1716 580 -941 -95 -975 525 1337 313 538 -47 470 52 -610 -546 -1397 -372 -268 -988 -795 -1883 -2036 -424 -459 347 255 1113 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