File name: Pandora64s1_NewHavenCT_20240724_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240725T050422.7Z 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_20240724_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: 20240724 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 20240724T175224.3Z 8971.744726 474 1 48.62 2 24.54 212.10 136.56 312.95 0.00 1 0.00 1 0 17 1.241e-02 8.406e-03 1.864e-03 1.210e-03 1.658551e-01 6.624036e-04 1.998417e-03 -6.000000e+00 7.630118e-03 232.60 -2.00 3.52 -2.00 315.21 0.00e+00 4.405519e-04 6.036343e-05 4.275903e-05 -6.000000e+00 3.405293e-04 289.56 -2.00 20.00 -2.00 314.51 0.00e+00 1.099 0.000 302.00 328.00 3 5.2424e+00 1.7156e-03 1.4131e-02 -6.0000e+00 1.9129e-02 3.3982e-02 1.8940e-03 8.6847e-03 -6.0000e+00 2.0594e-02 -6.4371e-04 1.0816e-03 4.1962e-03 -6.0000e+00 1.2269e-02 -3.0728e-03 4.7579e-04 1.1623e-03 -6.0000e+00 5.1894e-03 7.8711e-04 4.5359e-04 3.7282e-05 1.6129e-05 -6.0000e+00 3.6967e-04 8.1725e-03 3.5568e-05 11 9 0 11 8 0 99.99 21.71 0.25 0.00817 0.01158 74 18 1 5 0 656.860 26.11 20.02 21.71 34.40 40.7 1073.59 1725 -1112 1306 -3604 -7526 -1347 496 -17 2454 -848 -2479 -470 150 -491 1885 256 -374 1087 600 2147 1180 -55 1615 807 505 1148 54 -1151 -512 -220 1698 191 2471 -740 -4196 -1745 -1239 -881 221 -145 -1042 -781 -471 -1382 -540 -86 -712 -251 -1087 -374 1166 1083 942 1251 121 753 913 535 282 715 691 1333 1152 2031 234 -1101 -491 -1349 850 1448 282 522 -154 759 -237 -865 -783 -2083 -722 -594 -1316 -852 -2189 -1579 -400 -165 311 292 1101 335 462 -40 -1107 -219 760 387 -35 1129 517 -606 -447 -1545 -1604 261 43 -1225 -170 -454 14 494 1191 178 371 -23 -307 -270 291 -334 550 437 184 -120 747 -91 1165 496 -662 582 842 88 452 -715 -618 -306 648 59 -340 362 88 -453 -46 -960 521 -354 398 -1026 -2203 -373 145 -5 769 -276 -799 -157 55 -200 824 119 -177 523 276 1002 553 -26 775 406 261 599 27 -583 -244 -104 827 98 1313 -390 -2158 -923 -681 -563 153 -112 -804 -619 -379 -1112 -429 -71 -570 -193 -823 -285 925 898 767 1053 104 654 796 462 242 620 628 1287 1108 1976 230 -1002 -423 -1167 793 1479 290 546 -159 741 -226 -750 -666 -1756 -648 -555 -1355 -891 -2421 -1839 -470 -205 399 379 1396 401 537 -43 -1169 -231 801 446 -42 1435 665 -754 -522 -1812 -1876 305 54 -1611 -221 -612 20 720 1674 258 504 -31 -377 -320 352 -428 714 593 253 -162 1023 -118 1437 618 -805 722 1042 115 605 -977 -821 -424 942 89 -502 540 130 -655 -69 -1394 SS 20240724T180825.9Z 8971.755855 486 1 48.72 2 26.31 219.87 138.51 317.78 0.00 1 0.00 1 0 17 1.276e-02 1.027e-02 3.384e-03 2.141e-03 1.794056e-01 1.172113e-03 2.181380e-03 -6.000000e+00 7.843216e-03 232.60 -2.00 3.52 -2.00 315.30 0.00e+00 5.563468e-04 1.085354e-04 1.168352e-04 -6.000000e+00 3.501308e-04 289.56 -2.00 20.00 -2.00 314.58 0.00e+00 1.115 0.000 302.00 328.00 3 6.3099e+00 3.0367e-03 1.4730e-02 -6.0000e+00 1.9663e-02 5.7753e-02 3.3556e-03 9.3764e-03 -6.0000e+00 2.1171e-02 -8.2939e-03 1.9175e-03 4.5348e-03 -6.0000e+00 1.2612e-02 1.0706e-03 8.4551e-04 1.2411e-03 -6.0000e+00 5.3332e-03 2.5657e-04 1.4753e-04 6.6072e-05 1.7776e-05 -6.0000e+00 3.8013e-04 8.9149e-03 -2.9584e-06 12 8 8 10 0 0 99.83 21.71 -0.06 0.00891 0.01002 15 4 1 5 0 3247.240 26.11 20.02 21.71 35.25 40.7 1078.42 23 238 485 -2284 -2977 -1447 -1686 160 1971 -721 -3635 -817 -1134 -629 2081 978 8 2028 -190 949 2042 545 1801 1059 1174 1733 141 -1987 -1744 -2227 1417 -1754 1885 -546 -3685 -2290 -2626 -1183 282 -16 -166 -579 87 -275 -463 -598 -441 -637 -648 -2418 1373 599 1640 1030 425 604 834 65 533 -6 1014 1299 1944 2777 993 -1342 -977 -1533 1119 1656 1005 473 312 562 -521 -1530 -1558 -2991 -1542 -873 -1989 -754 -1828 -1064 -117 365 432 893 1417 597 -24 214 -2439 -753 -115 579 -268 1566 410 -426 -1062 -2064 -2231 82 -353 -1055 -315 152 212 991 1554 821 243 -53 -678 -623 -194 -434 360 648 243 515 791 162 1207 -112 -1535 691 786 123 756 -704 -803 -112 578 -106 219 567 395 -622 -229 -1311 7 70 147 -634 -764 -368 -461 47 613 -232 -1173 -273 -398 -243 862 428 4 922 -90 436 970 261 883 516 587 873 69 -969 -805 -1037 667 -886 974 -278 -1825 -1179 -1442 -747 196 -12 -129 -465 71 -222 -374 -475 -338 -474 -492 -1813 1048 481 1361 892 373 539 746 58 468 -5 901 1230 1928 2791 954 -1207 -873 -1374 1029 1669 1029 496 321 573 -492 -1374 -1296 -2473 -1360 -809 -2041 -793 -2027 -1191 -139 440 541 1127 1751 725 -27 228 -2586 -791 -123 670 -328 1949 520 -542 -1278 -2355 -2641 98 -452 -1355 -422 201 295 1431 2276 1176 330 -69 -855 -760 -241 -547 484 906 331 712 1059 206 1513 -135 -1889 827 992 163 990 -945 -1105 -154 838 -159 324 848 587 -939 -337 -1891 SS 20240724T181244.1Z 8971.758844 489 1 18.83 2 26.84 221.80 139.01 319.13 0.00 1 0.00 1 0 17 1.073e-02 8.007e-03 1.557e-03 1.119e-03 1.638150e-01 6.176329e-04 1.983846e-03 -6.000000e+00 6.595168e-03 232.60 -2.00 3.52 -2.00 314.71 0.00e+00 2.629784e-04 5.085179e-05 2.186544e-05 -6.000000e+00 2.943835e-04 289.56 -2.00 20.00 -2.00 314.05 0.00e+00 1.120 0.000 302.00 328.00 3 4.3038e+00 1.5911e-03 1.4227e-02 -6.0000e+00 1.6535e-02 1.5472e-02 1.7519e-03 8.5793e-03 -6.0000e+00 1.7802e-02 2.2508e-03 1.0026e-03 4.1510e-03 -6.0000e+00 1.0605e-02 -3.7533e-03 4.3414e-04 1.1401e-03 -6.0000e+00 4.4850e-03 1.9932e-03 3.1208e-04 3.4347e-05 1.6640e-05 -6.0000e+00 3.1960e-04 8.4784e-03 8.6106e-06 12 9 1 12 9 1 99.89 21.72 0.07 0.00848 0.01082 27 17 1 5 0 672.150 26.11 20.01 21.72 35.60 40.5 1080.27 985 -901 465 -3308 -5286 -464 267 1328 1233 133 -2867 -822 227 136 1084 524 -323 1156 517 1625 871 244 921 909 -7 1351 125 -1119 -509 240 1520 117 2224 -730 -4218 -1223 -1652 -738 348 86 -1309 -864 -353 -1173 -414 -191 -772 -177 -649 -134 1132 964 905 1288 152 862 1069 414 275 514 536 1315 1221 1856 -95 -1150 -200 -1296 1066 1284 294 233 -181 652 19 -676 -431 -1983 -200 -523 -1201 -961 -2086 -1852 -456 -527 32 94 727 291 674 344 -871 275 921 128 -24 1051 404 -559 -345 -1302 -1251 387 92 -1393 -94 -552 -262 213 682 186 135 123 -58 97 617 -222 619 237 104 -259 585 67 1124 821 -471 964 863 487 148 -458 -526 -113 509 -388 -533 278 75 -515 -64 -844 352 -336 167 -1186 -1778 -150 92 464 462 51 -1095 -326 98 61 525 267 -168 611 280 898 483 136 493 506 -4 780 70 -625 -268 125 818 66 1306 -424 -2395 -711 -1013 -492 254 70 -1074 -727 -301 -999 -349 -158 -618 -144 -516 -108 948 801 784 1152 139 756 940 381 251 476 495 1286 1198 1848 -95 -1061 -183 -1196 1006 1269 310 250 -191 653 18 -626 -368 -1683 -180 -496 -1196 -1033 -2257 -2119 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