File name: Pandora206s1_BuffaloNY_20240709_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240710T052517.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240709_L1_smca1c1d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240709 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240709T121526.3Z 8956.510721 121 1 24.00 2 65.23 81.95 100.94 58.68 0.00 1 0.00 1 0 17 3.250e-01 3.177e-02 2.553e-01 2.607e-02 3.261544e-01 1.330540e-02 4.376850e-03 -6.000000e+00 1.857602e-01 232.96 -2.00 3.55 -2.00 318.84 0.00e+00 1.440335e-03 2.961953e-03 2.094932e-03 -6.000000e+00 8.592170e-03 286.82 -2.00 20.00 -2.00 318.02 0.00e+00 2.371 0.000 302.00 328.00 3 7.5481e+00 3.7044e-02 3.0758e-02 -6.0000e+00 4.6668e-01 7.5688e-02 4.2756e-02 2.2746e-02 -6.0000e+00 5.0506e-01 5.2377e-02 3.0416e-02 8.9992e-03 -6.0000e+00 3.0053e-01 -2.2370e-02 1.5943e-02 3.1530e-03 -6.0000e+00 1.2861e-01 1.6860e-05 -2.1391e-03 7.4740e-04 2.7227e-05 -6.0000e+00 8.4249e-03 1.2798e-02 9.4148e-05 12 8 8 10 0 0 20.68 18.68 3.03 0.01280 -0.00328 6 6 2 8 0 4000.000 15.00 18.68 31.91 21.69 21.98 23.4 1033.12 -40785 900000 900000 62379 900000 3261 106425 42538 21962 77875 172470 29531 -29628 25681 8731 -12029 269489 31920 6503 -1748 57752 19128 -9215 16178 -7730 543 22530 14415 5682 9089 6755 14420 3186 15643 13359 -4258 32806 3628 29207 -4626 -2325 -12370 4536 -8897 -2678 -1373 -3624 3094 -7183 1210 -1235 7467 -9920 -294 -200 -4020 -1808 4644 -2742 -856 -10547 6388 -5145 -1278 -1609 -3016 -621 -5742 6272 828 5115 -2756 3126 3571 7149 -570 5074 4446 -1836 -750 -5557 2636 -4994 406 106 8753 3374 1809 96 1659 -1830 1264 5795 -5186 2430 -4768 6629 -1878 1644 495 3796 -2216 1646 -4178 1050 -924 -509 2137 -4059 -866 722 2185 -5475 -51 -3410 3605 -3391 1882 -3827 -2054 2207 342 -475 -414 4919 -2097 377 -1144 4856 -962 3819 -818 1530 -1453 12 340 922 1494 -526 2153 -509 -2464 -1119 -2261 900000 900000 1585 900000 117 2705 1255 900 1979 4383 1235 -2494 1468 693 -1347 6848 2586 718 -219 4261 1990 -1295 1889 -1209 82 2791 1843 736 1162 933 2027 554 2571 2168 -761 4572 758 5706 -1517 -829 -5118 1650 -3773 -1066 -544 -1456 1143 -2915 453 -505 3042 -5105 -146 -104 -2206 -995 2397 -1487 -450 -6265 3450 -3420 -889 -1145 -2014 -378 -3579 3641 582 3819 -2333 2502 2737 4922 -392 2970 2478 -1137 -524 -4470 2179 -4803 385 108 8793 3764 2120 116 1896 -1996 1261 5064 -4859 2237 -5089 7054 -2441 2219 665 4631 -2634 1792 -4907 1283 -1176 -673 2895 -6153 -1363 1195 3645 -9557 -79 -5002 4744 -4753 2605 -5814 -3274 3435 532 -749 -624 6637 -2900 481 -1478 6389 -1444 5798 -1347 2506 -2538 22 634 1747 2879 -1043 4019 -966 -4571 -1983 SS 20240709T130155.6Z 8956.543004 148 1 26.90 2 56.77 89.54 93.74 66.92 0.00 1 0.00 1 0 17 1.033e-02 5.417e-03 8.198e-03 2.420e-03 2.431958e-01 1.218399e-03 2.925490e-03 -6.000000e+00 5.902260e-03 232.96 -2.00 3.55 -2.00 317.67 0.00e+00 2.377715e-04 1.889250e-04 6.342576e-05 -6.000000e+00 2.601149e-04 286.82 -2.00 20.00 -2.00 316.83 0.00e+00 1.819 0.000 302.00 328.00 3 4.6789e+00 3.2734e-03 2.2141e-02 -6.0000e+00 1.4838e-02 -2.0471e-02 3.6899e-03 1.2964e-02 -6.0000e+00 1.6054e-02 6.4506e-03 2.2171e-03 6.2622e-03 -6.0000e+00 9.5444e-03 -6.1459e-03 1.0919e-03 1.7154e-03 -6.0000e+00 4.0360e-03 6.2726e-04 1.3163e-04 6.7754e-05 1.7864e-05 -6.0000e+00 2.6366e-04 7.6237e-03 -2.8692e-05 10 0 0 10 0 0 99.95 18.70 0.35 0.00762 0.00861 55 55 2 8 0 488.980 15.00 18.70 33.90 21.69 21.98 23.6 1046.21 -1279 -2445 2833 -3428 1064 -3198 2914 -157 32 2210 -1677 -3021 -1423 -893 -849 174 153 835 -39 1518 457 1082 -1052 -239 208 209 23 -968 178 -311 970 65 3214 -151 -1857 -3279 -1954 -1156 110 -249 -1122 -631 -863 -861 -493 -553 -773 -440 -596 -182 -2 831 719 1272 703 1018 527 581 583 84 783 1143 1530 1670 129 -81 -535 -1374 728 460 395 554 185 722 680 361 -403 -608 -367 -223 -1187 -518 -1850 -1446 -1015 -425 -50 23 290 127 619 423 409 51 697 181 399 430 415 -322 -279 -889 -647 -374 -661 -850 -831 -273 -508 308 225 480 170 -66 -300 122 0 40 78 156 -274 58 94 88 758 343 605 790 584 235 115 32 -347 222 247 -15 -28 316 -61 -151 -236 -332 -605 -132 -280 318 -385 99 -296 270 -17 4 276 -213 -390 -203 -145 -157 35 32 180 -9 352 110 254 -257 -62 56 59 7 -259 43 -74 243 17 917 -47 -534 -923 -599 -406 46 -113 -560 -325 -461 -465 -263 -296 -406 -224 -297 -90 -1 462 421 784 450 659 351 385 379 54 518 812 1177 1374 107 -62 -378 -947 519 377 357 522 175 656 575 274 -278 -435 -248 -171 -1030 -494 -1910 -1547 -1165 -479 -60 28 356 150 731 456 402 48 695 201 489 539 553 -422 -343 -1106 -752 -451 -806 -1093 -1117 -383 -748 479 371 796 271 -98 -407 154 0 53 112 239 -432 89 143 127 1030 447 811 1061 774 333 172 50 -543 357 426 -28 -48 556 -109 -262 -427 -582 -1038 SS 20240709T135352.2Z 8956.579076 184 1 26.57 2 47.31 98.98 85.14 75.60 0.00 1 0.00 1 0 17 8.752e-03 5.895e-03 4.907e-03 2.330e-03 1.985043e-01 1.177033e-03 2.394509e-03 -6.000000e+00 4.999031e-03 232.96 -2.00 3.55 -2.00 316.40 0.00e+00 2.386668e-04 1.351261e-04 4.119475e-05 -6.000000e+00 2.202914e-04 286.83 -2.00 20.00 -2.00 315.62 0.00e+00 1.472 0.000 302.00 328.00 3 5.3307e+00 3.1021e-03 1.7954e-02 -6.0000e+00 1.2567e-02 -8.9785e-03 3.4639e-03 1.0530e-02 -6.0000e+00 1.3597e-02 5.3328e-03 1.9953e-03 5.0775e-03 -6.0000e+00 8.0837e-03 -4.4591e-03 9.2351e-04 1.3822e-03 -6.0000e+00 3.4186e-03 4.9071e-04 1.0249e-04 6.3701e-05 1.5380e-05 -6.0000e+00 2.2329e-04 7.3467e-03 -1.5421e-05 10 0 0 10 0 0 99.80 18.71 0.59 0.00735 0.00812 17 17 4 8 0 1562.870 15.00 18.71 35.58 21.69 21.98 23.8 1057.21 -1500 -324 100 -3140 -1924 -3290 -941 1219 238 107 239 27 -757 -246 1274 176 741 1593 191 82 1945 -216 -40 -433 -206 383 1065 -178 -831 115 1201 1002 1902 1172 -2769 -1706 -1619 -1135 -432 -497 -613 -1047 -580 -990 -359 -908 -865 -147 -1083 -379 704 734 800 1142 806 900 997 81 699 526 343 1471 1064 1621 185 66 -680 -586 464 41 401 293 684 632 221 42 -362 -861 -838 -551 -987 -792 -1945 -1503 -882 -353 -23 3 444 287 601 319 -14 217 269 127 460 720 279 -225 -20 -623 -1196 -306 -250 -1009 -914 -412 -337 377 322 166 -90 190 -279 -72 -22 578 189 267 -336 -112 86 307 755 442 660 873 595 267 346 71 -306 -67 -100 54 -48 293 -63 9 -331 -518 -560 -289 -67 21 -643 -336 -550 -162 228 50 24 52 6 -183 -66 382 53 229 549 63 28 663 -74 -14 -159 -79 151 419 -66 -311 41 447 395 800 468 -1158 -678 -706 -516 -234 -318 -392 -695 -395 -682 -244 -619 -575 -102 -734 -252 486 496 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