File name: Pandora132s1_Berlin_20230725_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T202024.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20230725_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20230725 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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 20230725T041952.8Z 8606.180473 86 1 6.07 2 82.25 67.57 136.80 358.54 0.00 1 0.00 1 0 25 6.717e-01 5.384e-02 5.569e-01 5.009e-02 9.225131e-01 2.888300e-02 1.095197e-02 -6.000000e+00 4.052369e-01 233.54 -2.00 3.85 -2.00 321.93 0.00e+00 -4.501603e-03 1.331303e-02 8.459253e-03 -6.000000e+00 1.879282e-02 282.75 -2.00 20.00 -2.00 321.37 0.00e+00 6.900 0.007 302.00 328.00 3 2.1087e+00 1.0377e-01 1.0221e-01 -6.0000e+00 1.0255e+00 1.2962e+00 1.2683e-01 8.9067e-02 -6.0000e+00 1.1194e+00 -1.6215e+00 8.1585e-02 3.0629e-02 -6.0000e+00 6.5469e-01 6.3720e-01 4.0552e-02 1.0639e-02 -6.0000e+00 2.6740e-01 2.3753e-05 8.9189e-04 1.3421e-03 1.1313e-04 -6.0000e+00 1.9764e-02 -9.3745e-03 0.0000e+00 12 9 9 12 5 5 999.00 4.70 0.40 -0.00937 -0.00267 2 5 4 8 0 1964.810 14.98 4.70 22.02 21.38 21.79 28.5 976.39 -43480 19908 -49580 51286 -35509 -82718 900000 -1776 -67204 -144641 112661 900000 209624 900000 -63133 900000 -91694 49331 900000 183188 -58790 79293 63574 -14412 900000 56648 900000 -72084 -49767 900000 251879 105555 67069 900000 -19529 900000 269674 900000 9773 207380 84320 77573 94344 31411 155512 43464 119462 122057 73005 58641 900000 119481 109034 900000 9926 66736 9832 10572 8938 39649 106515 15120 68397 13949 171035 33601 81330 54155 29735 58724 8387 32436 -3574 26967 -20674 43576 20736 -9803 -9736 8759 34269 -22057 17993 -4372 -6860 3677 1608 -12336 -8028 1113 2332 3601 -8584 23902 -3139 -10296 -6583 -11941 2742 -1970 -573 -4208 -6259 -995 2020 -4274 1742 -779 -4793 6870 643 6401 -317 -2871 -2837 535 2508 -3288 3756 -1410 2140 -1059 2289 7513 5297 -5329 2993 3188 -998 -1507 1313 3081 -824 -801 1567 363 -1749 528 361 416 1042 -2400 -2381 -2118 970 -2415 2499 -1730 -4030 900000 -87 -3274 -14094 5489 900000 10213 900000 -5383 900000 -11913 2403 900000 8925 -5012 3863 3097 -819 900000 2760 900000 -6146 -3233 900000 12271 5143 3268 900000 -1348 900000 13138 900000 754 10103 4108 4123 4596 2504 7576 2888 5820 5946 3880 3896 900000 5821 5795 900000 1451 6207 1477 1639 1306 4039 5661 2210 6664 2379 8333 5209 7925 7435 5432 9883 2281 6979 -1045 5733 -5708 6176 3582 -2268 -2648 2382 8487 -10925 6501 -2095 -3565 1806 836 -7412 -4498 538 1041 1521 -4147 9219 -1860 -7775 -5613 -11322 2404 -1779 -505 -3399 -4803 -744 1566 -3731 1528 -769 -5191 7646 855 8563 -460 -4175 -3976 713 3375 -4942 5517 -2194 3088 -1492 3002 9095 6352 -6870 3567 4205 -1609 -2807 2632 6535 -1813 -1897 3873 941 -4693 1386 925 998 2457 -5432 -5328 SS 20230725T051450.2Z 8606.218637 111 1 1.24 2 74.27 77.98 135.89 17.44 0.00 1 0.00 1 0 25 2.600e-01 1.172e-02 2.480e-01 1.163e-02 5.364435e-01 6.046027e-03 6.655494e-03 -6.000000e+00 1.516274e-01 233.54 -2.00 3.85 -2.00 319.84 0.00e+00 3.007889e-03 1.884788e-03 4.107586e-04 -6.000000e+00 6.577084e-03 282.75 -2.00 20.00 -2.00 319.16 0.00e+00 3.623 0.001 302.00 328.00 3 2.2243e+00 1.7603e-02 4.8026e-02 -6.0000e+00 3.8191e-01 5.0776e-02 2.1042e-02 3.1823e-02 -6.0000e+00 4.1374e-01 -2.5280e-02 1.7687e-02 1.5386e-02 -6.0000e+00 2.4524e-01 2.9813e-03 9.1174e-03 5.8087e-03 -6.0000e+00 1.0187e-01 8.2793e-04 4.2992e-04 3.2815e-04 5.3543e-05 -6.0000e+00 7.1243e-03 -9.3773e-03 0.0000e+00 12 9 9 12 5 5 999.00 4.77 0.14 -0.00938 -0.00615 2 29 4 8 0 353.370 15.01 4.77 22.46 21.38 21.79 28.2 978.34 210037 -95249 32016 -83184 -6038 -69277 -53102 77205 -76866 14722 -45196 9306 -22294 9562 -44243 3546 -27991 -35678 17954 -752 27889 6462 11640 26780 27138 761 -2873 2188 -20835 10380 -5860 374 -3726 -398 2497 -13948 14593 7036 10152 -5366 1022 -1883 -386 4167 -1675 212 -4194 7989 -2216 8835 996 3933 1961 2926 1076 -2177 -170 -3431 2021 -4006 4036 530 3191 1999 -989 1439 -2292 2566 339 536 -36 1027 150 1110 628 -2648 585 -438 857 -2452 -2631 -1799 -3078 -2361 -2169 -1 1442 586 427 2387 1824 583 -402 -124 -369 489 -291 1256 192 -847 191 -1626 -674 -316 -517 -908 -572 -314 1742 -591 488 1418 745 124 408 416 178 -837 278 -1240 -1367 -174 918 -752 272 64 660 144 522 -7 452 -404 192 288 -353 32 -374 1285 -529 -181 329 -1457 620 2383 -2358 363 -1802 -69 -1336 -964 876 -2061 184 -1077 148 -607 239 -2099 121 -1444 -2171 685 -36 1139 300 540 1276 1260 48 -187 131 -1569 621 -484 34 -396 -42 245 -1640 1460 922 1571 -1035 204 -411 -87 910 -394 50 -1047 1805 -574 2189 295 1249 690 1006 395 -855 -67 -1374 750 -1580 1550 234 1540 1062 -548 745 -1200 1330 187 337 -25 714 102 708 366 -1550 312 -243 490 -1697 -1956 -1480 -2759 -2227 -2047 -1 1466 613 440 2300 1751 526 -352 -113 -352 530 -341 1617 249 -1083 235 -1846 -769 -374 -620 -1152 -761 -420 2489 -901 792 2331 1203 191 618 610 267 -1264 441 -2061 -2252 -274 1453 -1164 399 90 902 209 798 -13 775 -729 360 545 -714 64 -769 2626 -1088 -373 637 -2732 1189 SS 20230725T052102.7Z 8606.222948 115 1 49.18 2 73.35 79.15 135.63 19.51 0.00 1 0.00 1 0 25 2.866e-01 1.272e-02 2.139e-01 9.299e-03 5.145873e-01 4.974932e-03 6.333927e-03 -6.000000e+00 1.671864e-01 233.54 -2.00 3.85 -2.00 320.49 0.00e+00 2.832072e-03 1.828642e-03 5.301129e-04 -6.000000e+00 7.688872e-03 282.75 -2.00 20.00 -2.00 319.83 0.00e+00 3.434 0.001 302.00 328.00 3 4.5134e+00 1.5244e-02 4.5685e-02 -6.0000e+00 4.2108e-01 1.0895e-01 1.8913e-02 3.0166e-02 -6.0000e+00 4.5626e-01 -2.9913e-02 1.6648e-02 1.5253e-02 -6.0000e+00 2.7058e-01 2.3326e-03 8.3332e-03 5.4460e-03 -6.0000e+00 1.1329e-01 9.8922e-05 -1.7307e-04 2.7869e-04 5.8254e-05 -6.0000e+00 7.9038e-03 -9.3854e-03 0.0000e+00 12 9 9 12 4 4 99.99 4.83 0.35 -0.00939 -0.01069 39 8 1 8 0 1260.880 15.00 4.83 22.77 21.38 21.79 28.4 979.95 -117535 900000 -97811 -44531 -21610 -111734 117522 -84679 141938 -114270 900000 -51969 -30725 -8351 -24270 -4631 -24634 69148 -13798 36987 -607 42682 -23589 227 -1905 -26778 10592 -16843 14216 -2662 24471 -10316 -8608 9113 -15778 21246 -8402 6100 -4423 11329 -737 4146 471 5692 5585 -3575 10654 -4351 5602 -1347 10549 4601 -89 4516 882 7182 -5204 6615 -239 7669 -2018 102 3277 -505 2087 -3111 1895 -4891 891 -1334 108 1557 -1069 3449 -2064 2584 -1018 3723 -1721 -612 -201 -2381 -1274 -2961 1199 -2637 1395 -120 2485 569 -146 1847 -2043 -552 -2818 1657 -1105 1797 935 -242 -284 -1744 142 -1175 -1637 -1775 95 -1225 1139 867 84 680 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