File name: Pandora257s1_AustinTX_20250526_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250527T063302.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250526_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20250526 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250526T163234.0Z 9277.689283 230 1 54.03 2 27.44 102.23 20.14 101.64 0.00 1 0.00 1 0 17 3.190e-02 1.805e-02 6.721e-03 3.805e-03 1.416752e-01 2.115701e-03 1.502710e-03 -6.000000e+00 2.049873e-02 230.94 -2.00 3.25 -2.00 315.85 0.00e+00 2.160348e-04 2.279252e-04 1.008036e-04 -6.000000e+00 9.449990e-04 289.77 -2.00 20.00 -2.00 315.06 0.00e+00 1.126 0.000 302.00 328.00 3 7.3668e+00 5.5016e-03 1.2865e-02 -6.0000e+00 5.1098e-02 -1.5859e-02 6.1123e-03 6.6557e-03 -6.0000e+00 5.5099e-02 5.1160e-02 3.4788e-03 3.1861e-03 -6.0000e+00 3.2897e-02 -2.1231e-02 1.5118e-03 9.2563e-04 -6.0000e+00 1.3595e-02 9.9271e-05 1.0735e-03 1.3632e-04 1.4614e-05 -6.0000e+00 1.1535e-03 2.5781e-02 -8.2718e-05 12 9 8 11 8 0 99.89 28.15 1.08 0.02578 0.03385 17 2 1 5 0 3177.590 36.00 19.99 28.15 25.87 0.0 932.64 -791 -2371 -15 10924 -11303 -5632 -9627 -2982 1058 -2530 -1154 -6913 -1018 6461 4710 -2646 -681 5930 1740 3294 13097 -1430 6697 3182 3443 -2562 -1707 1676 -1739 -1413 2126 1467 -5719 -1130 -6527 11086 -6522 -2062 -1540 -206 2833 -626 1183 -2142 -733 -3383 -4292 868 -470 -480 2353 4912 -827 3643 -697 -23 -1074 -316 1305 -178 449 828 5701 -482 -3050 -2815 1726 249 -330 1867 1104 3037 -450 847 89 2012 1071 -5381 -2427 -860 -2870 -1094 -4133 -1448 747 -902 383 1580 1518 367 -305 -1516 1420 -154 -256 2331 142 -4 -1143 -233 24 -1136 1200 429 929 -1028 -709 1199 -524 1857 1465 72 -56 735 -113 -1108 -1414 -1246 -184 -418 67 -672 -845 2950 -1284 367 683 -592 98 -1288 -1119 -1362 1047 846 -201 229 -264 841 2354 2143 -1194 -2761 -145 -196 -616 -4 2306 -2814 -1306 -2433 -759 274 -699 -320 -2111 -315 2026 1622 -1034 -269 2253 706 1342 4898 -625 2751 1398 1552 -1233 -794 718 -735 -584 861 619 -2657 -500 -3008 4393 -3373 -1167 -995 -133 1913 -456 864 -1625 -545 -2542 -3165 589 -348 -355 1743 3703 -625 2726 -557 -19 -880 -257 1039 -145 379 733 5036 -461 -2912 -2517 1388 200 -279 1674 1067 2981 -457 821 81 1814 898 -4618 -2076 -781 -2642 -1070 -4441 -1605 863 -1124 494 2063 1973 464 -362 -1669 1406 -150 -257 2443 165 -5 -1494 -297 29 -1327 1337 495 1129 -1347 -969 1677 -776 2793 2264 103 -84 1014 -146 -1366 -1733 -1578 -245 -589 96 -980 -1207 3897 -1682 449 803 -702 119 -1654 -1485 -1856 1420 1188 -298 354 -423 1362 3775 3396 -1911 -4383 -222 SS 20250526T164007.4Z 9277.694530 236 1 54.64 2 25.85 103.92 18.58 103.48 0.00 1 0.00 1 0 17 1.089e-02 7.346e-03 2.403e-03 1.570e-03 1.479495e-01 8.827251e-04 1.629039e-03 -6.000000e+00 6.997410e-03 230.94 -2.00 3.25 -2.00 315.23 0.00e+00 -2.794631e-05 8.378523e-05 3.133597e-05 -6.000000e+00 3.224599e-04 289.77 -2.00 20.00 -2.00 314.51 0.00e+00 1.111 0.000 302.00 328.00 3 6.0716e+00 2.2812e-03 1.2981e-02 -6.0000e+00 1.7443e-02 8.1116e-03 2.5263e-03 7.0657e-03 -6.0000e+00 1.8807e-02 1.1837e-02 1.4369e-03 3.4181e-03 -6.0000e+00 1.1229e-02 -8.0149e-03 6.1270e-04 9.3297e-04 -6.0000e+00 4.6418e-03 3.6612e-04 5.3708e-04 5.6023e-05 1.6130e-05 -6.0000e+00 3.9362e-04 2.5461e-02 -1.1242e-05 11 8 0 10 0 0 99.99 28.12 0.96 0.02546 0.02950 137 13 1 5 0 398.770 36.00 19.99 28.12 26.58 0.0 937.49 -307 -2000 -2379 -1914 -4898 -1206 -919 637 784 -2085 -709 -772 18 1834 1595 -882 -354 2515 861 1515 2520 -117 3486 1156 1046 -313 -919 -581 124 1540 1021 895 -593 -665 -3254 1686 -2068 -677 -804 -81 -811 -810 204 -1538 -225 -1006 -1226 523 -536 204 718 1854 106 2083 -289 503 400 0 523 675 801 1005 1924 306 -718 -1188 267 350 -24 1202 486 372 -137 466 438 -148 365 -1437 -591 -984 -1295 -1333 -2385 -1452 -199 -699 -81 285 627 608 -579 43 -426 172 340 758 233 503 -21 -799 -228 -720 -202 26 132 -1097 -447 120 -257 833 480 345 209 196 -96 -25 -24 -148 208 108 83 -74 -219 1202 143 377 384 218 1008 31 105 -405 149 36 20 -5 -271 505 337 7 -412 -699 -842 -97 -660 -773 -584 -1450 -337 -267 196 256 -719 -244 -276 7 745 637 -380 -157 1107 394 701 1167 -56 1641 574 535 -163 -470 -281 57 747 504 457 -286 -321 -1586 879 -1109 -409 -558 -57 -621 -646 164 -1266 -182 -804 -954 387 -391 161 532 1418 86 1713 -249 436 349 0 453 591 723 954 1897 313 -723 -1129 235 303 -21 1164 507 372 -138 488 429 -134 302 -1263 -484 -871 -1257 -1402 -2493 -1593 -229 -860 -104 347 816 762 -685 46 -464 179 364 799 268 621 -28 -1024 -277 -835 -227 30 160 -1427 -605 157 -350 1170 693 497 289 254 -125 -30 -28 -185 276 151 111 -100 -289 1622 186 464 454 257 1215 39 138 -549 205 51 28 -8 -406 767 516 11 -613 -1018 -1214 SS 20250526T165820.9Z 9277.707187 251 1 4.09 2 22.07 108.70 14.87 109.11 0.00 1 0.00 1 0 17 9.052e-03 7.328e-03 5.168e-03 3.924e-03 1.409251e-01 2.230052e-03 1.583022e-03 -6.000000e+00 5.816244e-03 230.94 -2.00 3.25 -2.00 314.42 0.00e+00 4.255350e-04 1.815936e-04 4.441906e-05 -6.000000e+00 2.681432e-04 289.78 -2.00 20.00 -2.00 313.78 0.00e+00 1.079 0.000 302.00 328.00 3 5.2276e+00 5.7117e-03 1.2563e-02 -6.0000e+00 1.4498e-02 2.0707e-02 6.2995e-03 6.8207e-03 -6.0000e+00 1.5634e-02 7.2968e-03 3.6040e-03 3.2956e-03 -6.0000e+00 9.3342e-03 -5.5525e-03 1.5039e-03 9.6911e-04 -6.0000e+00 3.8573e-03 8.8782e-04 2.0394e-04 1.3937e-04 1.6910e-05 -6.0000e+00 3.2730e-04 2.5691e-02 -9.3278e-05 12 9 1 12 1 1 999.00 28.07 0.34 0.02569 0.02722 2 4 1 5 0 1361.130 36.00 19.99 28.07 27.49 0.0 943.55 -1582 -48 -1912 -2824 -2949 532 693 706 1250 620 -2166 -353 1236 790 1189 624 -444 -51 1863 1867 991 183 -18 718 754 -571 350 109 -639 659 863 1542 1005 -2397 -1617 -532 -431 -904 -86 -1550 -49 -1000 -97 -1178 -466 -358 -932 739 -39 194 520 1243 47 1145 515 232 459 588 353 -91 1262 1194 1282 678 -575 -331 750 38 723 1574 -246 759 162 130 306 -458 103 -900 -571 -482 -1982 -1142 -2587 -2108 -708 -607 -102 191 295 86 296 -211 307 271 385 1108 -59 631 -163 -214 -239 -489 -127 504 490 -1036 -593 -176 -332 402 307 97 -38 -152 -167 116 303 -276 931 -14 -339 -188 -96 492 -1 713 1088 985 739 14 666 -24 49 212 478 -504 -71 314 370 -706 -270 -1053 -541 -658 -20 -805 -1131 -1111 189 256 279 520 266 -967 -160 545 381 615 342 -253 -28 1005 1025 554 104 -10 423 456 -351 207 61 -373 371 490 898 602 -1479 -975 -323 -264 -636 -64 -1228 -41 -882 -86 -1003 -416 -313 -797 601 -31 154 424 1048 42 1039 452 207 410 524 314 -82 1163 1159 1303 667 -590 -319 670 36 662 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