File name: Pandora75s1_EssexMD_20241230_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20241231T051341.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20241230_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20241230 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-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 20241230T142640.3Z 9130.601855 105 1 51.03 2 73.00 141.33 76.55 147.42 0.00 1 0.00 1 0 17 2.229e-01 1.165e-02 2.087e-01 6.784e-03 4.841102e-01 3.689248e-03 5.907495e-03 -6.000000e+00 1.332364e-01 223.51 -2.00 3.48 -2.00 320.32 0.00e+00 1.622645e-03 1.294639e-03 2.552245e-03 -6.000000e+00 5.802298e-03 277.56 -2.00 20.00 -2.00 319.79 0.00e+00 3.368 0.001 302.00 328.00 3 4.4849e+00 1.0927e-02 4.3000e-02 -6.0000e+00 3.2817e-01 5.4158e-02 1.3391e-02 2.8566e-02 -6.0000e+00 3.5540e-01 -4.0851e-02 1.2057e-02 1.4544e-02 -6.0000e+00 2.1183e-01 9.6780e-03 6.1651e-03 4.2072e-03 -6.0000e+00 9.0874e-02 1.1405e-04 -8.2730e-04 2.2129e-04 7.2021e-05 -6.0000e+00 6.8520e-03 -3.2176e-02 2.0020e-04 12 9 8 11 16 0 95.48 23.40 0.49 -0.03218 -0.03839 13 2 1 5 0 3924.760 26.21 20.00 23.40 19.30 5.7 957.91 -21499 110157 -47169 29441 -42535 -32257 -91894 -78738 -35854 13105 -63976 107635 -59345 57366 37674 10523 -32834 -44165 10205 -7220 16238 -39866 22513 -21637 -3587 -15137 -11214 -13675 -11079 4970 -17014 -1095 14026 -11024 -7431 -9966 -12268 -9457 -3041 3965 10254 727 6768 -6540 911 344 2495 -1769 7218 -662 2066 1621 1199 4195 -1729 5556 -2263 6271 -3785 1921 2880 2514 5845 6756 2693 2714 1408 -1140 2779 2815 -166 4558 -2058 3556 -463 -1740 -6579 -2153 -2048 -780 318 -3267 -3733 -802 20 525 -727 -698 1387 1028 -103 -772 -1454 383 -1652 -568 281 1454 151 -294 -1195 -1054 -1058 -499 -917 -1628 -1808 118 697 629 195 940 459 -792 -480 463 -300 188 433 516 309 555 1550 1381 337 -453 -457 1110 -28 -1020 -496 -423 28 -571 237 211 476 183 -87 512 -294 -1115 -190 729 -737 212 -588 -388 -2100 -1752 -582 142 -1577 712 -1784 655 634 272 -1461 -2390 344 -304 557 -2421 758 -1210 -179 -892 -647 -789 -606 239 -1136 -71 877 -941 -603 -827 -1129 -984 -357 513 1400 117 1182 -1337 175 67 480 -359 1370 -142 467 403 324 1182 -544 1683 -757 1925 -1262 601 922 875 2177 2713 1160 1136 581 -489 1237 1406 -94 2557 -1227 1910 -239 -824 -3042 -945 -973 -419 194 -2308 -2877 -639 17 468 -688 -677 1314 941 -89 -625 -1129 295 -1412 -541 301 1720 192 -371 -1438 -1165 -1102 -523 -1026 -1940 -2280 155 985 969 323 1595 770 -1281 -728 668 -437 284 689 850 511 896 2399 2055 485 -630 -622 1543 -42 -1722 -893 -801 54 -1188 516 481 1111 434 -206 1158 -639 -2343 SS 20241230T143718.1Z 9130.609237 108 1 51.37 2 71.74 143.53 75.51 149.49 0.00 1 0.00 1 0 17 1.697e-01 1.368e-02 3.795e-02 3.026e-03 4.465375e-01 1.596352e-03 5.364564e-03 -6.000000e+00 1.013344e-01 223.51 -2.00 3.48 -2.00 319.28 0.00e+00 1.606714e-03 4.156031e-04 1.260253e-03 -6.000000e+00 4.415892e-03 277.56 -2.00 20.00 -2.00 318.72 0.00e+00 3.151 0.001 302.00 328.00 3 4.4064e+00 4.4204e-03 3.8918e-02 -6.0000e+00 2.4959e-01 1.7701e-02 5.1522e-03 2.3445e-02 -6.0000e+00 2.7039e-01 -3.3177e-02 4.0355e-03 1.1968e-02 -6.0000e+00 1.6116e-01 1.0722e-02 2.1296e-03 3.5548e-03 -6.0000e+00 6.9073e-02 1.6213e-04 -1.8777e-03 9.4443e-05 4.7573e-05 -6.0000e+00 5.2174e-03 -3.0094e-02 1.6890e-05 12 9 8 11 32 0 99.91 23.42 0.31 -0.03009 -0.04420 19 3 1 5 0 2703.240 26.21 20.00 23.42 19.84 5.8 962.41 -121408 -18855 1387 -22734 -82022 -20625 2186 -31191 -60330 -20860 -61608 -24268 19257 55363 -12466 9537 -7077 -7800 33211 8244 21651 17608 -2150 1973 -5572 735 11628 -2527 5035 -5602 -4992 -6877 -9210 3109 4885 8594 -10254 -1900 1446 -1393 -2758 34 2690 1688 3368 4533 2131 142 2839 4006 2149 -625 4926 5371 -681 1003 1463 -561 993 -72 -674 3137 2970 3171 -98 -2255 -1427 351 1822 4416 -117 875 1340 -768 393 -668 -4228 -2873 -1812 -2869 -836 -5269 -1566 -421 -619 -565 204 1038 8 1795 -272 -760 148 -1822 -1432 723 1084 1135 288 505 -1152 -1641 -432 -425 -2713 -1250 -292 644 -223 1629 1376 845 96 -397 -271 -221 252 13 174 402 401 982 1734 781 476 -352 215 -674 -198 178 -339 -1163 81 -394 -330 135 717 983 -369 -120 -500 -679 -6286 -405 29 -590 -3582 -469 41 -911 -2635 -665 -3090 -902 540 1307 -695 495 -480 -575 1735 579 1367 1169 -180 168 -546 71 1023 -249 446 -565 -552 -877 -1337 422 640 1080 -1685 -334 294 -344 -774 10 799 518 1028 1380 668 46 904 1312 701 -229 1841 2138 -302 453 670 -262 449 -33 -319 1546 1616 1865 -61 -1389 -843 206 1131 2995 -83 644 978 -547 279 -435 -2646 -1752 -1178 -1969 -641 -4724 -1466 -415 -601 -584 220 1139 9 1877 -271 -766 140 -1772 -1499 768 1298 1404 380 659 -1442 -2051 -504 -504 -3502 -1562 -382 886 -333 2415 2186 1385 156 -615 -422 -329 375 20 266 639 640 1528 2597 1215 709 -507 300 -983 -311 284 -580 -2103 142 -723 -642 272 1479 1932 -730 -243 -973 -1272 SS 20241230T144719.5Z 9130.616198 111 1 52.23 2 70.62 145.66 74.58 151.47 0.00 1 0.00 1 0 17 1.118e-01 8.122e-03 5.921e-02 3.674e-03 4.335470e-01 1.968783e-03 5.198693e-03 -6.000000e+00 6.682578e-02 223.51 -2.00 3.48 -2.00 319.72 0.00e+00 2.469480e-03 5.802407e-04 1.224646e-03 -6.000000e+00 2.909941e-03 277.56 -2.00 20.00 -2.00 319.16 0.00e+00 2.979 0.000 302.00 328.00 3 4.1596e+00 5.5875e-03 3.7171e-02 -6.0000e+00 1.6460e-01 3.9682e-02 6.6098e-03 2.2663e-02 -6.0000e+00 1.7825e-01 -1.3757e-02 5.4783e-03 1.2224e-02 -6.0000e+00 1.0624e-01 -7.4298e-03 2.8620e-03 4.1783e-03 -6.0000e+00 4.5584e-02 2.4360e-04 -9.4529e-04 1.1916e-04 5.5988e-05 -6.0000e+00 3.4360e-03 -3.2822e-02 2.2389e-04 11 9 0 11 24 0 32.78 23.44 0.33 -0.03282 -0.03993 22 4 1 5 0 2373.840 26.21 20.00 23.44 20.22 5.7 965.25 -65149 -24486 -13656 -16246 -23425 -8476 -59212 -36343 22247 -14925 -41397 -28882 -33079 -22846 -18685 -15359 -8265 -601 6597 -2898 -7492 853 -5848 3975 -2399 1271 -6239 -3613 -6254 1083 3548 -3156 4310 -1736 -5894 -1360 -7965 -3327 -4472 -888 310 1549 1285 3321 -1680 3186 -1659 1889 -1979 517 689 1315 402 3093 2633 -721 918 -910 496 -1106 1664 1997 2653 3262 877 1979 878 -97 -843 1766 855 1398 780 765 1187 -2377 -809 -2042 -1585 -2442 -882 -1133 -2022 -1771 41 489 90 444 239 1326 68 635 -877 -329 -1413 -160 629 115 598 -37 -695 -1805 -865 -1593 -695 -1993 -388 -127 167 1108 566 679 264 474 -822 -203 -553 152 458 406 479 334 926 173 598 7 -166 216 799 -223 -271 -186 -144 -108 -57 135 200 428 168 -329 -319 -742 -1591 -462 -249 -302 -435 -130 -1562 -840 319 -335 -1267 -837 -1163 -878 -828 -765 -425 -31 337 -171 -476 50 -379 247 -169 99 -534 -294 -506 83 294 -315 445 -202 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