File name: Pandora132s1_Berlin_20221114_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T183834.8Z 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_20221114_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: 20221114 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 20221114T074507.4Z 8353.323002 291 1 49.30 2 81.38 135.82 53.99 265.07 0.00 1 0.00 1 0 25 5.094e-01 1.478e-02 3.028e-01 7.314e-03 6.876330e-01 3.966933e-03 8.302382e-03 -6.000000e+00 2.843564e-01 220.90 -2.00 3.85 -2.00 321.73 0.00e+00 6.571517e-03 1.951111e-03 1.778390e-03 -6.000000e+00 1.259180e-02 271.19 -2.00 20.00 -2.00 321.28 0.00e+00 6.297 0.005 302.00 328.00 3 1.2844e+00 1.3367e-02 7.3027e-02 -6.0000e+00 6.9979e-01 2.1811e-01 1.8984e-02 4.0353e-02 -6.0000e+00 7.6687e-01 -3.0676e-01 2.0826e-02 2.3855e-02 -6.0000e+00 4.5474e-01 1.3118e-01 9.9216e-03 1.0947e-02 -6.0000e+00 1.9315e-01 1.6064e-04 -2.8572e-04 2.1648e-04 1.4450e-04 -6.0000e+00 1.3935e-02 -1.7954e-02 0.0000e+00 12 8 8 10 0 0 93.21 15.98 0.33 -0.01795 -0.02010 116 25 4 8 0 424.920 14.98 15.98 13.10 20.46 20.87 26.2 990.22 -203526 900000 -114930 -120193 -146122 -156147 -93685 -204422 900000 -230114 5707 -172000 -116144 -83267 -131110 -12673 -105708 72454 -68079 83708 -44503 42840 -9533 -50832 3448 -55030 47395 -73369 2667 -34922 54656 -13030 -12223 25410 -45309 12948 -48490 20407 10581 34490 12849 8045 16307 7016 37294 -223 25226 -3253 20075 10708 12734 11605 7483 16750 4755 19694 -1148 14460 6392 9289 9561 692 16230 1960 12056 4234 7225 3506 4512 3926 1156 2541 -2529 5519 -1653 6443 -4888 -939 -311 -170 1858 -1322 139 -5351 843 -2663 305 -260 -911 1095 -218 2617 -2818 786 -2994 -341 -1533 -901 1127 -1524 304 -2679 614 -1544 -862 -2434 -636 -1027 -26 927 -562 923 -166 -26 -944 -129 490 -696 1458 -644 381 202 1875 1115 1078 544 -649 1163 194 633 -481 295 -681 224 260 -519 260 194 1004 -367 -57 -1223 -496 -2902 900000 -819 -857 -1231 -1417 -668 -3578 900000 -5966 41 -3122 -1581 -1187 -3484 -136 -2946 517 -1699 597 -920 367 -143 -1232 52 -1530 473 -2406 42 -896 701 -399 -427 634 -2197 351 -2697 684 475 1426 733 516 1012 490 1968 -18 1601 -288 1489 947 1235 1274 939 2066 695 2570 -187 1990 925 1298 1404 125 2882 409 2613 886 1607 775 1114 1115 366 817 -833 1563 -455 1626 -1321 -257 -89 -58 728 -607 69 -2958 467 -1624 190 -166 -579 652 -123 1352 -1507 432 -1956 -254 -1344 -894 1177 -1616 292 -2369 490 -1291 -768 -2334 -635 -1112 -31 1241 -842 1430 -259 -39 -1358 -179 688 -1042 2260 -1045 600 305 2689 1563 1460 714 -848 1606 308 1136 -952 615 -1516 526 652 -1368 694 524 2652 -939 -136 -2773 -1102 SS 20221114T075107.2Z 8353.327167 294 1 49.58 2 80.75 137.11 54.88 266.26 0.00 1 0.00 1 0 25 4.993e-01 1.092e-02 2.106e-01 5.958e-03 6.558835e-01 3.178005e-03 7.861872e-03 -6.000000e+00 2.779918e-01 220.90 -2.00 3.85 -2.00 321.57 0.00e+00 5.304169e-03 1.502642e-03 8.098209e-04 -6.000000e+00 1.203736e-02 271.19 -2.00 20.00 -2.00 321.11 0.00e+00 5.915 0.005 302.00 328.00 3 1.3658e+00 1.0505e-02 6.8964e-02 -6.0000e+00 6.8255e-01 1.4516e-01 1.4568e-02 3.9014e-02 -6.0000e+00 7.4750e-01 -1.8809e-01 1.5798e-02 2.0994e-02 -6.0000e+00 4.4453e-01 7.9138e-02 7.6045e-03 9.2080e-03 -6.0000e+00 1.8797e-01 2.1858e-04 -4.4922e-04 1.7634e-04 1.0814e-04 -6.0000e+00 1.3625e-02 -1.7984e-02 0.0000e+00 12 8 8 10 0 0 93.90 15.99 0.33 -0.01798 -0.02136 133 28 4 8 0 372.710 14.98 15.99 13.60 20.46 20.87 26.1 991.84 -180910 -175291 -208839 -39894 -194934 -127224 -167369 -150142 -111271 -152479 -112100 -130230 -95266 -137221 -64768 -81175 -54781 -35098 -40135 -54041 -30991 -37002 -29737 -21926 -45117 -40969 -36164 -3008 -13371 -40216 -10440 -7465 4599 -6254 -16253 9093 -12061 8009 3464 10210 2967 14322 7860 2396 9660 6787 11319 3587 8391 5093 9184 4981 12476 7329 6123 10705 5532 1304 2200 4080 1098 7756 3033 7672 8657 3110 8288 -1195 5261 20 2689 1317 1914 3147 -963 -1083 -2285 -2305 -4247 -1566 -2109 -1464 -3341 -1550 -1233 -1625 641 137 1668 -576 1263 560 -1462 -236 -2181 -165 -1139 930 -371 484 -15 -2151 -476 -650 234 -1905 -769 -1337 -74 445 703 68 366 -493 -590 -37 -865 116 600 -27 86 398 1236 626 704 156 297 553 505 206 -150 154 -402 367 -146 -335 174 713 110 -71 -296 -704 -446 -2007 -2130 -3751 -232 -2677 -874 -1857 -1745 -970 -2126 -1107 -1816 -1218 -3508 -1016 -1792 -1050 -612 -793 -1287 -594 -752 -587 -433 -1206 -1095 -925 -54 -272 -1192 -279 -234 147 -233 -642 280 -512 335 185 599 209 965 594 196 752 560 921 329 775 527 1019 645 1646 1099 978 1698 942 229 372 673 197 1456 684 1678 1953 726 2003 -303 1409 7 919 470 663 1007 -291 -326 -662 -698 -1368 -586 -927 -725 -1834 -888 -751 -1056 428 94 1114 -376 757 317 -825 -139 -1493 -129 -1042 946 -410 524 -15 -1976 -402 -564 216 -1902 -803 -1514 -92 618 1069 109 581 -756 -858 -52 -1246 174 949 -44 139 611 1816 896 971 207 389 773 802 370 -294 319 -882 850 -362 -869 458 1890 289 -178 -703 -1580 -987 SS 20221114T080953.0Z 8353.340197 303 1 49.37 2 78.88 141.22 57.69 269.89 0.00 1 0.00 1 0 17 3.743e-01 1.707e-02 3.267e-01 1.460e-02 5.507789e-01 7.612764e-03 6.839677e-03 -6.000000e+00 2.105287e-01 220.90 -2.00 3.85 -2.00 320.99 0.00e+00 1.656765e-03 3.065663e-03 1.951295e-03 -6.000000e+00 9.203509e-03 271.19 -2.00 20.00 -2.00 320.51 0.00e+00 5.007 0.003 302.00 328.00 3 3.5706e+00 2.3356e-02 5.8047e-02 -6.0000e+00 5.1675e-01 1.3743e-01 2.9815e-02 3.2018e-02 -6.0000e+00 5.6635e-01 -1.5821e-01 2.9151e-02 1.7711e-02 -6.0000e+00 3.3487e-01 6.8611e-02 1.4641e-02 6.1322e-03 -6.0000e+00 1.4094e-01 6.2032e-05 -1.5791e-04 4.4298e-04 8.2271e-05 -6.0000e+00 1.0419e-02 -1.7112e-02 0.0000e+00 12 8 8 10 0 0 99.96 16.01 0.40 -0.01711 -0.01830 49 10 1 8 0 1007.240 15.00 16.01 14.27 20.46 20.87 25.8 992.97 -134605 -95888 94686 -141610 900000 -82710 900000 -147784 19842 -143290 -162326 -27476 114076 38517 46384 40726 -39582 137070 55648 -9465 -12359 -23709 9729 28100 52809 -15543 38955 7529 -33000 -14765 -23631 -25279 -673 16912 -2336 20932 -23627 -18675 -1663 7276 7474 -5609 16180 -1344 14110 11237 1413 1755 2421 6044 7345 22492 -1093 19808 543 -1186 3408 12590 6172 820 10485 -1875 4999 3270 5488 -1516 -7848 3453 106 5715 3453 10029 -763 3267 -713 872 -2332 -426 -545 -1026 1456 -1153 -1288 -1848 -566 842 -984 -1582 -264 233 -2278 1452 -1793 -786 -961 -3431 684 -33 1380 -872 -1450 -1385 -368 -691 -724 -2200 -944 573 -2169 777 -279 -613 620 -1044 -476 -634 342 -1022 2385 711 583 1039 981 1467 1691 1554 -341 1211 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