File name: Pandora89s1_PaloDuroTX_20250717_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250718T065737.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Kevin Mishoe Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 89 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora89_OF_v3d20240314.txt Instrument calibration file used: Pandora89s1_CF_v2d20241101.txt Level 1 file used: Pandora89s1_PaloDuroTX_20250717_L1_smca1c2d20241101p1-8.txt Full location name: Palo Duro, TX Short location name: PaloDuroTX Country of location: United States Location latitude [deg]: 34.8806 Location longitude [deg]: -101.6647 Location altitude [m]: 1056 Local noon date: 20250717 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 clearance session 1 First and last pixel inside fitting window: 194 335 Nominal wavelengths inside fitting window [nm]: 305.1224 305.2633 305.4042 305.5451 305.6860 305.8269 305.9677 306.1085 306.2494 306.3902 306.5310 306.6718 306.8126 306.9533 307.0941 307.2349 307.3756 307.5163 307.6570 307.7977 307.9384 308.0791 308.2198 308.3604 308.5011 308.6417 308.7823 308.9230 309.0636 309.2041 309.3447 309.4853 309.6258 309.7664 309.9069 310.0474 310.1879 310.3284 310.4689 310.6094 310.7499 310.8903 311.0307 311.1712 311.3116 311.4520 311.5924 311.7328 311.8731 312.0135 312.1538 312.2942 312.4345 312.5748 312.7151 312.8554 312.9957 313.1359 313.2762 313.4164 313.5566 313.6969 313.8371 313.9773 314.1174 314.2576 314.3978 314.5379 314.6781 314.8182 314.9583 315.0984 315.2385 315.3786 315.5186 315.6587 315.7987 315.9388 316.0788 316.2188 316.3588 316.4988 316.6387 316.7787 316.9186 317.0586 317.1985 317.3384 317.4783 317.6182 317.7581 317.8979 318.0378 318.1776 318.3175 318.4573 318.5971 318.7369 318.8767 319.0164 319.1562 319.2959 319.4357 319.5754 319.7151 319.8548 319.9945 320.1342 320.2738 320.4135 320.5531 320.6928 320.8324 320.9720 321.1116 321.2512 321.3907 321.5303 321.6698 321.8094 321.9489 322.0884 322.2279 322.3674 322.5068 322.6463 322.7857 322.9252 323.0646 323.2040 323.3434 323.4828 323.6222 323.7616 323.9009 324.0403 324.1796 324.3189 324.4582 324.5975 324.7368 324.8761 --------------------------------------------------------------------------------------- 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 20250717T131603.3Z 9329.552816 222 1 53.45 2 73.57 75.43 29.73 214.71 0.00 1 0.00 1 0 17 1.467e-01 1.225e-02 6.356e-02 4.010e-03 4.320606e-01 2.065762e-03 4.850858e-03 -6.000000e+00 8.533441e-02 231.42 -2.00 3.36 -2.00 319.62 0.00e+00 7.421539e-04 5.987771e-04 1.114535e-03 -6.000000e+00 3.856608e-03 287.25 -2.00 20.00 -2.00 318.84 0.00e+00 3.478 0.001 302.00 328.00 3 4.7618e+00 5.9448e-03 3.8026e-02 -6.0000e+00 2.1368e-01 3.0806e-02 7.0550e-03 2.2535e-02 -6.0000e+00 2.3159e-01 -4.5883e-02 5.5063e-03 1.1022e-02 -6.0000e+00 1.3744e-01 1.8208e-02 2.8685e-03 3.0289e-03 -6.0000e+00 5.8316e-02 1.2228e-04 5.3736e-04 1.1577e-04 3.4575e-05 -6.0000e+00 3.9472e-03 6.0294e-02 0.0000e+00 12 9 8 11 8 0 96.50 26.39 0.37 0.06029 0.06433 14 2 1 5 0 3817.620 34.00 20.00 26.39 27.35 5.9 963.72 57309 -54937 -74797 52497 900000 -44134 -48069 -19293 -14513 -74386 13904 16246 -8389 -302 -5298 -21459 15526 900000 -5349 -11260 3765 -5885 -2856 -9801 28818 3690 -1318 -13174 -13 17821 -11001 -2108 1191 4411 -6643 5778 -8936 -3389 2366 1658 1529 2718 -5207 3566 2500 9688 341 2651 -893 2705 -874 1711 -2356 36 4789 380 199 2131 876 4595 -443 64 4022 2794 1159 -217 -1661 2340 -1955 -382 2041 1427 225 2115 -1624 -2593 427 -1988 -2482 -2451 -666 -1946 617 -1971 766 2642 1639 -3777 506 -910 373 -1588 -408 -1221 -82 -912 1733 -103 420 -286 -911 -1399 -153 -417 -1164 -727 -185 658 719 1184 97 689 466 -1558 -612 -821 -378 -844 272 333 1183 1612 1537 -53 -114 -416 -484 318 670 -193 -244 100 154 -24 -132 108 570 376 537 -73 -1227 -893 570 -1777 -2844 504 900000 -1259 -1616 -551 -425 -4042 332 445 -354 -14 -298 -1543 825 900000 -391 -898 258 -458 -232 -916 1926 322 -115 -1231 -1 1379 -1286 -253 147 500 -821 689 -1450 -633 498 392 384 703 -1486 935 669 2412 93 714 -257 811 -298 612 -941 15 1928 164 86 884 363 1886 -207 33 2187 1580 631 -114 -880 1281 -1279 -248 1353 951 145 1364 -975 -1435 223 -1135 -1641 -1859 -507 -1628 529 -1858 754 2692 1743 -4257 528 -893 333 -1347 -338 -1099 -82 -1045 2181 -131 526 -369 -1081 -1544 -169 -504 -1499 -977 -262 902 1074 1903 163 1130 725 -2296 -842 -1130 -542 -1296 438 542 1863 2455 2254 -75 -169 -590 -696 455 1046 -327 -432 182 292 -45 -261 219 1172 779 1073 -140 -2459 -1729 SS 20250717T132720.3Z 9329.560651 225 1 54.35 2 71.32 76.86 31.06 219.43 0.00 1 0.00 1 0 17 3.916e-02 7.376e-03 1.509e-02 1.794e-03 3.893880e-01 9.148860e-04 4.314252e-03 -6.000000e+00 2.258145e-02 231.42 -2.00 3.36 -2.00 318.79 0.00e+00 1.294583e-03 2.049832e-04 3.363543e-04 -6.000000e+00 1.008246e-03 287.25 -2.00 20.00 -2.00 317.99 0.00e+00 3.084 0.000 302.00 328.00 3 3.9867e+00 2.5328e-03 3.3650e-02 -6.0000e+00 5.6518e-02 -1.5226e-04 2.9108e-03 1.9488e-02 -6.0000e+00 6.1159e-02 -1.9117e-02 2.0374e-03 9.5814e-03 -6.0000e+00 3.6412e-02 7.6306e-03 1.0741e-03 2.9607e-03 -6.0000e+00 1.5547e-02 3.9893e-04 7.3331e-04 5.0827e-05 2.9758e-05 -6.0000e+00 1.0537e-03 6.0267e-02 0.0000e+00 11 9 0 11 8 0 99.12 26.41 0.40 0.06027 0.06578 41 4 1 5 0 1325.530 34.00 20.00 26.41 27.34 5.9 964.57 2168 -18161 -13932 9318 16682 -7751 -15155 -14455 885 -17439 -98 -1147 -187 3505 5057 -1834 3319 -10569 -177 -1667 1354 439 3076 -204 4711 1186 231 -3787 1406 6073 -1307 -652 -479 -3186 -2794 1157 -4261 -1838 541 -297 -520 -1069 -1853 1428 657 2200 153 -1426 -742 600 -28 766 76 672 1082 -185 437 -74 -327 1272 776 1292 2441 573 22 -124 -1385 425 -155 691 758 917 957 228 -688 -1273 -1527 -1886 -1394 -998 -926 -1800 -428 -982 191 857 801 1433 871 745 421 -756 -844 -611 -217 174 1157 353 -55 -409 -1187 -940 -574 -1071 -1094 -870 -674 350 864 829 608 498 -31 -1026 -288 -880 -331 9 353 -41 562 701 736 501 -292 -202 278 -162 285 -332 -73 -318 169 162 104 187 747 499 286 -223 -923 -1047 74 -804 -568 271 432 -273 -647 -690 39 -931 -5 -64 -12 264 429 -180 329 -1278 -20 -198 156 52 383 -28 645 170 32 -515 184 834 -217 -120 -93 -600 -511 222 -1012 -517 160 -99 -183 -394 -702 525 246 808 57 -542 -287 246 -13 367 39 360 593 -105 247 -41 -180 711 433 791 1612 394 14 -76 -854 276 -116 565 599 723 784 174 -477 -808 -1022 -1235 -1043 -849 -815 -1726 -425 -1051 201 947 916 1635 965 766 430 -724 -794 -616 -227 204 1515 468 -73 -508 -1455 -1068 -663 -1354 -1464 -1136 -928 507 1264 1304 988 791 -46 -1539 -405 -1238 -484 14 546 -64 863 1045 1123 728 -410 -269 373 -238 454 -533 -122 -546 301 289 196 362 1469 935 550 -413 -1644 -1814 SS 20250717T133345.3Z 9329.565108 229 1 16.84 2 70.04 77.68 31.88 221.96 0.00 1 0.00 1 0 17 1.833e-02 7.239e-03 4.692e-03 1.127e-03 3.671354e-01 5.730210e-04 4.091276e-03 -6.000000e+00 1.056811e-02 231.42 -2.00 3.36 -2.00 317.80 0.00e+00 8.919119e-04 9.572664e-05 2.139473e-04 -6.000000e+00 4.719568e-04 287.26 -2.00 20.00 -2.00 316.97 0.00e+00 2.898 0.000 302.00 328.00 3 2.3406e+00 1.5371e-03 3.1583e-02 -6.0000e+00 2.6450e-02 -3.3572e-03 1.7349e-03 1.8211e-02 -6.0000e+00 2.8624e-02 -2.4684e-02 1.0814e-03 8.8321e-03 -6.0000e+00 1.7042e-02 1.1787e-02 5.5135e-04 2.5235e-03 -6.0000e+00 7.2749e-03 2.5106e-03 4.6055e-04 3.1256e-05 2.5237e-05 -6.0000e+00 4.9319e-04 6.1395e-02 0.0000e+00 12 9 1 12 1 1 -16.77 26.42 0.44 0.06139 0.06486 55 19 1 5 0 300.600 34.00 20.00 26.42 27.47 6.0 966.03 -3106 -2163 -5673 -7647 -6621 -5508 -4473 -5471 -1894 -7452 -4829 -2760 -1772 960 3115 7 1890 -478 994 702 1142 2266 1749 1039 1010 799 -836 -1925 -404 561 276 -87 -886 -3845 -2551 -2939 -2543 -458 11 -359 -71 100 -1 1206 146 306 122 -933 -56 936 604 1002 650 682 1127 124 98 -330 -423 489 952 1497 2078 346 26 -468 -1034 416 439 492 995 752 1029 326 -476 -1299 -2107 -1626 -1449 -1264 -994 -2012 -1171 -815 -112 680 1109 1205 1041 826 -4 -270 -754 -532 -496 328 976 449 -32 -446 -1212 -1065 -597 -1166 -941 -694 -552 226 839 967 622 516 -76 -648 -450 -446 -202 184 349 274 698 585 433 549 -302 -351 372 149 -2 -275 -159 -157 -20 -98 293 609 658 288 -68 -244 -687 -982 -239 -173 -449 -553 -453 -396 -358 -498 -178 -747 -492 -318 -218 135 488 1 340 -93 199 145 234 470 390 249 232 186 -205 -450 -93 140 71 -25 -267 -1131 -720 -908 -845 -181 5 -173 -36 49 0 597 74 153 61 -466 -28 501 353 586 407 445 752 81 64 -224 -284 335 659 1136 1610 278 20 -354 -775 310 374 438 878 666 918 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