File name: Pandora64s1_NewHavenCT_20240113_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240114T160129.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240113_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240113 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240113T163043.4Z 8778.688003 182 1 1.88 2 63.15 172.31 70.42 139.65 0.00 1 0.00 1 0 33 2.108e-02 9.218e-03 1.247e-02 4.026e-03 3.271523e-01 2.121448e-03 3.803542e-03 -6.000000e+00 1.261310e-02 223.66 -2.00 3.52 -2.00 317.10 0.00e+00 4.932699e-04 2.938326e-04 1.104610e-04 -6.000000e+00 5.452597e-04 275.11 -2.00 20.00 -2.00 316.56 0.00e+00 2.202 0.000 302.00 328.00 3 3.0054e+00 5.5238e-03 2.7287e-02 -6.0000e+00 3.1121e-02 5.9364e-02 6.1927e-03 1.6189e-02 -6.0000e+00 3.3721e-02 -1.5864e-02 3.7338e-03 8.0729e-03 -6.0000e+00 2.0062e-02 7.7491e-04 1.8349e-03 2.5816e-03 -6.0000e+00 8.5932e-03 1.8927e-03 5.1169e-03 1.2333e-04 2.7540e-05 -6.0000e+00 6.2274e-04 -2.1697e-02 8.5534e-04 12 9 1 12 1 1 6.63 21.37 0.26 -0.02170 0.01675 3 25 1 5 0 466.050 25.90 20.00 21.37 18.12 37.4 994.06 -2587 -7142 -4223 -4735 -17224 -1937 -1064 -1337 2477 1453 -928 -3343 -206 -1129 1727 -469 1313 875 2288 769 1575 -532 394 705 -1386 936 2254 -2573 303 -1396 2790 -572 4032 316 -4686 -1156 -1466 -963 -577 -915 -583 19 -378 -973 -247 816 -678 -466 -738 -464 1413 1007 1131 1306 119 1000 1111 -100 454 117 947 901 1310 2859 2058 -1485 -139 -2140 108 1632 195 1034 -131 624 436 -331 -1655 -2399 -1736 -440 -1752 -902 -1752 -2716 -484 -4 -336 97 1050 700 709 132 -356 -458 852 843 -510 1436 915 -534 -540 -1356 -1821 255 403 -813 -389 -415 -91 445 315 161 153 -156 -395 -263 476 -511 1491 803 76 -267 439 -149 1081 820 -1629 394 1020 479 896 -363 -915 -171 676 108 -505 95 551 -455 -291 -932 -281 -864 -506 -525 -1985 -193 -113 -159 312 193 -127 -467 -32 -206 351 -107 308 218 584 191 392 -135 104 196 -411 280 655 -737 81 -392 821 -187 1376 112 -1647 -409 -540 -414 -274 -499 -319 11 -222 -575 -145 475 -393 -268 -425 -275 884 676 754 919 86 740 832 -75 332 87 728 709 1106 2373 1770 -1233 -111 -1748 95 1494 183 984 -124 584 375 -274 -1300 -1883 -1481 -397 -1689 -949 -1870 -3090 -553 -5 -404 117 1247 824 808 141 -376 -493 939 982 -637 1843 1211 -690 -683 -1672 -2195 306 516 -1049 -528 -567 -132 658 487 247 226 -224 -551 -354 649 -706 2154 1165 111 -396 630 -204 1464 1066 -2194 522 1448 697 1313 -552 -1444 -270 1086 181 -864 164 937 -752 -482 -1502 SS 20240113T163928.6Z 8778.694081 185 1 48.37 2 62.97 174.59 69.38 141.49 0.00 1 0.00 1 0 17 1.261e-02 7.433e-03 1.638e-03 4.115e-04 3.241938e-01 2.160225e-04 3.909131e-03 -6.000000e+00 7.508581e-03 223.66 -2.00 3.52 -2.00 317.67 0.00e+00 4.736632e-04 3.430641e-05 1.444111e-04 -6.000000e+00 3.259001e-04 275.11 -2.00 20.00 -2.00 317.10 0.00e+00 2.188 0.000 302.00 328.00 3 1.7937e+00 5.6756e-04 2.7288e-02 -6.0000e+00 1.8523e-02 4.4639e-02 6.3867e-04 1.6389e-02 -6.0000e+00 2.0104e-02 -1.6642e-03 4.0086e-04 8.2199e-03 -6.0000e+00 1.1959e-02 -7.1595e-03 2.0261e-04 2.4232e-03 -6.0000e+00 5.0968e-03 6.4996e-03 6.5237e-05 1.2733e-05 2.9115e-05 -6.0000e+00 3.7421e-04 -8.0212e-03 5.0167e-05 11 8 0 10 0 0 99.99 21.38 0.16 -0.00802 -0.00753 1117 269 1 5 0 43.300 25.90 20.00 21.38 18.58 37.7 996.90 472 -144 544 -3869 -7267 -2106 -540 396 1023 40 -4115 -2080 -223 -468 776 774 -742 954 548 1444 909 -580 977 1002 159 697 83 -1504 -1173 -438 1514 51 2105 -168 -4339 -2640 -1830 -1155 199 -17 -1043 -1346 -346 -1010 -458 -79 -676 -230 -670 -613 1035 401 734 1539 163 740 1114 509 121 393 600 1391 1302 2319 761 -1391 -376 -1528 661 1716 506 668 -17 638 124 -897 -899 -1942 -767 -200 -1192 -762 -1895 -1941 -460 -294 266 350 1025 639 353 406 -804 -21 744 375 -30 1174 759 -360 -463 -1543 -1813 194 479 -1365 -349 -732 -354 379 817 318 164 32 -327 -334 438 -187 656 500 -55 -249 630 -16 805 683 -1124 287 834 224 420 -585 -706 -406 548 -9 -382 442 341 -325 86 -717 38 -12 47 -323 -579 -162 -44 36 101 4 -412 -224 -27 -66 124 136 -138 185 111 301 192 -124 217 235 39 177 21 -360 -271 -104 384 14 575 -47 -1190 -746 -576 -425 86 -8 -516 -697 -183 -537 -243 -42 -353 -119 -347 -329 588 245 472 968 106 492 747 339 80 261 416 1037 1046 1820 629 -1094 -285 -1179 550 1479 468 632 -16 561 100 -708 -666 -1445 -618 -170 -1134 -747 -1983 -2147 -509 -343 323 429 1233 729 395 421 -796 -21 804 425 -38 1512 1006 -464 -592 -1845 -2118 236 621 -1774 -475 -1048 -510 579 1294 503 249 48 -456 -450 598 -268 947 749 -82 -367 943 -23 1097 942 -1529 381 1188 341 638 -920 -1148 -657 934 -17 -691 770 618 -570 145 -1181 SS 20240113T164404.6Z 8778.697276 189 1 16.87 2 62.89 175.78 68.85 142.48 0.00 1 0.00 1 0 17 1.361e-02 7.755e-03 1.321e-03 4.164e-04 3.241142e-01 2.190808e-04 3.918365e-03 -6.000000e+00 8.102459e-03 223.66 -2.00 3.52 -2.00 317.19 0.00e+00 6.279612e-04 3.078818e-05 1.087130e-04 -6.000000e+00 3.516952e-04 275.11 -2.00 20.00 -2.00 316.63 0.00e+00 2.183 0.000 302.00 328.00 3 9.8058e-01 5.7089e-04 2.7219e-02 -6.0000e+00 1.9988e-02 4.1700e-02 6.4001e-04 1.6343e-02 -6.0000e+00 2.1696e-02 -1.2760e-02 3.8812e-04 8.1778e-03 -6.0000e+00 1.2905e-02 -6.6881e-05 1.9194e-04 2.4109e-03 -6.0000e+00 5.4993e-03 1.4789e-02 -2.1324e-04 1.2767e-05 2.8954e-05 -6.0000e+00 4.0396e-04 -7.6391e-03 1.3719e-05 12 9 1 12 1 1 99.93 21.38 0.19 -0.00764 -0.00924 369 255 1 5 0 45.570 25.90 20.00 21.38 18.79 37.8 997.47 417 -1318 -128 -3755 -7400 -3787 -1688 -441 -659 -1445 -5117 -3007 -957 -498 585 779 -926 1105 529 1984 1020 -416 635 635 182 765 82 -1640 -1487 -575 1573 62 2310 -83 -4583 -2644 -1654 -1173 332 227 -765 -921 -89 -661 -157 295 -507 76 -453 -204 1204 862 857 1456 316 817 1131 606 192 403 585 1398 1280 2164 648 -1453 -351 -1576 524 1571 466 515 -136 577 107 -884 -919 -2114 -729 -324 -1192 -810 -2031 -2092 -554 -487 148 269 924 586 389 468 -688 -158 782 358 -83 1214 784 -392 -381 -1578 -1789 263 536 -1252 -287 -769 -343 243 746 356 170 115 -312 -168 531 -81 738 574 -1 -228 705 28 856 807 -969 374 935 261 484 -542 -660 -424 457 -66 -455 392 268 -401 17 -770 44 -150 -15 -405 -764 -382 -180 -52 -85 -180 -663 -419 -151 -90 120 175 -204 252 126 484 253 -104 166 176 53 227 24 -460 -403 -159 467 20 798 -29 -1595 -945 -610 -506 157 122 -417 -524 -52 -387 -92 171 -292 43 -259 -120 753 578 571 1019 228 602 842 448 141 297 451 1093 1079 1804 533 -1200 -279 -1276 434 1437 434 491 -127 538 92 -732 -715 -1654 -617 -291 -1143 -851 -2172 -2364 -633 -588 177 326 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