File name: Pandora55s1_QueensNY_20220401_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T115116.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220401_L1_smca1c19d20211111p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20220401 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20220401T121311.6Z 8126.509162 83 1 45.37 2 72.99 98.72 78.07 97.46 0.00 1 0.00 1 0 25 7.010e-02 6.056e-03 7.865e-03 4.957e-04 5.325227e-01 2.589787e-04 6.235085e-03 -6.000000e+00 4.142064e-02 227.50 -2.00 3.51 -2.00 319.31 0.00e+00 1.044152e-03 6.857422e-05 4.471526e-04 -6.000000e+00 1.809976e-03 278.88 -2.00 20.00 -2.00 318.69 0.00e+00 3.367 0.001 302.00 328.00 3 2.3908e-01 7.2178e-04 4.3658e-02 -6.0000e+00 1.0288e-01 5.4679e-02 8.4352e-04 2.7811e-02 -6.0000e+00 1.1167e-01 -2.9220e-02 6.7069e-04 1.3694e-02 -6.0000e+00 6.6439e-02 2.8717e-03 3.5220e-04 3.9797e-03 -6.0000e+00 2.7750e-02 7.4323e-03 -1.3932e-03 1.4522e-05 4.7795e-05 -6.0000e+00 2.0929e-03 -1.8792e-03 -4.9037e-05 10 0 0 10 0 0 95.60 22.64 0.18 -0.00188 -0.01235 600 113 1 5 0 75.590 25.58 19.99 22.64 16.58 31.3 1094.33 -29810 -21144 -15741 -25889 -28445 -21237 -32606 -12655 -20593 -20125 -20543 -16664 -13245 -8440 -1968 -5609 -4960 -3586 -134 -1829 -1471 -2053 -1158 -2435 -3161 -3559 -2818 -3031 -2995 -1565 -755 933 393 -2812 -1329 -187 -1579 -646 725 -926 -1286 -1102 -1472 -1195 -404 171 -484 317 272 1405 1276 1394 1289 1301 1141 726 825 100 393 649 1656 1495 1663 683 -46 178 592 734 1482 951 201 -229 -682 -686 -864 -184 293 732 1045 263 45 -640 -1489 -1421 -1162 -1123 -795 -634 -481 -582 16 602 709 1526 1507 1265 852 701 -376 -548 -463 -413 131 772 -268 -961 -469 -765 -69 -126 -230 -468 -238 -49 138 747 965 916 394 -280 -677 -292 -163 -229 43 48 547 1438 812 128 323 -139 263 127 137 -387 -172 121 -390 -410 -124 -79 -1 131 -485 -370 -282 -511 -544 -365 -659 -237 -474 -504 -549 -468 -424 -318 -85 -298 -295 -212 -8 -121 -101 -144 -83 -189 -269 -324 -261 -277 -268 -141 -74 104 50 -405 -190 -26 -234 -100 135 -210 -335 -291 -413 -345 -117 50 -145 95 84 445 433 520 494 540 505 338 397 49 190 308 781 745 856 394 -27 105 359 437 915 619 140 -172 -527 -519 -616 -126 182 454 662 176 33 -541 -1340 -1311 -1137 -1113 -833 -695 -536 -641 17 614 674 1456 1409 1308 957 855 -492 -731 -609 -528 159 880 -315 -1209 -594 -1024 -93 -178 -342 -751 -380 -77 214 1131 1400 1333 600 -436 -1099 -472 -257 -347 65 70 790 2000 1170 195 522 -235 449 226 248 -723 -336 243 -770 -807 -245 -153 -2 242 SS 20220401T132326.9Z 8126.557950 130 1 44.14 2 60.15 111.74 65.26 109.46 0.00 1 0.00 1 0 25 1.120e-02 6.286e-03 3.997e-03 8.461e-04 3.245739e-01 4.367388e-04 3.878742e-03 -6.000000e+00 6.628046e-03 227.50 -2.00 3.51 -2.00 318.03 0.00e+00 -2.663121e-05 7.655593e-05 1.829565e-04 -6.000000e+00 2.894350e-04 278.88 -2.00 20.00 -2.00 317.36 0.00e+00 2.000 0.000 302.00 328.00 3 2.5381e+00 1.1678e-03 2.6148e-02 -6.0000e+00 1.6463e-02 1.7747e-02 1.3205e-03 1.6707e-02 -6.0000e+00 1.7863e-02 1.0619e-02 8.3844e-04 8.2392e-03 -6.0000e+00 1.0628e-02 -1.0625e-02 4.2390e-04 2.3173e-03 -6.0000e+00 4.4438e-03 3.6862e-03 -3.5443e-05 2.6336e-05 2.8673e-05 -6.0000e+00 3.3448e-04 -4.4828e-03 1.4030e-04 10 0 0 10 0 0 100.00 22.64 0.13 -0.00448 -0.00475 752 142 1 5 0 58.610 25.58 20.00 22.64 17.89 31.4 1100.00 -2482 -1369 -229 -5864 -2863 -41 -293 2915 1900 -1874 973 -71 1268 -321 2691 -1638 -1738 -560 996 312 -757 746 703 582 -129 -150 -239 -788 -100 1222 1771 2044 1833 -1762 -750 1097 1314 345 915 -899 -1663 -1493 -1784 -1429 -1129 -701 -1315 -838 -710 670 487 759 642 762 873 561 1180 241 727 659 1770 1537 1189 21 -676 -377 148 816 1548 992 -56 -436 -498 -566 -617 41 598 1313 1630 659 224 -582 -1211 -1213 -1071 -973 -748 -532 -609 -540 -66 489 565 1663 1593 1517 841 677 -447 -535 -474 -433 207 911 4 -707 -403 -761 -183 -28 -131 -500 -291 -221 -61 637 846 961 474 -239 -680 -383 -337 -216 53 5 479 1425 944 209 436 -60 222 140 273 -282 -113 112 -372 -382 -208 -158 -71 160 -160 -97 -17 -442 -196 -3 -19 205 150 -163 85 -6 125 -37 343 -242 -275 -92 169 55 -139 137 131 113 -27 -33 -53 -170 -21 243 361 450 442 -459 -192 270 333 99 305 -352 -725 -694 -861 -701 -554 -345 -645 -405 -340 320 240 395 355 442 528 349 750 155 463 416 1113 1008 832 16 -530 -291 108 573 1094 758 -47 -387 -451 -508 -533 33 446 917 1127 486 183 -521 -1169 -1229 -1132 -1078 -869 -638 -742 -654 -76 540 583 1629 1561 1572 945 824 -584 -723 -633 -551 247 1061 5 -892 -530 -1032 -256 -41 -200 -794 -465 -345 -92 904 1156 1314 668 -355 -1045 -595 -517 -326 77 7 657 1890 1269 294 647 -93 350 225 451 -483 -199 202 -680 -700 -376 -280 -123 271 SS 20220401T135537.8Z 8126.580299 148 1 8.43 2 54.63 118.66 59.66 115.68 0.00 1 0.00 1 0 25 1.053e-02 6.435e-03 4.409e-03 1.768e-03 2.848803e-01 9.199438e-04 3.435068e-03 -6.000000e+00 6.227065e-03 227.51 -2.00 3.51 -2.00 316.67 0.00e+00 -6.301100e-06 1.130709e-04 9.828276e-05 -6.000000e+00 2.719303e-04 278.88 -2.00 20.00 -2.00 316.02 0.00e+00 1.723 0.000 302.00 328.00 3 2.9936e+00 2.3998e-03 2.2651e-02 -6.0000e+00 1.5467e-02 3.3617e-02 2.6858e-03 1.4545e-02 -6.0000e+00 1.6782e-02 -6.8686e-03 1.5691e-03 7.1750e-03 -6.0000e+00 9.9854e-03 -1.3971e-03 7.3819e-04 2.0114e-03 -6.0000e+00 4.1750e-03 3.2521e-03 -1.7209e-04 5.4237e-05 2.6335e-05 -6.0000e+00 3.1425e-04 -4.7265e-03 1.2695e-04 12 9 1 12 1 1 99.99 22.65 0.19 -0.00473 -0.00602 24 28 1 5 0 330.050 25.58 20.00 22.65 17.88 31.2 1100.00 -2537 -2569 -1143 -6734 -1476 275 -135 1761 1010 -1282 -1233 390 755 -153 1438 -427 -1645 125 834 1034 823 1481 1076 1339 144 -78 666 -1350 760 295 817 1020 1540 -1827 -909 1040 57 683 909 -575 -1784 -1026 -1378 -1411 -963 -563 -1098 -612 -552 585 431 105 804 681 1126 548 1072 471 953 1097 1586 1386 1202 -41 -616 -285 -135 813 1108 938 -24 -24 -458 -775 -530 -156 55 1016 1061 87 52 -1154 -1584 -1164 -1115 -1132 -656 -369 -474 -455 -234 512 331 1263 1341 1175 853 872 -193 -393 -490 -649 479 866 -11 -526 -381 -669 -145 -257 -163 -482 -149 -96 -233 553 790 605 431 -106 -570 -241 -323 -172 259 13 527 1546 884 195 445 51 360 150 17 -261 -6 50 -380 -304 -341 -192 -240 74 -355 -394 -179 -1076 -210 37 -18 258 164 -226 -220 70 146 -33 348 -114 -470 37 250 318 259 469 343 443 50 -28 241 -484 257 98 274 364 583 -737 -360 395 22 294 442 -318 -1078 -647 -893 -927 -632 -369 -716 -394 -352 369 277 71 564 496 843 419 829 367 739 841 1219 1097 1001 -36 -556 -253 -115 664 912 818 -22 -23 -455 -768 -508 -143 47 822 850 74 48 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