File name: Pandora64s1_NewHavenCT_20240609_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240610T052500.8Z 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_20240609_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: 20240609 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 20240609T161722.4Z 8926.678732 299 1 0.63 2 19.61 156.33 45.91 94.08 0.00 1 0.00 1 0 17 1.223e-02 9.399e-03 6.720e-03 4.931e-03 1.736278e-01 2.732058e-03 2.119031e-03 -6.000000e+00 7.529281e-03 232.66 -2.00 3.52 -2.00 314.59 0.00e+00 1.365200e-04 2.164536e-04 1.739466e-05 -6.000000e+00 3.305656e-04 286.00 -2.00 20.00 -2.00 313.99 0.00e+00 1.061 0.000 302.00 328.00 3 3.2845e+00 7.0388e-03 1.4141e-02 -6.0000e+00 1.8904e-02 2.4051e-02 7.7423e-03 9.1039e-03 -6.0000e+00 2.0348e-02 -5.5190e-03 4.4285e-03 4.4256e-03 -6.0000e+00 1.2095e-02 -9.9079e-04 1.9108e-03 1.2148e-03 -6.0000e+00 5.1108e-03 5.7138e-03 -4.3563e-04 1.5087e-04 1.8007e-05 -6.0000e+00 3.6400e-04 -9.0194e-03 -4.6572e-05 12 9 9 12 1 1 999.00 21.56 0.13 -0.00902 -0.01229 1 38 1 5 0 309.680 26.00 20.01 21.56 24.53 39.5 1033.46 1132 2226 -759 -428 -4122 -672 -576 3475 1804 1779 -4120 -828 -2074 -220 -260 879 -1052 1327 436 2312 2044 -1204 -114 878 521 1483 602 -323 36 751 1434 178 420 522 -4794 -1837 -1453 -1426 201 -602 -870 -1184 -694 -1916 -147 -600 -1332 170 -1093 -1176 1878 297 1157 2289 631 -572 1002 882 1046 -312 558 1710 1429 397 520 -1579 4 -1254 1322 1849 65 805 -211 609 648 -57 399 -2189 -335 -96 -512 -383 -1121 -2621 502 -1128 -168 117 850 324 438 490 -73 -369 1319 447 207 748 381 -871 -213 -1414 -1247 412 473 -1071 -1181 -1083 -606 777 54 263 312 355 -526 198 278 -416 952 217 -435 -532 573 -367 778 1887 -832 734 1532 20 983 -374 -814 -601 190 380 -539 -143 341 80 -696 -268 420 842 -293 -155 -1408 -232 -202 1291 702 705 -1682 -343 -916 -105 -132 463 -549 699 236 1268 1126 -678 -66 501 307 882 350 -182 20 407 775 101 253 307 -2775 -1073 -905 -958 151 -479 -733 -999 -595 -1653 -124 -501 -1116 136 -889 -965 1524 249 1000 2039 560 -523 910 793 927 -284 525 1647 1416 398 509 -1481 3 -1129 1264 1840 68 855 -223 629 635 -52 356 -1939 -301 -92 -512 -405 -1216 -2961 577 -1362 -204 144 1031 383 500 525 -76 -386 1405 509 244 927 471 -1075 -252 -1630 -1412 490 574 -1335 -1512 -1435 -817 1056 76 361 414 455 -644 237 339 -521 1234 291 -579 -714 742 -466 955 2239 -997 889 1893 26 1259 -491 -1071 -804 262 541 -772 -209 494 115 -987 -377 SS 20240609T162130.1Z 8926.681598 302 1 48.33 2 19.32 159.04 45.16 94.80 0.00 1 0.00 1 0 17 2.357e-02 1.108e-02 5.152e-03 2.831e-03 1.843326e-01 1.547019e-03 2.212777e-03 -6.000000e+00 1.452679e-02 232.66 -2.00 3.52 -2.00 315.87 0.00e+00 1.010784e-03 1.579261e-04 5.290271e-05 -6.000000e+00 6.374885e-04 286.00 -2.00 20.00 -2.00 315.15 0.00e+00 1.059 0.000 302.00 328.00 3 6.4885e+00 4.0398e-03 1.4515e-02 -6.0000e+00 3.6473e-02 6.6755e-02 4.4723e-03 9.6856e-03 -6.0000e+00 3.9249e-02 -8.2240e-03 2.5580e-03 4.6723e-03 -6.0000e+00 2.3330e-02 -1.1940e-03 1.1478e-03 1.4156e-03 -6.0000e+00 9.8664e-03 2.2258e-04 5.2047e-04 8.8213e-05 1.7099e-05 -6.0000e+00 7.0114e-04 -9.7752e-03 1.5217e-04 12 8 8 10 0 0 99.99 21.55 -0.10 -0.00978 -0.00586 55 13 1 5 0 878.470 26.00 20.00 21.55 25.07 39.4 1036.07 3305 -720 3507 -2477 -21949 -1511 -442 -18 3059 -622 -3044 -2508 -1312 -97 1082 1999 466 3381 188 3388 1135 2096 1494 2046 352 2844 -615 -315 -1443 -1382 912 2625 1228 2048 -5558 -691 -2744 -349 -624 1076 -1231 -750 -1015 -1124 -1257 799 -1060 34 -1636 -1035 988 1042 919 1642 155 485 418 514 389 879 155 1247 1080 2470 1211 -1652 -632 -1574 686 1308 668 469 34 136 415 -1215 -433 -3234 -477 -772 -966 -2480 -1155 -2151 170 -758 1185 305 1650 812 321 -514 -931 -1129 585 388 -209 725 1300 -815 -293 -1876 -2266 -162 472 -1633 -190 -253 5 779 1757 527 456 16 -545 -816 -8 -393 585 820 -16 564 584 117 460 605 -1657 574 310 814 0 -539 -1038 68 147 268 -359 825 159 -100 -481 -916 766 -180 835 -564 -5500 -325 -100 -4 744 -160 -778 -670 -384 -31 381 737 177 1292 76 1362 467 844 623 881 159 1269 -276 -130 -571 -544 368 1083 547 888 -2423 -297 -1340 -193 -383 730 -903 -565 -784 -865 -964 594 -774 24 -1135 -720 710 786 722 1332 129 408 355 431 323 733 136 1156 1005 2337 1106 -1492 -537 -1330 617 1228 667 481 35 132 390 -1043 -340 -2529 -388 -699 -959 -2576 -1239 -2455 204 -924 1479 390 2057 1014 371 -547 -968 -1172 602 435 -258 911 1655 -1017 -360 -2194 -2613 -194 605 -2107 -254 -351 7 1170 2683 797 653 21 -706 -1018 -10 -520 782 1149 -23 786 792 158 594 743 -1995 694 397 1085 1 -764 -1436 97 222 418 -575 1335 257 -158 -742 -1378 SS 20240609T162617.1Z 8926.684921 305 1 3.27 2 19.02 162.27 44.29 95.66 0.00 1 0.00 1 0 17 9.973e-03 7.737e-03 8.714e-04 6.371e-04 1.705408e-01 3.527012e-04 2.077015e-03 -6.000000e+00 6.144640e-03 232.66 -2.00 3.52 -2.00 314.61 0.00e+00 2.906354e-04 2.792496e-05 1.879997e-05 -6.000000e+00 2.697330e-04 286.00 -2.00 20.00 -2.00 314.00 0.00e+00 1.058 0.000 302.00 328.00 3 1.5512e+00 9.0951e-04 1.3997e-02 -6.0000e+00 1.5427e-02 8.2994e-03 9.9991e-04 8.9430e-03 -6.0000e+00 1.6604e-02 -7.2584e-04 5.7196e-04 4.3388e-03 -6.0000e+00 9.8693e-03 -3.1839e-03 2.4711e-04 1.1976e-03 -6.0000e+00 4.1724e-03 3.2788e-02 -5.9149e-05 1.9468e-05 1.7634e-05 -6.0000e+00 2.9679e-04 -9.9877e-03 4.2149e-05 12 9 1 12 1 1 99.03 21.55 0.22 -0.00999 -0.01043 69 247 1 5 0 46.620 26.00 20.00 21.55 25.62 39.8 1038.25 1108 -914 22 -2462 -3948 -752 -108 1259 1244 651 -2555 -1242 110 37 804 781 -855 1054 270 1677 1288 -139 780 974 356 943 576 -627 -469 611 1745 191 1939 251 -4137 -1754 -1508 -927 5 -193 -1305 -1263 -511 -907 -690 -10 -812 -177 -668 -273 1119 882 681 1377 211 579 1055 644 356 439 607 1222 1056 1725 569 -1354 -141 -1280 755 1498 253 295 -134 435 335 -440 -432 -1645 -236 -154 -1241 -772 -1811 -2023 -497 -509 -5 23 627 359 306 526 -615 144 926 492 -115 912 535 -513 -362 -1151 -1317 147 475 -1371 -249 -785 -433 176 520 265 113 192 20 114 683 -86 500 380 -70 -230 502 48 845 1145 -537 775 889 390 486 -369 -529 -387 390 -82 -691 256 -28 -510 32 -627 405 -352 8 -927 -1367 -251 -38 484 480 257 -1013 -508 49 17 404 414 -437 547 144 910 704 -76 437 568 215 576 343 -349 -246 335 925 107 1131 146 -2346 -1008 -905 -643 4 -157 -1078 -1076 -442 -784 -592 -8 -663 -147 -541 -221 896 743 599 1193 187 520 952 577 316 395 568 1159 1059 1694 563 -1301 -127 -1149 723 1508 262 312 -140 435 324 -404 -383 -1426 -216 -148 -1263 -813 -1936 -2284 -572 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