File name: Pandora64s1_NewHavenCT_20240731_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240801T050442.3Z 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_20240731_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: 20240731 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 20240731T122149.6Z 8978.515157 246 1 48.20 2 62.62 89.45 20.45 125.41 0.00 1 0.00 1 0 17 5.013e-02 9.481e-03 1.263e-02 2.709e-03 3.001065e-01 1.458681e-03 3.525021e-03 -6.000000e+00 3.082652e-02 232.36 -2.00 3.52 -2.00 318.16 0.00e+00 9.624808e-04 2.693655e-04 2.150036e-04 -6.000000e+00 1.376828e-03 289.71 -2.00 20.00 -2.00 317.30 0.00e+00 2.162 0.000 302.00 328.00 3 4.5171e+00 3.9531e-03 2.6933e-02 -6.0000e+00 7.7236e-02 8.7113e-03 4.4738e-03 1.5816e-02 -6.0000e+00 8.3124e-02 1.4337e-02 2.7913e-03 7.6833e-03 -6.0000e+00 4.9538e-02 -1.0339e-02 1.4034e-03 2.3373e-03 -6.0000e+00 2.0995e-02 4.5279e-04 2.1197e-03 8.6060e-05 2.6150e-05 -6.0000e+00 1.4930e-03 7.8141e-03 3.6149e-04 12 9 8 11 8 0 100.00 21.45 0.12 0.00781 0.02374 70 17 2 5 0 688.470 25.90 20.00 21.45 31.41 40.6 1055.97 -2995 4844 -3808 5855 -52918 2676 -480 7688 149 3237 -9154 7270 -3153 -1339 2656 2881 -3236 5754 -786 4916 2040 3996 1968 613 1416 3532 -847 613 663 -4267 3142 1270 2091 446 -2506 -3271 -149 -1594 297 -2468 -692 -1280 778 -2416 217 -199 -150 -470 -753 -2838 2584 736 2318 341 987 -438 932 -438 1584 49 1546 349 1843 2305 1569 -1737 524 -1010 1797 1049 619 -68 -245 315 357 -1030 820 -2306 82 -739 -1490 -1454 -1922 -1812 -322 -274 169 141 1253 993 31 24 -593 84 351 664 -637 1304 345 -426 -915 -1254 -2219 349 -6 -1259 -259 -38 -218 824 577 197 131 116 -434 -85 387 -167 94 216 -413 87 424 71 1138 718 -1025 1160 745 282 85 -671 -579 129 823 -13 -119 478 105 -689 19 -1041 -206 325 -280 378 -5390 171 -34 567 12 262 -845 630 -350 -168 364 426 -531 913 -138 850 364 703 372 117 278 698 -181 121 127 -897 668 295 492 104 -611 -805 -40 -515 112 -1075 -298 -576 353 -1132 100 -92 -72 -223 -358 -1351 1255 387 1268 200 586 -271 574 -270 948 30 994 246 1372 1685 1166 -1245 357 -711 1371 846 529 -59 -209 255 279 -740 545 -1585 61 -621 -1324 -1414 -1972 -1973 -353 -317 203 171 1479 1104 34 25 -571 83 376 743 -797 1739 471 -561 -1133 -1454 -2570 423 -8 -1718 -351 -54 -330 1308 906 320 202 167 -617 -117 546 -238 143 337 -648 133 627 100 1599 967 -1372 1600 1107 424 135 -1089 -971 216 1450 -24 -223 903 197 -1253 33 -1786 SS 20240731T123019.7Z 8978.521061 252 1 1.32 2 61.02 90.86 19.21 129.37 0.00 1 0.00 1 0 25 1.721e-02 8.000e-03 9.609e-03 3.582e-03 2.831750e-01 1.941691e-03 3.382710e-03 -6.000000e+00 1.056015e-02 232.36 -2.00 3.52 -2.00 316.90 0.00e+00 2.772726e-04 2.578255e-04 1.252656e-04 -6.000000e+00 4.724440e-04 289.71 -2.00 20.00 -2.00 316.06 0.00e+00 2.054 0.000 302.00 328.00 3 2.6524e+00 5.1348e-03 2.5507e-02 -6.0000e+00 2.6456e-02 -2.6653e-03 5.7279e-03 1.4885e-02 -6.0000e+00 2.8495e-02 3.5668e-03 3.3520e-03 7.1820e-03 -6.0000e+00 1.6980e-02 -7.3516e-03 1.5910e-03 1.9532e-03 -6.0000e+00 7.1806e-03 3.3840e-03 8.1216e-05 1.1120e-04 2.4749e-05 -6.0000e+00 5.1250e-04 1.0726e-02 -7.6454e-05 12 9 1 12 1 1 98.81 21.45 0.19 0.01073 0.01134 4 44 1 5 0 263.280 25.90 19.98 21.45 31.63 40.4 1056.97 -434 575 -861 -8846 -12019 -1950 840 -130 2100 -2455 -1103 -2131 128 -1380 1314 -687 826 -855 1637 1497 1949 725 2548 430 1184 -677 868 -1549 -546 -1941 3842 1045 3391 -2227 -3886 -2862 -1413 -1423 1464 -319 -205 -1577 -53 -919 399 -399 -792 168 -582 850 420 794 1074 1189 -62 -112 978 296 318 732 1270 1231 1098 1696 82 -1079 -375 -773 1145 1233 -545 563 -905 895 -440 -173 -624 -1352 -135 -107 -1765 -255 -2471 -1312 -537 -55 -372 534 802 568 -418 306 -1142 1291 799 455 -500 1333 292 -722 -522 -1603 -1335 371 80 -1409 -187 -149 -204 535 647 45 384 586 345 95 440 -646 569 351 -604 -264 628 -28 1235 485 -417 199 958 257 499 -381 -1028 -636 597 -184 -130 323 187 -416 87 -695 -58 74 -120 -1207 -1586 -239 109 -19 306 -383 -170 -367 25 -308 302 -173 212 -236 455 434 562 213 776 141 378 -225 292 -501 -169 -633 1278 359 1230 -830 -1407 -1094 -603 -677 760 -180 -123 -992 -34 -587 253 -253 -494 103 -356 532 270 539 769 850 -45 -85 740 223 237 552 1006 1008 963 1469 72 -889 -298 -627 1016 1158 -529 550 -875 841 -383 -142 -506 -1107 -116 -98 -1748 -261 -2616 -1460 -616 -66 -452 650 958 661 -471 328 -1176 1333 868 527 -623 1711 383 -916 -641 -1925 -1586 449 103 -1862 -249 -208 -293 782 977 67 559 816 465 126 595 -897 810 519 -900 -384 907 -39 1672 630 -552 266 1318 365 738 -562 -1580 -995 978 -303 -220 537 316 -683 142 -1111 SS 20240731T123442.5Z 8978.524103 255 1 30.55 2 60.20 91.59 18.59 131.59 0.00 1 0.00 1 0 17 2.849e-02 8.480e-03 6.906e-03 2.201e-03 2.810320e-01 1.190781e-03 3.349302e-03 -6.000000e+00 1.749902e-02 232.36 -2.00 3.52 -2.00 317.27 0.00e+00 6.742103e-04 1.740963e-04 1.766782e-04 -6.000000e+00 7.821775e-04 289.71 -2.00 20.00 -2.00 316.43 0.00e+00 2.003 0.000 302.00 328.00 3 4.8096e+00 3.1632e-03 2.5051e-02 -6.0000e+00 4.3842e-02 3.9368e-02 3.5409e-03 1.4794e-02 -6.0000e+00 4.7208e-02 -1.6270e-03 2.1038e-03 7.1523e-03 -6.0000e+00 2.8133e-02 -4.7671e-03 1.0194e-03 1.9966e-03 -6.0000e+00 1.1906e-02 4.0332e-04 7.3329e-04 6.8772e-05 2.3680e-05 -6.0000e+00 8.4853e-04 9.6645e-03 7.9053e-05 12 9 1 12 1 1 99.98 21.45 0.08 0.00966 0.01517 25 10 1 5 0 1174.600 25.90 20.01 21.45 31.78 40.4 1057.99 -1000 605 1537 -1415 -30037 1856 -2370 1596 1366 237 -4717 849 -328 -1463 1314 1406 -690 3334 -345 3352 919 1336 1648 1244 1069 1188 -1129 -922 -49 -1763 874 -269 2009 -904 -3892 -2461 -1986 -1911 373 -110 -856 -745 174 -1344 -326 38 -107 -383 -191 -1216 1823 362 2307 483 666 226 1310 -57 782 -114 909 1073 1659 2163 378 -1439 152 -895 1300 1089 709 144 -354 423 33 -799 -237 -2287 -409 -371 -1505 -919 -1897 -1980 -570 -390 286 160 885 364 272 387 -781 187 1025 463 10 1106 419 -642 -1086 -1318 -1730 611 -273 -1673 -182 -138 -239 548 782 214 148 435 -406 -11 514 -155 373 509 -20 -80 427 83 1150 613 -849 979 938 164 160 -638 -523 -307 544 -76 -541 444 -26 -238 104 -904 -107 67 168 -152 -3786 184 -267 192 169 30 -635 119 -53 -273 270 309 -161 786 -83 847 238 346 423 338 302 343 -323 -260 -13 -502 248 -82 649 -293 -1236 -819 -743 -800 180 -57 -475 -429 102 -795 -192 22 -61 -216 -107 -712 1112 237 1564 333 467 163 942 -41 552 -83 687 836 1374 1848 313 -1128 119 -717 1086 1008 666 138 -334 392 28 -648 -180 -1769 -342 -332 -1444 -958 -2008 -2228 -654 -472 357 195 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