File name: Pandora55s1_QueensNY_20220120_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T111046.0Z 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_20220120_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: 20220120 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 20220120T172005.4Z 8055.722285 414 1 49.46 2 60.83 183.69 118.26 327.82 0.00 1 0.00 1 0 25 2.056e-02 6.676e-03 4.912e-03 1.262e-03 3.165572e-01 6.445873e-04 3.814031e-03 -6.000000e+00 1.199739e-02 223.95 -2.00 3.51 -2.00 317.59 0.00e+00 -3.439442e-04 1.006539e-04 1.209178e-04 -6.000000e+00 5.233798e-04 275.31 -2.00 20.00 -2.00 317.00 0.00e+00 2.043 0.000 302.00 328.00 3 3.6652e+00 1.6965e-03 2.5863e-02 -6.0000e+00 2.9593e-02 2.5470e-02 1.9142e-03 1.5972e-02 -6.0000e+00 3.2213e-02 5.8639e-03 1.1864e-03 7.9818e-03 -6.0000e+00 1.9178e-02 -8.2340e-03 5.9345e-04 2.2888e-03 -6.0000e+00 8.0479e-03 1.1767e-03 -1.1206e-04 3.8899e-05 2.8737e-05 -6.0000e+00 6.1314e-04 -2.4548e-03 1.5121e-04 11 8 0 10 0 0 99.99 22.70 0.14 -0.00245 -0.00330 122 23 1 5 0 405.300 25.58 19.99 22.70 7.19 29.6 992.51 -3129 -3324 7610 -12284 -732 187 -1948 9054 1112 -2522 -6711 447 -3700 -5853 3402 401 -4080 3700 2083 1935 -116 -360 1104 -1181 606 -654 2508 -1297 214 -484 2303 2505 1931 -2824 -739 3234 -708 39 977 73 -1902 -842 -2349 -1095 -1358 45 -1853 -616 -409 612 343 203 418 959 1616 233 1520 363 1390 1054 1520 1888 1179 -43 -589 -555 383 253 1120 1021 -264 -504 -426 -701 -55 -328 507 1006 1476 246 -221 -327 -1147 -1346 -1292 -817 -672 -493 -568 -449 -37 326 510 1352 1113 1404 583 604 -237 -677 -321 -677 295 787 157 -774 -359 -794 -115 159 -130 -554 -103 -177 -117 526 726 985 361 -269 -689 -386 -95 -45 123 40 538 1230 834 216 467 -16 281 217 413 -221 -87 202 -519 -497 -267 -159 -47 -40 -253 -297 640 -1208 -60 15 -160 742 109 -273 -770 50 -468 -860 524 70 -796 705 419 405 -25 -79 245 -279 149 -170 640 -334 52 -115 552 646 542 -863 -220 908 -212 13 373 32 -939 -437 -1272 -597 -745 24 -1014 -331 -217 325 187 117 254 606 1055 158 1041 252 954 717 1036 1327 884 -34 -487 -454 297 190 846 825 -232 -466 -402 -655 -50 -279 400 749 1088 193 -190 -305 -1144 -1400 -1399 -919 -788 -596 -698 -547 -44 366 540 1365 1125 1484 664 738 -309 -911 -426 -864 355 923 189 -980 -471 -1075 -161 230 -195 -862 -161 -271 -172 737 986 1333 503 -391 -1038 -587 -143 -66 178 56 731 1622 1111 300 680 -24 432 339 662 -368 -149 351 -916 -880 -466 -271 -79 -65 SS 20220120T172533.2Z 8055.726079 418 1 50.23 2 60.91 185.15 118.79 329.12 0.00 1 0.00 1 0 17 2.623e-02 7.652e-03 4.696e-03 1.384e-03 3.162015e-01 7.082518e-04 3.816493e-03 -6.000000e+00 1.530420e-02 223.95 -2.00 3.51 -2.00 317.30 0.00e+00 -1.380316e-04 1.023232e-04 1.157497e-04 -6.000000e+00 6.677062e-04 275.31 -2.00 20.00 -2.00 316.71 0.00e+00 2.048 0.000 302.00 328.00 3 3.9776e+00 1.8533e-03 2.5874e-02 -6.0000e+00 3.7750e-02 3.0760e-02 2.0866e-03 1.5927e-02 -6.0000e+00 4.1094e-02 -2.8752e-03 1.2666e-03 7.9533e-03 -6.0000e+00 2.4465e-02 -2.9958e-03 6.2422e-04 2.2730e-03 -6.0000e+00 1.0265e-02 8.5650e-04 -3.2337e-04 4.2392e-05 2.8936e-05 -6.0000e+00 7.8225e-04 -2.5270e-03 1.1466e-04 11 8 0 10 0 0 99.94 22.69 0.25 -0.00253 -0.00496 41 8 1 5 0 1224.930 25.58 20.02 22.69 7.27 29.6 992.63 -5312 -730 11703 -15244 1487 658 -5027 10551 -1041 -1044 -8119 169 -6283 -8902 5057 -845 -3259 -2110 4848 1951 2421 -941 2058 -2352 931 -586 3840 -1521 -724 -1005 2510 2911 955 -3279 -1227 3671 -1591 -269 1033 82 -1898 -332 -1950 -1407 -713 882 -1533 255 16 771 713 269 168 1654 1695 512 1565 461 1216 880 1329 1915 1090 -397 -330 -916 101 158 1280 704 -323 -570 -220 -865 354 -243 577 1698 920 327 -752 -256 -1709 -1131 -1614 -961 -1002 -625 -680 -400 -237 92 425 1288 1299 1376 650 600 -81 -881 -463 -526 135 1111 -44 -723 -209 -773 32 345 -110 -557 -222 -176 -231 518 761 978 465 -169 -854 -458 124 287 163 206 344 1136 685 225 503 -30 605 358 347 -208 141 39 -366 -525 -336 -410 -223 -122 -511 -75 1110 -1800 141 59 -493 992 -120 -129 -1090 22 -937 -1544 881 -171 -719 -482 1085 463 586 -237 511 -630 256 -170 1087 -440 -199 -270 674 837 302 -1117 -408 1144 -533 -99 432 39 -1007 -184 -1124 -820 -414 508 -894 146 9 436 414 164 108 1098 1163 362 1121 335 873 627 948 1405 851 -329 -281 -775 82 123 1001 588 -291 -540 -211 -828 325 -213 470 1305 708 265 -665 -243 -1735 -1191 -1767 -1091 -1183 -758 -836 -488 -281 104 456 1319 1329 1472 743 734 -106 -1181 -613 -669 163 1306 -53 -913 -272 -1037 44 491 -163 -852 -341 -265 -337 721 1024 1317 643 -243 -1271 -686 184 419 233 286 464 1489 907 310 723 -44 916 550 547 -338 236 66 -630 -907 -573 -686 -363 -197 SS 20220120T175113.7Z 8055.743908 436 1 44.51 2 61.63 191.98 121.04 335.47 0.00 1 0.00 1 0 17 3.891e-02 8.864e-03 6.772e-03 1.832e-03 3.251888e-01 9.368384e-04 3.900688e-03 -6.000000e+00 2.271748e-02 223.95 -2.00 3.51 -2.00 317.42 0.00e+00 -2.025307e-04 1.402083e-04 1.112210e-04 -6.000000e+00 9.905101e-04 275.31 -2.00 20.00 -2.00 316.83 0.00e+00 2.095 0.000 302.00 328.00 3 4.2915e+00 2.4566e-03 2.6503e-02 -6.0000e+00 5.6036e-02 3.5567e-02 2.7687e-03 1.6342e-02 -6.0000e+00 6.0987e-02 6.8639e-04 1.7006e-03 8.1593e-03 -6.0000e+00 3.6310e-02 -5.6179e-03 8.4581e-04 2.3354e-03 -6.0000e+00 1.5244e-02 5.8763e-04 3.7117e-04 5.6058e-05 2.9264e-05 -6.0000e+00 1.1600e-03 -3.6493e-03 2.5174e-04 12 9 1 12 33 1 99.98 22.70 0.16 -0.00365 -0.00086 21 5 1 5 0 2015.070 25.58 20.01 22.70 7.29 29.7 992.96 -9462 1634 22003 -21065 -1967 1112 -8647 16302 -714 -3725 -10461 -1727 -9774 1620 8796 -693 -6032 11236 4733 2856 3813 -2083 1279 -2220 -840 -889 4313 -1739 -1525 -747 -88 2880 -301 -4254 -1719 5023 -1992 -1784 2676 -537 -2390 -650 -2698 -1880 -698 1050 -1477 154 37 1735 -196 235 -468 1432 1899 283 2236 667 1964 586 1883 1991 1629 -665 -361 -1084 432 -363 1588 703 -227 -419 -38 -971 14 285 714 2304 555 316 -806 -103 -1087 -1303 -1548 -1228 -1275 -553 -571 -130 -514 343 413 1317 1352 1665 -94 373 -454 -861 -685 -736 148 1035 299 -586 -452 -726 -12 547 132 -615 127 -79 -224 482 952 1234 372 -215 -1025 -404 -97 258 -33 339 13 1017 495 233 589 87 517 204 381 -49 396 111 -495 -659 -333 -434 -97 -106 -849 148 1721 -2379 -174 91 -798 1320 -75 -431 -1319 -208 -1384 237 1376 -131 -1276 2144 992 632 857 -498 300 -562 -222 -246 1152 -478 -400 -190 -23 790 -92 -1401 -552 1487 -644 -639 1065 -249 -1235 -350 -1520 -1071 -395 589 -839 86 20 950 -112 141 -296 935 1281 197 1569 476 1381 411 1318 1438 1249 -545 -304 -910 344 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