File name: Pandora55s1_QueensNY_20220523_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T121445.0Z 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_20220523_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: 20220523 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 20220523T111251.3Z 8178.467261 179 1 50.06 2 72.90 77.21 54.24 169.06 0.00 1 0.00 1 0 25 1.461e-01 1.045e-02 3.880e-02 2.141e-03 4.769041e-01 1.134161e-03 5.539714e-03 -6.000000e+00 8.767370e-02 231.58 -2.00 3.51 -2.00 319.20 0.00e+00 -1.513688e-04 2.923993e-04 3.571225e-04 -6.000000e+00 3.910761e-03 284.44 -2.00 20.00 -2.00 318.47 0.00e+00 3.350 0.001 302.00 328.00 3 3.2274e+00 3.1818e-03 4.2016e-02 -6.0000e+00 2.1950e-01 5.2551e-02 3.7113e-03 2.5245e-02 -6.0000e+00 2.3730e-01 -3.5067e-05 2.8165e-03 1.2288e-02 -6.0000e+00 1.4127e-01 -1.0851e-02 1.4671e-03 3.3656e-03 -6.0000e+00 5.9033e-02 4.0557e-04 -1.0027e-03 6.4691e-05 4.0189e-05 -6.0000e+00 4.3736e-03 2.4230e-04 4.0828e-05 12 9 8 11 40 0 98.22 22.82 0.17 0.00024 -0.00729 26 5 1 5 0 1924.960 25.68 20.01 22.82 22.63 32.3 1100.00 -4465 48995 900000 -83175 56315 12579 2671 85821 4874 -5389 -24150 -12464 -40217 5904 35371 2985 -22127 14981 31201 26275 11752 990 8923 -16338 5311 -8660 34747 -8999 -1469 -15326 2070 1977 -564 -12190 705 17203 -6004 -1487 3945 4955 -5471 2951 -6825 -4217 -1003 3743 -3415 2378 1384 3033 -601 -1180 -948 3235 3588 974 4679 631 -1504 258 446 3836 1333 -788 133 -1135 715 846 740 1165 -327 -588 835 -1907 1694 -636 1918 2806 1252 -987 -758 825 -957 -478 -2246 -857 -1345 -458 -1373 -304 -571 -125 552 1733 1439 1063 475 447 -578 -836 -246 -709 473 1099 303 -704 -333 -432 -24 553 -232 -1068 -194 36 -331 547 1095 1610 262 -152 -1083 -443 4 590 -13 -439 466 975 615 -216 633 121 350 327 395 -330 -370 162 -365 -398 -348 -130 224 -60 -75 578 900000 -3523 625 203 50 831 113 -150 -838 -418 -1998 229 1246 164 -1686 878 1682 1567 830 79 679 -1673 482 -951 2614 -999 -148 -1758 218 235 -77 -1978 102 2123 -956 -259 776 1132 -1539 835 -2194 -1359 -318 1153 -1120 747 446 991 -213 -453 -391 1376 1604 460 2218 312 -752 126 218 1903 726 -470 83 -716 431 500 452 769 -237 -452 648 -1489 1237 -444 1223 1704 779 -673 -573 676 -854 -448 -2220 -878 -1442 -504 -1540 -336 -616 -128 536 1620 1371 1080 526 538 -747 -1121 -326 -902 565 1270 357 -871 -427 -572 -33 792 -353 -1700 -312 57 -512 809 1574 2312 390 -235 -1727 -708 6 905 -19 -646 663 1359 873 -323 1001 200 596 568 708 -616 -710 316 -718 -785 -674 -246 410 -108 SS 20220523T111912.9Z 8178.471677 183 1 50.54 2 71.72 78.17 54.01 170.91 0.00 1 0.00 1 0 25 1.149e-01 8.327e-03 2.096e-02 1.687e-03 4.465520e-01 8.876908e-04 5.211371e-03 -6.000000e+00 6.890823e-02 231.58 -2.00 3.51 -2.00 318.87 0.00e+00 1.026645e-03 2.052536e-04 2.919263e-04 -6.000000e+00 3.034924e-03 284.44 -2.00 20.00 -2.00 318.12 0.00e+00 3.147 0.001 302.00 328.00 3 3.0346e+00 2.4543e-03 3.9418e-02 -6.0000e+00 1.7252e-01 4.9571e-02 2.8232e-03 2.3662e-02 -6.0000e+00 1.8651e-01 -1.1872e-02 2.0105e-03 1.1437e-02 -6.0000e+00 1.1097e-01 -1.9954e-03 1.0461e-03 3.3207e-03 -6.0000e+00 4.6217e-02 6.2110e-04 -9.8826e-04 5.0938e-05 3.8146e-05 -6.0000e+00 3.4335e-03 -3.8220e-04 2.8527e-05 11 9 0 11 8 0 97.14 22.82 0.17 -0.00038 -0.00781 36 7 1 5 0 1403.560 25.68 19.99 22.82 22.76 32.4 1100.00 -30965 21284 83647 -43379 -3233 21788 -19739 61443 -5571 -6459 -19386 -18804 -18596 -9773 24518 -7878 -6257 -11607 18447 4800 6252 2631 2807 -6638 -2578 -3237 11721 -1754 -6174 -6085 -4122 2742 -2224 -6233 -2047 10188 -2493 -3014 4773 -592 -2712 -750 -3919 -3047 -1238 2430 -1808 1752 440 3196 177 591 -456 3219 2094 610 3180 903 2297 177 1123 2717 1831 -815 425 -1266 783 -326 1919 939 -578 -216 -178 -1180 661 -295 256 2278 423 -402 -528 121 -1368 -884 -1961 -1227 -1037 -768 -631 -592 -127 259 516 794 1170 973 384 745 -365 -380 -543 -662 163 1328 196 -389 -496 -790 92 334 131 -922 -68 -257 -24 527 882 1201 604 -191 -907 -346 -51 118 -107 194 404 1320 437 80 315 59 449 218 85 -529 52 91 -133 -523 -14 -411 -11 -4 -977 474 1116 -1853 -90 463 -645 1056 -199 -251 -886 -911 -1026 -593 1281 -637 -548 -1147 1475 457 608 270 293 -797 -320 -426 1374 -228 -813 -802 -572 399 -378 -1167 -372 1629 -465 -636 1110 -167 -870 -254 -1419 -1125 -455 875 -677 639 163 1190 71 252 -210 1527 1049 319 1678 488 1221 95 600 1494 1087 -529 285 -861 509 -209 1242 660 -444 -175 -146 -966 514 -218 176 1478 281 -287 -417 104 -1268 -858 -1994 -1294 -1140 -869 -722 -674 -140 273 516 768 1143 1010 432 902 -474 -510 -724 -847 197 1548 234 -486 -643 -1058 128 481 198 -1460 -109 -407 -37 774 1261 1717 888 -293 -1431 -548 -80 180 -160 283 574 1828 617 118 492 96 749 373 150 -966 97 173 -255 -1009 -27 -761 -19 -7 SS 20220523T112431.5Z 8178.475365 186 1 49.49 2 70.73 78.96 53.85 172.47 0.00 1 0.00 1 0 25 3.670e-02 6.402e-03 8.625e-03 1.008e-03 4.301863e-01 5.297373e-04 5.045873e-03 -6.000000e+00 2.201830e-02 231.58 -2.00 3.51 -2.00 318.67 0.00e+00 4.945934e-04 1.145686e-04 2.396446e-04 -6.000000e+00 9.697280e-04 284.44 -2.00 20.00 -2.00 317.91 0.00e+00 2.995 0.000 302.00 328.00 3 2.1768e+00 1.4550e-03 3.7681e-02 -6.0000e+00 5.5125e-02 4.1446e-02 1.6633e-03 2.2704e-02 -6.0000e+00 5.9594e-02 -9.3126e-03 1.1453e-03 1.0994e-02 -6.0000e+00 3.5457e-02 -3.4553e-03 5.9353e-04 3.0509e-03 -6.0000e+00 1.4768e-02 1.7384e-03 -9.3256e-04 3.0531e-05 3.6197e-05 -6.0000e+00 1.0971e-03 -8.2323e-04 2.2377e-05 11 9 0 11 8 0 99.00 22.82 0.11 -0.00082 -0.00783 125 24 1 5 0 395.800 25.68 19.98 22.82 22.82 32.4 1100.00 -14716 -4457 14111 -23766 -6606 -6318 -8875 11038 -4355 -5387 -13237 -4643 -8284 -1142 3270 -2892 -5869 -323 3031 2778 1068 -167 3509 -3483 -1255 -2024 4340 -2640 -2047 -3281 1160 1533 -536 -3182 -1368 3839 -479 435 1513 274 -2146 -840 -2622 -1679 -1217 513 -1225 -466 172 1134 574 514 805 1451 1086 558 1370 656 873 912 980 1806 1652 345 -490 -190 351 845 1315 878 -32 -466 -223 -914 -178 -246 449 1358 1124 258 -43 -524 -1464 -1093 -1148 -960 -1096 -591 -616 -555 -77 373 705 1432 1422 1212 752 719 -530 -596 -380 -518 67 926 -39 -894 -406 -670 -110 14 -198 -597 -258 -151 -18 752 880 1014 538 -322 -604 -334 -65 -121 49 4 477 1305 772 274 383 -71 310 177 142 -370 -41 212 -562 -397 -153 -188 -43 95 -495 -155 438 -1032 -231 -212 -320 368 -187 -252 -694 -238 -497 -76 245 -261 -596 -33 322 311 125 -20 418 -466 -176 -302 623 -395 -297 -478 173 253 -100 -642 -273 722 -97 98 398 84 -747 -310 -1021 -663 -484 203 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