File name: Pandora88s1_SanAntonioTX_20250305_L2Fit_fout2c2d20240901p1-8.txt File generation date: 20250504T101655.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 88 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora88_OF_v2d20240227.txt Instrument calibration file used: Pandora88s1_CF_v2d20240901.txt Level 1 file used: Pandora88s1_SanAntonioTX_20250305_L1_smca1c2d20240901p1-8.txt Full location name: University of Texas San Antonio Downtown Campus Short location name: SanAntonioTX Country of location: USA Location latitude [deg]: 29.4229 Location longitude [deg]: -98.5025 Location altitude [m]: 230 Local noon date: 20250305 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 198 340 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1841 305.3247 305.4653 305.6059 305.7464 305.8870 306.0275 306.1680 306.3086 306.4491 306.5895 306.7300 306.8705 307.0110 307.1514 307.2918 307.4323 307.5727 307.7131 307.8535 307.9939 308.1342 308.2746 308.4150 308.5553 308.6956 308.8359 308.9762 309.1165 309.2568 309.3971 309.5373 309.6776 309.8178 309.9581 310.0983 310.2385 310.3787 310.5189 310.6590 310.7992 310.9393 311.0795 311.2196 311.3597 311.4998 311.6399 311.7800 311.9201 312.0601 312.2002 312.3402 312.4803 312.6203 312.7603 312.9003 313.0403 313.1802 313.3202 313.4601 313.6001 313.7400 313.8799 314.0198 314.1597 314.2996 314.4395 314.5793 314.7192 314.8590 314.9988 315.1386 315.2785 315.4182 315.5580 315.6978 315.8376 315.9773 316.1170 316.2568 316.3965 316.5362 316.6759 316.8155 316.9552 317.0949 317.2345 317.3741 317.5138 317.6534 317.7930 317.9326 318.0721 318.2117 318.3513 318.4908 318.6303 318.7699 318.9094 319.0489 319.1884 319.3278 319.4673 319.6067 319.7462 319.8856 320.0250 320.1644 320.3038 320.4432 320.5826 320.7220 320.8613 321.0006 321.1400 321.2793 321.4186 321.5579 321.6972 321.8364 321.9757 322.1149 322.2542 322.3934 322.5326 322.6718 322.8110 322.9502 323.0893 323.2285 323.3676 323.5068 323.6459 323.7850 323.9241 324.0632 324.2023 324.3413 324.4804 324.6194 324.7585 324.8975 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250305T142621.3Z 9195.601635 78 1 4.33 2 71.35 108.23 112.20 42.22 0.00 1 0.00 1 0 17 2.034e-02 8.623e-03 1.173e-02 2.673e-03 3.697406e-01 1.320366e-03 4.054951e-03 -6.000000e+00 1.129812e-02 226.30 -2.00 3.23 -2.00 317.72 0.00e+00 5.595827e-04 2.171566e-04 3.956557e-04 -6.000000e+00 5.041691e-04 284.57 -2.00 20.00 -2.00 316.97 0.00e+00 3.089 0.000 302.00 328.00 3 2.3895e+00 3.5032e-03 3.4634e-02 -6.0000e+00 2.7985e-02 1.0763e-02 3.9620e-03 1.7409e-02 -6.0000e+00 3.0393e-02 -1.3487e-02 2.4978e-03 8.5406e-03 -6.0000e+00 1.8136e-02 5.4244e-03 1.2963e-03 2.4181e-03 -6.0000e+00 7.8534e-03 1.5541e-03 -1.4521e-05 6.9906e-05 2.3569e-05 -6.0000e+00 5.0437e-04 1.5228e-02 0.0000e+00 12 9 1 12 1 1 36.35 23.73 0.32 0.01523 0.01512 11 17 1 5 0 360.530 32.50 20.00 23.73 18.81 0.0 951.45 -2161 -1089 -5633 -390 -5316 2471 -923 -4373 -5515 -8560 -3337 -6978 -8368 -4437 -2001 15 -1670 546 2613 580 2089 167 270 -1071 883 -121 1095 -2159 -1503 -1376 240 -74 338 -1225 -5089 -5259 -4278 -2856 -60 1349 -231 156 186 699 456 -140 -104 161 -555 589 1425 1193 2538 1682 1383 1632 1475 547 173 347 652 2044 2808 2063 1705 -753 -1352 -1018 -171 303 491 961 651 485 300 -935 -1919 -2779 -2083 -2167 -1880 -1168 -1530 -1528 -1105 -274 512 148 1389 904 255 -779 -1303 -1843 -944 -88 182 1266 896 17 -367 -692 -1147 -942 -897 -537 -407 -187 146 658 819 1208 773 726 -67 -644 35 -105 37 232 258 692 744 497 554 -111 -436 24 466 50 -10 -262 -395 -665 -368 -42 -52 428 477 23 23 -186 -899 -147 -82 -466 -29 -362 151 -63 -350 -506 -875 -320 -724 -944 -570 -296 3 -299 102 503 119 435 35 58 -232 199 -29 264 -508 -355 -327 57 -20 100 -392 -1560 -1555 -1393 -981 -24 604 -109 77 96 364 237 -74 -54 83 -290 308 797 686 1532 1035 894 1075 1004 376 116 229 440 1389 2090 1611 1376 -577 -1037 -765 -134 259 444 864 590 444 256 -761 -1505 -2096 -1636 -1861 -1745 -1153 -1574 -1563 -1208 -307 600 173 1627 1075 282 -834 -1355 -1855 -1003 -100 213 1590 1186 23 -477 -865 -1368 -1125 -1137 -690 -524 -254 202 944 1229 1874 1181 1084 -97 -898 49 -145 54 352 388 1049 1104 738 777 -156 -584 33 664 73 -15 -414 -620 -1078 -616 -72 -92 767 847 40 39 -315 -1519 SS 20250305T143028.1Z 9195.604491 81 1 53.91 2 70.50 108.83 111.61 42.94 0.00 1 0.00 1 0 17 1.846e-02 6.170e-03 8.279e-04 2.368e-04 3.555276e-01 1.169230e-04 3.903870e-03 -6.000000e+00 1.025015e-02 226.30 -2.00 3.23 -2.00 317.40 0.00e+00 5.585661e-04 1.750914e-05 1.236444e-04 -6.000000e+00 4.574018e-04 284.57 -2.00 20.00 -2.00 316.65 0.00e+00 2.963 0.000 302.00 328.00 3 3.2997e-01 3.0831e-04 3.3227e-02 -6.0000e+00 2.5389e-02 2.0721e-03 3.4743e-04 1.6695e-02 -6.0000e+00 2.7573e-02 -5.0035e-03 2.1276e-04 8.2060e-03 -6.0000e+00 1.6453e-02 6.0068e-04 1.0832e-04 2.3683e-03 -6.0000e+00 7.1249e-03 1.4026e-02 1.4295e-04 6.2063e-06 2.3249e-05 -6.0000e+00 4.5759e-04 1.5192e-02 0.0000e+00 10 0 0 10 0 0 84.63 23.73 0.29 0.01519 0.01627 1390 156 1 5 0 38.780 32.75 20.00 23.73 18.88 0.0 952.20 -4873 -3424 -4437 -6142 -8121 -7872 -5311 -4943 -3378 -3761 -5361 -4928 -3140 -2044 353 169 313 910 1524 1865 1661 1206 1877 1384 688 753 546 -559 -1206 -9 872 778 1697 -325 -2882 -3266 -2523 -1429 -485 169 -243 -430 -232 -213 335 29 -42 -258 -504 -269 906 763 1105 1134 887 973 731 465 355 273 777 1263 1608 2007 809 -173 -508 -927 19 388 469 507 163 527 89 -456 -833 -1651 -1020 -1063 -1127 -1027 -2006 -1822 -1157 -642 -63 142 722 682 557 317 -145 -222 -8 1 197 856 490 -47 -299 -745 -928 -439 -595 -784 -713 -500 -211 303 596 582 559 260 -48 -114 73 -41 184 266 29 62 492 270 529 331 60 364 469 249 228 -107 -147 -257 -77 96 -86 201 248 -156 -177 -489 -614 -420 -325 -447 -595 -769 -723 -514 -489 -373 -449 -642 -612 -450 -342 62 34 67 204 359 457 387 300 443 355 188 216 160 -156 -314 -2 248 243 546 -114 -954 -1045 -892 -540 -207 81 -130 -228 -128 -120 186 16 -23 -142 -279 -150 538 470 721 754 618 691 511 326 242 193 535 935 1248 1628 682 -136 -394 -709 15 327 421 478 155 480 79 -380 -658 -1251 -803 -923 -1026 -1008 -2081 -1891 -1281 -737 -73 170 874 802 626 339 -150 -228 -9 2 234 1069 649 -62 -385 -914 -1077 -510 -740 -1001 -950 -682 -294 439 907 893 841 379 -68 -156 99 -56 261 394 44 92 736 389 739 459 81 486 661 360 344 -165 -231 -406 -127 163 -151 350 438 -269 -300 -818 -1017 SS 20250305T143539.9Z 9195.608100 84 1 53.92 2 69.43 109.61 110.86 43.84 0.00 1 0.00 1 0 17 1.545e-02 6.104e-03 6.618e-04 2.133e-04 3.388972e-01 1.057465e-04 3.734613e-03 -6.000000e+00 8.578097e-03 226.30 -2.00 3.23 -2.00 317.18 0.00e+00 4.734916e-04 1.495343e-05 1.153652e-04 -6.000000e+00 3.827754e-04 284.57 -2.00 20.00 -2.00 316.43 0.00e+00 2.818 0.000 302.00 328.00 3 2.8263e-01 2.7755e-04 3.1630e-02 -6.0000e+00 2.1248e-02 1.0390e-03 3.1247e-04 1.5921e-02 -6.0000e+00 2.3075e-02 -3.5737e-03 1.8829e-04 7.8239e-03 -6.0000e+00 1.3769e-02 1.3154e-04 9.4459e-05 2.2452e-03 -6.0000e+00 5.9629e-03 1.7237e-02 1.7969e-04 5.5884e-06 2.3026e-05 -6.0000e+00 3.8292e-04 1.4957e-02 0.0000e+00 10 0 0 10 0 0 56.01 23.73 0.30 0.01496 0.01631 1603 180 1 5 0 33.630 32.50 20.00 23.73 19.08 0.0 953.07 -3580 -2848 -2561 -4833 -7464 -5578 -5909 -3322 -1344 -3307 -4045 -3856 -2260 -1204 505 581 477 1178 1452 1735 1394 1008 1403 1441 320 757 30 -315 -1618 -114 716 943 1482 -548 -2855 -3157 -2324 -1156 -335 98 -239 -445 -140 -245 305 30 -57 -167 -613 -153 816 761 1094 1171 800 913 830 563 405 261 661 1187 1497 1995 767 -211 -501 -857 57 380 494 480 187 489 109 -366 -739 -1612 -1071 -1014 -1099 -1124 -1990 -1747 -1145 -563 -145 83 652 645 550 310 -83 -205 -16 84 114 850 524 -26 -293 -692 -950 -506 -591 -768 -635 -548 -143 322 609 552 538 290 -37 -173 -6 -43 195 283 29 79 532 308 522 282 81 449 422 192 225 -152 -123 -224 -32 75 -82 240 219 -172 -201 -498 -614 -370 -325 -305 -556 -766 -546 -627 -387 -174 -469 -569 -560 -378 -214 103 135 108 280 362 451 373 266 380 422 93 230 9 -93 -479 -33 213 305 531 -199 -1047 -1118 -847 -482 -158 52 -133 -245 -80 -143 176 18 -33 -95 -350 -87 496 479 729 795 570 662 592 403 296 189 488 898 1188 1652 658 -176 -393 -660 46 336 449 458 179 450 98 -307 -586 -1279 -844 -879 -1040 -1104 -2064 -1878 -1267 -647 -169 101 793 761 619 332 -85 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