File name: Pandora64s1_NewHavenCT_20240617_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240618T220220.7Z 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_20240617_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: 20240617 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 20240617T104834.8Z 8934.450403 128 1 23.90 2 75.54 71.38 140.25 303.09 0.00 1 0.00 1 0 25 2.373e-01 1.702e-02 9.345e-02 3.794e-03 5.216474e-01 2.097403e-03 6.384152e-03 -6.000000e+00 1.463672e-01 232.94 -2.00 3.52 -2.00 320.04 0.00e+00 6.893611e-03 6.992418e-04 2.376879e-03 -6.000000e+00 6.439624e-03 286.76 -2.00 20.00 -2.00 319.34 0.00e+00 3.919 0.001 302.00 328.00 3 3.2757e+00 6.2213e-03 4.8753e-02 -6.0000e+00 3.6765e-01 8.9399e-02 7.4735e-03 2.8909e-02 -6.0000e+00 3.9558e-01 -1.2308e-01 6.0066e-03 1.6596e-02 -6.0000e+00 2.3518e-01 4.8884e-02 3.0664e-03 7.0940e-03 -6.0000e+00 9.9406e-02 2.1239e-04 -3.0202e-04 1.1509e-04 1.0067e-04 -6.0000e+00 7.0651e-03 -5.8078e-03 1.3477e-04 12 9 9 12 9 1 99.96 21.54 0.11 -0.00581 -0.00808 26 13 1 5 0 884.710 26.00 20.01 21.54 26.45 39.2 1040.19 -66565 78962 -63243 -22192 -198775 37486 -74124 -1017 -27622 41690 -49286 43732 -35681 2781 -8801 29800 -15762 31444 -5569 27770 -4551 34591 15365 20791 -5390 5730 -3878 -682 -2960 -18145 2125 717 6338 4907 12909 -3961 4929 233 6028 3053 4110 527 4478 -1276 6572 2884 12485 1559 5857 -1197 10566 2496 8325 2649 4536 -699 2360 -2205 3502 -1115 4331 1199 4884 4022 4287 -554 3533 303 2547 680 1926 -565 225 36 -340 -3614 608 -4309 -1522 -1744 -932 -3342 -1314 -2690 -1501 -1077 -194 12 524 690 -528 14 -2373 -648 -679 423 -1039 1269 426 -178 -967 -975 -3270 394 -311 -1339 -1070 21 -488 877 720 602 -193 641 -276 245 442 188 449 1010 98 630 813 439 1253 1262 -1347 1102 1034 430 214 -294 -640 -282 535 -135 -1011 0 316 -493 92 -831 -1461 480 -1560 -339 -14577 317 -1901 -14 -531 452 -1288 566 -1122 79 -319 904 -773 1124 -286 1072 -245 1339 707 952 -333 327 -244 -41 -183 -1447 162 63 591 472 1092 -392 503 29 855 512 741 104 895 -275 1343 626 2499 359 1333 -294 2549 711 2402 865 1497 -250 830 -803 1188 -403 1577 499 2057 1854 1973 -257 1576 144 1322 404 1205 -352 143 21 -187 -1871 290 -2229 -868 -1155 -660 -2710 -1115 -2334 -1385 -1047 -195 12 525 656 -473 12 -2078 -558 -655 438 -1231 1566 551 -224 -1203 -1111 -3658 447 -380 -1652 -1405 29 -709 1372 1158 982 -309 1010 -415 357 662 295 717 1645 159 1026 1287 666 1819 1847 -1984 1626 1689 738 380 -546 -1251 -560 1121 -284 -2183 0 674 -1052 186 -1634 SS 20240617T113307.0Z 8934.481331 150 1 48.27 2 67.48 78.00 146.53 316.99 0.00 1 0.00 1 0 17 1.691e-02 6.772e-03 3.150e-03 5.725e-04 3.574025e-01 3.108336e-04 4.238289e-03 -6.000000e+00 1.042063e-02 232.94 -2.00 3.52 -2.00 318.20 0.00e+00 4.582154e-04 5.787710e-05 1.832330e-04 -6.000000e+00 4.585593e-04 286.76 -2.00 20.00 -2.00 317.40 0.00e+00 2.589 0.000 302.00 328.00 3 2.0705e+00 8.4218e-04 3.2259e-02 -6.0000e+00 2.6175e-02 -1.1531e-02 9.4968e-04 1.8992e-02 -6.0000e+00 2.8168e-02 -2.0463e-03 6.0980e-04 9.1911e-03 -6.0000e+00 1.6747e-02 -5.3660e-03 3.1091e-04 2.5244e-03 -6.0000e+00 7.0748e-03 3.2429e-03 -5.0367e-04 1.7777e-05 2.9485e-05 -6.0000e+00 5.0352e-04 -6.2947e-03 -3.3294e-05 11 8 0 10 0 0 94.05 21.55 0.17 -0.00629 -0.01008 368 89 1 5 0 131.130 26.00 20.01 21.55 27.20 39.5 1044.19 326 -2278 -878 -4654 -14018 -5082 -1968 -589 373 -1149 -4349 -1577 -732 -863 584 406 -1679 993 -332 1211 437 -209 23 1068 -508 770 -677 -1454 -2164 -582 1238 158 1525 -17 -4583 -1957 -1827 -786 -179 208 -1058 -916 -346 -818 -623 -51 -762 -136 -759 -159 1132 1312 754 1277 228 679 1077 666 41 481 480 1389 1254 2071 864 -1084 102 -1108 808 1499 312 335 -245 341 53 -710 -409 -1702 -290 -159 -1183 -857 -1858 -1972 -445 -512 159 89 975 433 583 727 -197 314 1026 361 -187 866 444 -590 -394 -1408 -1522 72 356 -1428 -313 -780 -292 144 588 229 139 30 44 53 709 -105 475 316 -238 -358 515 47 857 980 -746 599 879 248 391 -450 -511 -309 408 -103 -515 324 170 -384 60 -550 17 -132 -52 -261 -805 -273 -112 -37 26 -84 -334 -131 -70 -89 68 52 -234 144 -51 191 70 -34 4 194 -98 152 -134 -274 -400 -111 255 36 374 -4 -1134 -497 -484 -244 -66 81 -449 -406 -158 -376 -288 -24 -350 -62 -351 -76 580 720 413 738 136 417 670 412 25 298 313 975 894 1548 638 -765 70 -777 616 1271 268 295 -212 279 42 -521 -301 -1268 -221 -137 -1080 -813 -1886 -2123 -482 -588 189 107 1156 489 643 745 -193 314 1113 415 -228 1147 579 -786 -492 -1733 -1827 90 454 -1927 -422 -1110 -421 222 904 352 214 44 63 74 993 -156 711 492 -373 -548 761 70 1211 1327 -1047 830 1315 380 633 -722 -849 -517 722 -189 -933 594 309 -703 107 -944 SS 20240617T113859.7Z 8934.485413 154 1 48.12 2 66.40 78.88 147.26 319.11 0.00 1 0.00 1 0 17 1.376e-02 6.846e-03 1.586e-03 3.534e-04 3.440689e-01 1.921055e-04 4.090670e-03 -6.000000e+00 8.481486e-03 232.94 -2.00 3.52 -2.00 317.87 0.00e+00 4.455887e-04 3.237749e-05 1.805163e-04 -6.000000e+00 3.732055e-04 286.76 -2.00 20.00 -2.00 317.07 0.00e+00 2.478 0.000 302.00 328.00 3 1.2952e+00 5.1603e-04 3.0934e-02 -6.0000e+00 2.1304e-02 -1.0024e-02 5.7940e-04 1.8240e-02 -6.0000e+00 2.2926e-02 -7.6972e-03 3.6077e-04 8.8246e-03 -6.0000e+00 1.3630e-02 -2.3368e-03 1.8085e-04 2.4216e-03 -6.0000e+00 5.7588e-03 7.9865e-03 -4.5800e-04 1.0963e-05 2.8550e-05 -6.0000e+00 4.0976e-04 -6.8474e-03 -2.5547e-05 11 8 0 10 0 0 97.73 21.55 0.20 -0.00685 -0.01029 682 164 1 5 0 70.540 26.00 20.00 21.55 27.59 39.7 1046.98 -802 -1653 -729 -3918 -9234 -3433 -2590 -407 412 -982 -4135 -2150 -850 -826 70 450 -1007 620 -265 1406 540 65 445 810 115 763 -125 -1318 -1553 -193 1527 -291 1689 -612 -4815 -2669 -1835 -1062 133 162 -971 -982 -241 -742 -341 13 -674 -114 -608 -136 1280 488 770 1450 263 836 1062 523 113 425 724 1424 1296 2212 772 -1110 86 -1085 735 1597 301 403 -249 342 40 -710 -512 -1681 -461 -313 -1216 -760 -1800 -1918 -412 -509 108 67 814 483 378 609 -454 211 944 369 -132 872 433 -575 -405 -1330 -1603 185 396 -1393 -333 -731 -325 169 596 226 177 162 6 20 651 -82 568 307 -195 -339 541 12 840 977 -814 546 899 278 498 -486 -581 -343 423 -63 -533 282 130 -410 60 -553 -55 -121 -54 -275 -636 -228 -185 -32 35 -89 -393 -221 -100 -104 10 71 -168 109 -49 266 104 13 91 176 26 180 -29 -294 -338 -43 369 -77 445 -165 -1283 -733 -564 -382 52 73 -475 -469 -118 -367 -169 7 -331 -59 -299 -69 694 286 476 885 167 543 698 342 73 278 496 1052 975 1740 600 -823 66 -794 585 1332 270 371 -226 294 34 -544 -392 -1296 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