File name: Pandora64s1_NewHavenCT_20240527_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240528T045602.8Z 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_20240527_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: 20240527 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 20240527T154309.7Z 8913.654973 406 1 7.60 2 24.22 140.07 120.71 260.86 0.00 1 0.00 1 0 17 1.477e-02 1.074e-02 5.850e-03 3.933e-03 1.848412e-01 2.166385e-03 2.241925e-03 -6.000000e+00 9.068180e-03 231.88 -2.00 3.52 -2.00 315.00 0.00e+00 6.541757e-04 1.847836e-04 4.056991e-05 -6.000000e+00 3.971939e-04 284.71 -2.00 20.00 -2.00 314.38 0.00e+00 1.096 0.000 302.00 328.00 3 5.4561e+00 5.5917e-03 1.4757e-02 -6.0000e+00 2.2733e-02 4.7831e-02 6.1698e-03 9.6486e-03 -6.0000e+00 2.4494e-02 -6.3164e-03 3.5235e-03 4.6775e-03 -6.0000e+00 1.4558e-02 -2.0501e-03 1.5389e-03 1.3246e-03 -6.0000e+00 6.1497e-03 6.0775e-04 -3.0710e-04 1.2053e-04 1.8423e-05 -6.0000e+00 4.3977e-04 -4.5816e-03 -1.3260e-06 12 9 9 12 1 1 999.00 21.52 0.04 -0.00458 -0.00689 2 5 1 5 0 2528.290 26.00 20.01 21.52 26.25 39.3 1043.24 2081 -365 -560 -2405 -6659 -2320 1813 -159 3459 403 -3350 -1371 1851 1218 980 -816 -949 400 708 3318 310 -4 -1268 1582 549 1717 -835 -1377 -212 -960 3425 1319 1948 703 -5985 -3144 -1756 -819 1338 145 -788 -715 -368 -2800 -1355 537 -1068 -1045 -458 -368 1915 494 1327 1007 205 445 1502 223 562 863 527 1392 2568 2594 738 -407 -1035 -402 715 1762 659 85 74 738 -50 -910 -1115 -2157 -1052 -943 -1552 -1413 -2933 -2245 -734 -300 344 290 911 392 636 708 -1335 -468 702 1089 -633 1065 1071 -535 -153 -831 -2399 91 17 -1565 -350 -409 -130 552 1259 296 571 283 -740 -639 497 -611 658 319 281 190 938 -14 1194 431 -818 650 1004 307 682 -409 -783 -664 784 409 -802 594 376 -376 -407 -1348 672 -119 -181 -748 -1966 -654 523 -52 1165 142 -1195 -480 697 512 434 -389 -460 198 357 1679 154 -2 -655 826 298 937 -453 -728 -105 -477 1708 699 1043 372 -3165 -1684 -1033 -531 955 112 -628 -587 -308 -2385 -1134 436 -849 -839 -355 -288 1550 409 1136 866 180 396 1332 198 491 761 487 1315 2534 2545 727 -383 -932 -356 683 1781 687 91 78 740 -48 -826 -971 -1843 -953 -912 -1596 -1522 -3245 -2518 -873 -364 420 360 1144 467 717 780 -1385 -481 761 1237 -772 1340 1329 -668 -185 -979 -2825 108 21 -1972 -458 -538 -179 768 1783 414 775 366 -921 -789 619 -779 864 427 380 253 1244 -19 1473 527 -971 783 1273 397 884 -543 -1067 -916 1097 594 -1171 872 550 -553 -585 -1899 SS 20240527T155657.5Z 8913.664555 412 1 47.84 2 22.68 147.15 123.14 262.87 0.00 1 0.00 1 0 17 1.430e-02 9.182e-03 2.026e-03 1.286e-03 1.814909e-01 7.042582e-04 2.182125e-03 -6.000000e+00 8.780364e-03 231.89 -2.00 3.52 -2.00 315.26 0.00e+00 5.078364e-04 6.338092e-05 4.861967e-05 -6.000000e+00 3.845225e-04 284.71 -2.00 20.00 -2.00 314.62 0.00e+00 1.084 0.000 302.00 328.00 3 5.3830e+00 1.8226e-03 1.4524e-02 -6.0000e+00 2.2012e-02 3.9962e-02 2.0134e-03 9.4299e-03 -6.0000e+00 2.3713e-02 -1.4181e-03 1.1497e-03 4.5734e-03 -6.0000e+00 1.4094e-02 -2.3438e-03 5.0693e-04 1.2782e-03 -6.0000e+00 5.9564e-03 6.6759e-04 2.4583e-04 3.9560e-05 1.7544e-05 -6.0000e+00 4.2550e-04 -5.4106e-03 9.2025e-05 11 8 0 10 0 0 99.98 21.50 0.02 -0.00541 -0.00356 46 11 1 5 0 1039.880 26.00 20.02 21.50 27.11 39.1 1047.38 1288 -588 1340 -2410 -10735 -540 -65 866 2211 321 -2780 -962 237 -347 1438 107 -372 1268 752 1970 1830 11 1405 1134 268 1071 176 -1170 -371 -1318 1518 -81 2589 81 -4340 -2283 -1375 -1319 391 117 -927 -1297 10 -1230 -455 -205 -744 -218 -970 -967 1326 866 1018 1382 125 797 1206 328 34 392 590 1142 1462 2374 1026 -1630 -643 -1398 703 1643 549 803 -92 659 17 -830 -702 -2362 -1084 -291 -1244 -1156 -1974 -1812 -358 -345 276 296 1106 669 130 124 -1141 -517 497 444 -209 1212 914 -307 -395 -1622 -1975 141 399 -1409 -267 -530 -291 561 1085 429 302 -44 -432 -535 398 -321 545 584 188 73 933 35 1272 653 -947 336 742 221 448 -882 -673 -384 595 41 -226 513 383 -573 -354 -886 372 -179 397 -666 -2931 -141 -18 247 671 101 -877 -314 85 -138 586 47 -165 574 349 932 868 5 684 576 141 571 92 -571 -169 -606 711 -40 1328 41 -2178 -1169 -777 -821 267 86 -724 -1048 8 -1009 -369 -164 -576 -163 -746 -752 1013 697 852 1201 106 683 1038 281 31 336 527 1085 1400 2319 1009 -1501 -584 -1264 649 1592 569 851 -97 657 16 -762 -594 -1971 -958 -270 -1276 -1231 -2126 -2055 -414 -421 350 381 1396 799 149 136 -1171 -527 535 498 -248 1530 1177 -385 -485 -1889 -2274 169 494 -1840 -349 -718 -397 793 1566 609 420 -59 -538 -668 503 -410 714 802 261 100 1232 45 1575 807 -1141 411 918 287 602 -1168 -910 -540 846 61 -342 786 585 -857 -515 -1260 SS 20240527T160544.0Z 8913.670648 415 1 48.22 2 21.84 152.07 124.69 264.16 0.00 1 0.00 1 0 17 1.315e-02 1.005e-02 3.270e-03 1.948e-03 1.884163e-01 1.062410e-03 2.267319e-03 -6.000000e+00 8.076449e-03 231.89 -2.00 3.52 -2.00 315.54 0.00e+00 4.374605e-04 1.008332e-04 9.284513e-05 -6.000000e+00 3.537099e-04 284.71 -2.00 20.00 -2.00 314.87 0.00e+00 1.077 0.000 302.00 328.00 3 6.0672e+00 2.7578e-03 1.4727e-02 -6.0000e+00 2.0247e-02 5.7287e-02 3.0491e-03 9.7662e-03 -6.0000e+00 2.1813e-02 -5.6406e-03 1.7431e-03 4.7461e-03 -6.0000e+00 1.2964e-02 -1.1812e-03 7.7569e-04 1.3098e-03 -6.0000e+00 5.4784e-03 3.3218e-04 6.7767e-05 6.0125e-05 1.7818e-05 -6.0000e+00 3.9147e-04 -4.9855e-03 7.8069e-05 12 8 8 10 0 0 99.97 21.51 0.00 -0.00499 -0.00448 32 8 1 5 0 1506.660 26.00 19.95 21.51 27.62 39.3 1049.39 1570 -376 373 -2295 -3766 -826 -1754 1151 2011 87 -4503 -1625 -1016 -21 669 676 -432 1509 -398 2790 1133 659 1312 1486 -63 1376 -838 -729 -962 -2529 1019 210 2485 -1004 -4450 -2834 -1667 -1686 648 267 -93 -641 -22 -1699 -229 -55 -317 -621 -882 -1803 1732 1675 1517 880 541 371 1799 448 540 39 496 1075 1865 2217 1140 -2053 -668 -1721 860 1578 919 851 446 503 -93 -1548 -985 -3278 -1380 -520 -1510 -1634 -1843 -1992 -239 -412 983 335 1270 717 196 123 -1667 -565 271 549 -75 1517 789 -358 -860 -1539 -2365 -172 90 -1329 -444 175 -312 1000 1266 779 466 237 -584 -772 18 -461 400 875 -15 147 755 530 725 695 -1498 444 501 501 327 -982 -735 -352 671 80 -252 505 309 -566 8 -966 418 -106 103 -585 -886 -188 -431 303 566 26 -1340 -495 -341 -7 257 274 -180 637 -175 1225 506 293 598 704 -31 684 -412 -332 -414 -1104 450 97 1199 -490 -2102 -1372 -888 -992 417 193 -72 -488 -17 -1326 -175 -44 -243 -463 -642 -1338 1311 1331 1201 730 455 318 1532 382 454 33 441 1016 1768 2158 1067 -1891 -577 -1485 790 1525 946 897 463 500 -89 -1359 -831 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