File name: Pandora64s1_NewHavenCT_20240619_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240620T050921.9Z 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_20240619_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: 20240619 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 20240619T101436.5Z 8936.426811 144 1 46.97 2 81.54 66.15 124.34 267.94 0.00 1 0.00 1 0 25 4.173e-01 4.424e-02 2.188e-01 1.541e-02 7.578532e-01 8.996221e-03 1.138667e-02 -6.000000e+00 2.574291e-01 232.94 -2.00 3.52 -2.00 321.38 0.00e+00 3.008054e-02 3.727979e-03 8.845755e-03 -6.000000e+00 1.134788e-02 286.94 -2.00 20.00 -2.00 320.76 0.00e+00 6.391 0.005 302.00 328.00 3 2.9671e+00 2.9426e-02 7.9338e-02 -6.0000e+00 6.4724e-01 1.2100e+00 3.5195e-02 4.3552e-02 -6.0000e+00 6.9768e-01 -1.2904e+00 2.3419e-02 3.0572e-02 -6.0000e+00 4.1395e-01 4.8121e-01 1.1719e-02 1.9267e-02 -6.0000e+00 1.7447e-01 1.5458e-05 -2.9650e-03 4.4102e-04 4.2530e-04 -6.0000e+00 1.2434e-02 -2.5259e-03 -1.3925e-04 12 9 8 11 40 0 -16.68 21.54 -0.02 -0.00253 -0.02481 12 3 1 5 0 3913.640 26.00 20.01 21.54 27.91 39.5 1047.06 -42342 12958 -21196 -25760 -55641 -92507 -63309 -56736 60691 13354 -124216 -8712 -97074 -14952 20579 36528 81817 170594 14796 28250 75630 -15088 900000 231965 -8812 51308 -58813 -18311 -6395 82166 -1049 900000 61339 71054 26646 98951 34464 35919 9974 37049 39257 58234 45199 61687 12209 23773 60275 6997 55828 -37660 41643 35862 96259 18128 22683 1235 8629 1756 49888 13519 26271 17350 32549 22056 49674 -1915 14352 27804 15530 5820 20859 4716 73 -4617 -1841 -1638 38370 -7659 -4653 2006 -3858 -28435 670 -3894 2437 -5464 6300 -433 4382 2421 -3865 5441 -14722 -7220 -1771 4625 -2043 63 -850 -1601 -4212 -2933 -10765 -2781 -6988 -3333 -6012 10472 -2491 1217 3145 1005 609 1844 -1769 -1039 15 1994 -1351 1852 974 2156 2441 4845 3372 4236 -4090 3396 860 543 -799 -1719 -1177 -118 679 116 -265 3159 1206 -893 -2258 -3339 -3012 605 -1324 -1466 -3562 -7385 -3303 -2651 911 283 -9229 -277 -9131 -873 1065 1890 3108 3042 1064 1838 3007 -1193 900000 3484 -522 1677 -5021 -1100 -368 2468 -86 900000 3480 3616 1912 3584 2358 2637 993 3215 3472 4421 4110 4889 1554 2800 5381 1056 5683 -9332 5365 5244 8513 3439 4052 268 1685 351 6327 2383 4381 3566 6509 5439 9502 -568 3857 6725 4455 2041 6563 1742 27 -1622 -564 -479 7400 -2381 -1653 794 -1860 -18769 370 -2360 1471 -3552 3959 -280 2797 1496 -2371 2901 -9518 -4689 -1262 3460 -1896 66 -941 -1740 -4362 -2687 -9947 -2445 -6826 -3279 -6553 10537 -3195 1619 4510 1532 929 2693 -2574 -1479 21 2991 -2209 2970 1530 3204 3675 6836 4683 5692 -5937 5030 1429 1013 -1659 -3671 -2652 -279 1703 302 -702 8171 3119 -2227 -5379 -7597 SS 20240619T102942.1Z 8936.437293 149 1 48.49 2 78.92 68.45 127.08 270.28 0.00 1 0.00 1 0 25 3.818e-01 2.096e-02 1.470e-01 6.070e-03 6.528797e-01 3.468814e-03 8.817263e-03 -6.000000e+00 2.353007e-01 232.94 -2.00 3.52 -2.00 320.97 0.00e+00 8.876756e-03 1.521880e-03 6.794998e-03 -6.000000e+00 1.036268e-02 286.95 -2.00 20.00 -2.00 320.34 0.00e+00 5.018 0.002 302.00 328.00 3 3.3953e+00 1.1377e-02 6.7834e-02 -6.0000e+00 5.9100e-01 3.1685e-01 1.4334e-02 5.0125e-02 -6.0000e+00 6.3599e-01 -4.1787e-01 1.1938e-02 2.4331e-02 -6.0000e+00 3.7817e-01 1.6826e-01 5.8221e-03 6.5528e-03 -6.0000e+00 1.5977e-01 5.5281e-05 -1.6225e-03 1.8112e-04 1.7407e-04 -6.0000e+00 1.1370e-02 -5.7086e-03 -2.7887e-05 12 9 8 11 8 0 76.33 21.55 -0.10 -0.00571 -0.01790 24 6 1 5 0 2019.930 26.00 20.02 21.55 28.28 39.7 1048.47 -147273 -80877 -101788 -101272 -195309 -41720 -119862 -114204 -36749 86921 -118992 -79570 -102756 -74150 -45951 -8181 -16534 63317 -45893 -2666 -28860 84293 46348 34535 -30076 16245 -19499 -14043 -18323 -77477 -4214 2424 19046 27162 1039 21611 3333 3397 23608 2600 20235 12449 21290 -11240 9447 13623 16321 4024 13824 -10197 22885 11190 24194 -682 15321 3071 9582 3754 16172 2254 8352 5290 14857 9528 15061 744 6513 5256 8317 2742 7235 2519 2113 -177 1449 -7469 8832 -5001 -3805 -2038 -1783 -1212 -1905 -4509 -2934 -1349 515 -1261 1679 1577 -3333 174 -5052 -3534 -2475 911 -2275 133 -21 -542 -1833 -1088 -5065 -502 -1288 -2352 -2147 686 -317 1276 828 833 -134 669 -501 -230 857 539 314 1460 607 1537 577 2016 1447 963 -774 1465 942 35 76 -996 -233 -125 465 103 -361 313 447 -1164 -347 -1050 -4409 -1466 -2233 -2173 -8734 -477 -2754 -2664 -479 514 -3397 -1943 -3828 -2633 -1520 -216 -524 1054 -2128 -88 -1236 1297 1012 881 -1414 492 -842 -562 -791 -6471 -216 126 1008 1352 60 1121 219 261 1762 260 1943 1295 2247 -1586 1109 1579 1886 549 1791 -1811 3251 1959 4009 -148 3069 678 2107 859 3204 520 1925 1332 3816 2845 4328 240 2020 1720 2963 1164 3124 1163 945 -76 556 -2860 2802 -1912 -1658 -1026 -977 -746 -1267 -3262 -2244 -1071 399 -1009 1353 1210 -2510 121 -3632 -2675 -2110 827 -2435 149 -25 -628 -2099 -1123 -5162 -510 -1412 -2722 -2543 851 -439 1852 1312 1358 -218 1039 -751 -337 1278 843 520 2438 1000 2419 891 3071 2147 1394 -1125 2259 1577 63 147 -2065 -487 -277 1095 242 -867 757 1060 -2768 -777 -2255 SS 20240619T103544.2Z 8936.441484 152 1 43.84 2 77.87 69.36 128.17 271.24 0.00 1 0.00 1 0 17 3.469e-01 2.113e-02 1.707e-01 6.519e-03 6.012486e-01 3.674943e-03 7.536445e-03 -6.000000e+00 2.137438e-01 232.94 -2.00 3.52 -2.00 320.68 0.00e+00 7.559649e-03 1.501782e-03 4.021913e-03 -6.000000e+00 9.414334e-03 286.95 -2.00 20.00 -2.00 320.03 0.00e+00 4.614 0.002 302.00 328.00 3 3.8987e+00 1.1666e-02 5.8373e-02 -6.0000e+00 5.3685e-01 2.2086e-01 1.4547e-02 3.6914e-02 -6.0000e+00 5.7777e-01 -2.6234e-01 1.2297e-02 2.0263e-02 -6.0000e+00 3.4355e-01 9.9647e-02 6.0919e-03 7.1809e-03 -6.0000e+00 1.4511e-01 5.2291e-05 -8.4823e-04 1.9646e-04 1.3483e-04 -6.0000e+00 1.0331e-02 -4.8273e-03 -5.1113e-05 12 9 9 12 1 1 95.49 21.54 0.04 -0.00483 -0.01120 13 4 1 5 0 3130.750 26.00 20.01 21.54 28.20 39.6 1047.92 -128903 -22580 -117254 -82706 -198536 -43373 -87951 -44760 67141 -72696 -112703 3170 -66851 -20551 -58147 -25310 -30136 -4132 -4246 20136 69699 114001 97468 8920 -4344 20770 15102 -8859 -2302 -74395 23746 -19182 19947 -6751 8682 10759 14982 -2399 34695 -2638 20651 9635 25054 -16201 6833 5416 20372 -2934 15455 -12750 15298 14828 21979 -167 4991 -1689 11816 -2250 6410 753 3272 3173 10190 9151 12128 1257 840 2372 3677 1081 4682 3808 2331 -1950 -1623 -2595 1776 432 -4933 3497 -2363 -9601 -2012 -1111 -2673 -262 196 -1160 918 918 -2579 2523 -4479 -2386 -2360 2344 -1061 979 1003 605 -1970 -1959 -3905 965 -1052 -1197 -2073 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