File name: Pandora55s1_QueensNY_20220308_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T113209.7Z 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_20220308_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: 20220308 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 20220308T122752.9Z 8102.519362 75 1 49.37 2 77.91 107.27 107.53 43.84 0.00 1 0.00 1 0 25 3.679e-01 1.212e-02 1.362e-01 3.231e-03 5.787249e-01 1.745225e-03 6.486726e-03 -6.000000e+00 2.192722e-01 225.86 -2.00 3.51 -2.00 320.49 0.00e+00 4.454130e-03 6.661299e-04 9.261446e-04 -6.000000e+00 9.951443e-03 276.65 -2.00 20.00 -2.00 319.97 0.00e+00 4.632 0.002 302.00 328.00 3 2.3306e+00 5.2551e-03 5.5429e-02 -6.0000e+00 5.4259e-01 8.6361e-02 6.6476e-03 3.2406e-02 -6.0000e+00 5.9002e-01 -2.5401e-02 6.3740e-03 1.6050e-02 -6.0000e+00 3.4902e-01 2.7460e-03 3.1961e-03 8.1108e-03 -6.0000e+00 1.4630e-01 2.6380e-04 5.4764e-04 9.8426e-05 7.5210e-05 -6.0000e+00 1.1324e-02 -6.0497e-03 3.7471e-04 12 8 8 10 0 0 100.00 22.67 0.23 -0.00605 -0.00193 101 19 1 5 0 488.720 25.58 20.00 22.67 9.58 30.5 1066.53 7430 -12592 900000 -157670 900000 900000 -112599 900000 240599 -55388 -125525 -45166 -73427 -38852 900000 3876 -57338 -65014 44612 68948 68734 8293 12814 -33884 -14746 -27080 154740 -19455 -7762 -41497 3485 12797 -2600 -20766 929 76271 -10399 212 11752 9556 -7584 8284 -9828 -2321 3582 12487 -3918 8633 4649 6477 1618 -2034 58 7338 8041 3890 7035 3630 4154 -822 1095 7020 1196 -2223 4416 -2703 4642 -1897 806 1448 -1931 -1491 1385 -2304 3796 -703 3824 5353 1416 -479 -1996 2781 -1096 -355 -2942 -1018 -2500 -683 -1896 -819 -687 229 546 613 899 637 145 -36 -424 -847 68 -415 954 2197 123 -452 -626 -818 403 1212 -32 -1441 -382 -405 -538 307 835 1616 230 -309 -760 -424 411 868 174 -707 208 1237 297 -178 158 543 835 423 304 -374 -21 146 -254 -587 -181 -375 58 -52 31 -75 900000 -3951 900000 900000 -1810 900000 758 -704 -3211 -612 -1537 -742 900000 74 -2174 -2916 809 1067 1108 235 357 -1520 -597 -1297 1464 -893 -320 -2396 149 590 -159 -1627 61 2520 -781 16 968 949 -999 1033 -1529 -352 526 1738 -645 1297 750 1078 302 -431 13 1694 1961 1029 1872 1009 1141 -233 308 1978 391 -831 1678 -1119 1764 -760 329 648 -987 -812 753 -1270 1884 -336 1622 2147 609 -232 -1125 1695 -762 -263 -2350 -844 -2211 -617 -1763 -750 -607 190 427 469 707 551 140 -39 -506 -1065 84 -490 1035 2253 130 -503 -732 -999 514 1648 -47 -2295 -623 -658 -846 462 1217 2346 348 -489 -1242 -692 651 1339 263 -1043 295 1709 427 -276 265 964 1545 812 608 -782 -45 321 -567 -1311 -394 -790 117 -102 SS 20220308T123348.3Z 8102.523475 78 1 48.95 2 76.84 108.31 106.76 44.99 0.00 1 0.00 1 0 25 1.235e-01 6.416e-03 2.725e-02 1.160e-03 5.458012e-01 6.057398e-04 6.360077e-03 -6.000000e+00 7.253942e-02 225.86 -2.00 3.51 -2.00 319.80 0.00e+00 1.540092e-03 1.859942e-04 7.790101e-04 -6.000000e+00 3.160467e-03 276.65 -2.00 20.00 -2.00 319.23 0.00e+00 4.281 0.001 302.00 328.00 3 1.0519e+00 1.7255e-03 5.1179e-02 -6.0000e+00 1.7962e-01 7.6285e-02 2.0677e-03 2.8961e-02 -6.0000e+00 1.9527e-01 -3.1254e-02 1.7957e-03 1.4226e-02 -6.0000e+00 1.1617e-01 2.6214e-03 9.3231e-04 4.3967e-03 -6.0000e+00 4.8585e-02 1.3933e-03 -1.3710e-03 3.4308e-05 5.1762e-05 -6.0000e+00 3.6859e-03 -1.4288e-03 -2.6701e-05 11 8 0 10 0 0 98.92 22.67 0.17 -0.00143 -0.01173 183 35 1 5 0 267.430 25.58 19.99 22.67 9.69 30.5 1067.58 -23906 -32189 39586 -67681 -14770 -42292 -57662 7173 -19802 -33780 -49271 -29271 -34167 -23769 7867 -3263 -19787 -9847 579 5562 1410 -1917 -1647 -6829 -6467 -5912 7286 -9067 -8140 -9859 -2753 1791 -54 -5204 -1840 5772 -1678 -2292 2077 824 -2584 36 -3573 -1006 -259 1623 -1715 1746 295 2185 2094 -50 1320 2615 2633 1403 1497 199 855 489 1382 2215 1781 124 49 -534 745 773 1363 1209 -329 -506 -301 -754 -248 -301 252 871 1044 179 -64 -199 -1396 -1196 -1315 -1027 -974 -566 -638 -207 77 516 551 1321 1210 981 889 747 -484 -663 -400 -346 410 1051 -109 -903 -516 -743 -14 72 -116 -572 -337 -195 -41 836 785 1032 438 -268 -745 -447 -82 -180 80 1 518 1314 730 29 249 -73 377 204 170 -366 -98 126 -421 -455 -99 -113 42 169 -254 -431 294 -1359 -174 -622 -1029 79 -314 -663 -1185 -640 -914 -710 214 -115 -912 -453 26 253 69 -99 -87 -403 -412 -399 446 -640 -562 -706 -203 146 -5 -556 -194 560 -182 -284 294 139 -509 8 -813 -231 -60 377 -413 415 73 553 566 -15 425 894 953 533 589 80 340 192 542 905 793 61 26 -285 384 395 721 700 -210 -343 -208 -515 -161 -183 142 470 578 109 -44 -151 -1155 -1048 -1204 -982 -974 -583 -666 -214 77 492 500 1166 1098 960 953 877 -614 -875 -525 -434 482 1187 -126 -1093 -647 -966 -18 102 -176 -913 -550 -315 -65 1264 1159 1525 667 -425 -1213 -728 -131 -281 123 2 751 1865 1063 44 411 -126 675 375 324 -723 -200 260 -879 -950 -202 -225 81 321 SS 20220308T124433.0Z 8102.530937 81 1 47.31 2 74.91 110.23 105.32 47.04 0.00 1 0.00 1 0 25 5.032e-02 5.936e-03 8.456e-03 6.357e-04 4.891205e-01 3.290855e-04 5.751998e-03 -6.000000e+00 2.955420e-02 225.86 -2.00 3.51 -2.00 319.19 0.00e+00 9.098899e-04 8.287302e-05 4.285366e-04 -6.000000e+00 1.287593e-03 276.65 -2.00 20.00 -2.00 318.60 0.00e+00 3.769 0.001 302.00 328.00 3 4.7463e-01 9.0928e-04 4.5156e-02 -6.0000e+00 7.3181e-02 5.9201e-02 1.0544e-03 2.5415e-02 -6.0000e+00 7.9556e-02 -2.4082e-02 8.1994e-04 1.2556e-02 -6.0000e+00 4.7331e-02 9.7753e-04 4.3199e-04 3.6638e-03 -6.0000e+00 1.9796e-02 4.3351e-03 -1.2796e-03 1.9014e-05 4.4942e-05 -6.0000e+00 1.5016e-03 -2.2084e-03 -3.3929e-05 10 0 0 10 0 0 97.98 22.67 0.22 -0.00221 -0.01182 379 72 1 5 0 124.800 25.58 19.99 22.67 9.93 30.4 1068.28 -22708 -11932 -8321 -19691 -24141 -12300 -23634 -3730 -11335 -11445 -18495 -8719 -11565 -7793 1238 -5822 -3488 -3095 2236 126 474 -754 78 -1777 -2943 -2195 -1357 -2994 -3274 -772 -1338 1380 -217 -1899 -1735 1474 -500 -387 1287 -698 -1156 -994 -1470 -1558 -308 -19 -444 259 -141 1032 755 1144 820 1440 1196 663 975 272 573 692 1264 1653 1782 305 -196 129 503 644 1430 946 117 -298 -744 -752 -785 -201 164 841 1091 320 -68 -529 -1392 -1159 -1222 -1195 -811 -592 -443 -606 137 416 783 1520 1485 1222 846 756 -371 -523 -402 -475 144 1005 -233 -851 -411 -717 -61 -90 -165 -569 -261 -135 58 732 946 844 535 -273 -725 -334 -174 -275 44 65 452 1379 783 102 245 -121 261 141 194 -394 -88 119 -384 -404 -107 -90 4 138 -456 -250 -181 -475 -573 -250 -562 -82 -305 -335 -614 -284 -452 -358 63 -342 -224 -216 159 10 38 -61 6 -160 -291 -229 -144 -317 -338 -79 -149 171 -31 -299 -274 222 -80 -66 260 -172 -303 -284 -446 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