File name: Pandora206s1_BuffaloNY_20230825_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20230826T134219.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20230825_L1_smca1c1d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20230825 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20230825T151737.2Z 8637.637236 131 1 28.00 2 41.46 132.24 138.48 83.63 0.00 1 0.00 1 0 17 3.152e-02 1.505e-02 1.967e-02 8.511e-03 1.939194e-01 4.275465e-03 2.332652e-03 -6.000000e+00 1.789189e-02 230.96 -2.00 3.55 -2.00 316.57 0.00e+00 -3.464786e-05 5.136456e-04 5.397099e-05 -6.000000e+00 7.944785e-04 287.15 -2.00 20.00 -2.00 315.77 0.00e+00 1.333 0.000 302.00 328.00 3 7.5149e+00 1.1248e-02 1.6635e-02 -6.0000e+00 4.4753e-02 5.4056e-02 1.2599e-02 1.0154e-02 -6.0000e+00 4.8475e-02 1.8579e-02 7.3082e-03 4.9356e-03 -6.0000e+00 2.8876e-02 -1.4409e-02 3.4414e-03 1.3597e-03 -6.0000e+00 1.2282e-02 6.1884e-05 1.4468e-04 2.3434e-04 1.5028e-05 -6.0000e+00 8.0364e-04 1.6497e-03 5.7166e-05 12 8 8 10 0 0 51.62 18.45 1.75 0.00165 0.00274 7 7 2 8 0 4000.000 15.00 18.45 29.72 21.88 21.88 19.2 1013.06 -6054 6205 985 -1644 -2270 16174 -13123 3786 2020 2413 -109 6700 -8351 -1578 -2871 3803 2060 3511 2482 -3233 6508 -5014 3177 -455 4387 -6360 3211 -703 555 -1477 6043 -2893 459 6938 -5414 2423 -2048 -11786 359 -106 -1376 1005 580 366 3207 -1231 -1923 -1564 -691 -2619 3544 -1786 1475 1513 2984 -484 737 -243 1049 -3135 -1233 2474 1321 1408 -412 610 -1974 -1772 -2907 1812 2046 1787 2463 1002 766 265 -209 -1681 -3283 -2709 -1053 -183 2406 -2007 -485 -797 1780 866 10 872 748 -72 -838 -1646 -359 -1462 -343 1916 268 248 68 -479 -1971 -916 -665 -1383 -373 305 137 290 1271 -107 -486 -1117 -532 -656 -849 -2975 -482 587 -126 1641 659 686 2376 429 -578 -751 1893 213 342 -838 -59 580 319 926 624 1325 645 -157 -62 -3072 -895 -1067 1058 182 -293 -363 2014 -2303 623 379 481 -22 1225 -1950 -387 -801 1092 617 1059 781 -1112 2077 -1762 1040 -163 1563 -2618 1211 -257 182 -476 1949 -1037 171 2524 -2045 834 -805 -5657 183 -64 -891 657 392 250 2104 -842 -1291 -1041 -441 -1672 2224 -1261 1055 1099 2199 -373 572 -189 818 -2522 -998 1993 1162 1317 -390 518 -1626 -1393 -2405 1575 1954 1789 2458 981 703 226 -160 -1259 -2554 -2269 -968 -178 2424 -2191 -559 -961 2202 1118 13 1094 892 -79 -863 -1613 -363 -1583 -405 2453 358 324 86 -565 -2284 -1049 -835 -1845 -496 422 197 441 1943 -167 -751 -1605 -713 -817 -1054 -3928 -668 840 -187 2362 969 964 3089 561 -718 -927 2424 284 476 -1208 -85 856 487 1479 1023 2213 1097 -261 -101 -4936 -1415 SS 20230825T162406.6Z 8637.683410 158 1 28.01 2 34.33 156.38 127.01 94.81 0.00 1 0.00 1 0 17 3.517e-02 2.011e-02 2.903e-02 1.309e-02 1.747386e-01 6.559491e-03 2.040460e-03 -6.000000e+00 1.996740e-02 230.95 -2.00 3.55 -2.00 316.48 0.00e+00 2.747839e-03 7.737220e-04 1.536549e-04 -6.000000e+00 8.865920e-04 287.15 -2.00 20.00 -2.00 315.69 0.00e+00 1.210 0.000 302.00 328.00 3 8.1629e+00 1.7276e-02 1.5065e-02 -6.0000e+00 4.9945e-02 5.5901e-02 1.9342e-02 9.7296e-03 -6.0000e+00 5.4096e-02 1.3566e-02 1.1163e-02 4.4517e-03 -6.0000e+00 3.2225e-02 -1.1651e-02 5.2190e-03 2.4184e-03 -6.0000e+00 1.3707e-02 3.7390e-05 -1.0299e-04 3.6150e-04 1.8887e-05 -6.0000e+00 8.9677e-04 2.0546e-03 9.6000e-05 12 8 8 10 0 0 -10.23 18.45 3.86 0.00205 0.00128 7 7 2 8 0 4000.000 15.00 18.45 29.70 21.88 21.88 19.1 1011.79 2677 -14230 16240 503 5587 9557 -1680 -4279 -741 2895 7530 6496 -8949 1442 -6020 5047 2482 3802 1208 432 4071 -4729 178 2543 399 -8118 3463 -720 561 -2346 1958 4018 7499 3392 3993 -4913 -2718 797 1349 -4359 -2231 520 2640 -664 2647 -1094 -10891 -7122 -2084 -283 108 3047 -915 782 4205 2692 1485 2229 -181 -4216 3018 1423 2800 2944 1469 93 -538 -1702 -628 -347 1970 -137 3294 2490 1607 1324 -916 1024 -4663 -2510 -2624 733 -1521 -2318 -901 -241 1840 897 429 1735 1494 -6115 1235 -2685 806 -3283 1729 795 936 479 2105 -438 -1142 -919 272 -695 -990 118 -410 -336 306 789 -3602 -1327 -647 513 -734 -2810 -215 219 1248 730 2026 987 3691 -1164 574 164 1448 -56 1216 329 -47 -410 -397 828 -231 2317 -505 732 -863 -1264 -1943 488 -3371 2917 100 908 1380 -280 -799 -148 586 1456 1244 -2132 351 -1784 1478 766 1182 398 148 1371 -1701 63 915 151 -3432 1314 -267 188 -783 654 1385 2674 1315 1411 -1794 -1055 340 681 -2733 -1492 349 1791 -472 1808 -777 -8343 -5054 -1357 -177 70 2038 -664 585 3114 2031 1152 1708 -139 -3351 2297 1178 2469 2759 1391 80 -428 -1303 -491 -308 1882 -140 3260 2403 1466 1126 -712 723 -3550 -2093 -2445 700 -1582 -2513 -1032 -296 2328 1146 556 2219 1761 -7055 1236 -2629 793 -3554 1962 1010 1262 635 2574 -508 -1295 -1072 332 -905 -1347 166 -602 -520 476 1228 -5592 -1924 -846 637 -916 -3731 -289 316 1841 1071 2878 1402 4803 -1514 691 196 1815 -75 1687 471 -68 -612 -607 1317 -381 3819 -867 1208 -1403 -1999 -3124 SS 20230825T174256.1Z 8637.738149 190 1 15.98 2 32.82 191.69 113.61 106.44 0.00 1 0.00 1 0 17 9.841e-03 6.824e-03 6.079e-03 3.972e-03 1.578882e-01 2.019416e-03 1.932603e-03 -6.000000e+00 5.573666e-03 230.95 -2.00 3.55 -2.00 315.15 0.00e+00 3.227955e-04 1.791638e-04 1.758336e-05 -6.000000e+00 2.481087e-04 287.14 -2.00 20.00 -2.00 314.47 0.00e+00 1.189 0.000 302.00 328.00 3 6.0780e+00 5.2247e-03 1.4341e-02 -6.0000e+00 1.3940e-02 2.0280e-02 5.8054e-03 8.2950e-03 -6.0000e+00 1.5111e-02 5.0487e-03 3.3156e-03 4.0312e-03 -6.0000e+00 9.0002e-03 -3.1077e-03 1.4720e-03 1.1187e-03 -6.0000e+00 3.8199e-03 3.2810e-04 -1.9852e-03 1.0731e-04 1.3648e-05 -6.0000e+00 2.5115e-04 8.7554e-03 -2.8901e-04 12 9 1 12 1 1 -31.80 18.45 0.57 0.00876 -0.00616 3 8 1 8 0 3952.760 15.00 18.45 32.54 21.88 21.88 19.5 1031.73 -62 391 -287 -2190 -4753 438 -2310 1977 611 981 -1306 -1402 -1647 177 -1212 1584 433 213 1229 1675 1706 -811 1377 95 1234 -557 -26 -1175 -1362 669 1966 1419 1620 1360 -1968 -821 -1528 -1409 521 761 -1013 -692 179 -990 -274 -207 -1223 -1726 -769 -1187 602 -226 657 829 1131 396 854 860 480 336 1315 324 640 2076 0 -188 -254 -899 -36 437 509 375 -41 1474 -125 -281 -852 -981 -548 -1401 -1464 -738 -1422 -1457 -673 -831 -32 -124 808 878 993 -231 412 -340 178 392 201 759 127 72 115 -499 -479 -535 -519 -659 -613 -559 -124 24 459 498 232 -488 -169 44 -83 -298 49 230 -7 184 572 -1 257 626 172 1026 743 302 231 -110 -413 -234 -470 150 93 513 279 -95 -144 -620 -793 -19 129 -97 -704 -1346 115 -653 592 198 334 -439 -461 -592 70 -517 714 200 100 589 822 820 -407 681 48 639 -303 -14 -625 -657 316 909 688 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