File name: Pandora64s1_NewHavenCT_20210717_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20260321T233033.2Z 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 v1.8.88 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20210717_L1_smca1c4d20190911p1-8.txt.bz2 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: 20210717 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 20210717T104833.2Z 7868.450385 84 1 48.08 2 77.92 72.41 145.74 359.69 0.00 1 0.00 1 0 17 3.291e-01 1.307e-02 9.115e-02 3.909e-03 5.884597e-01 2.190200e-03 7.008861e-03 -6.000000e+00 2.023197e-01 232.90 -2.00 3.52 -2.00 320.68 0.00e+00 3.833382e-03 9.119296e-04 2.776902e-03 -6.000000e+00 9.025140e-03 289.37 -2.00 20.00 -2.00 319.99 0.00e+00 4.631 0.002 302.00 328.00 3 3.2302e+00 7.0207e-03 5.7257e-02 -6.0000e+00 5.0762e-01 6.7240e-02 8.9367e-03 3.4773e-02 -6.0000e+00 5.4659e-01 -1.2677e-01 7.7948e-03 1.7648e-02 -6.0000e+00 3.2549e-01 4.7567e-02 3.8397e-03 5.1301e-03 -6.0000e+00 1.3740e-01 1.0866e-04 -8.6904e-04 1.1940e-04 8.5884e-05 -6.0000e+00 9.8032e-03 1.2228e-02 -9.5243e-05 12 8 8 10 0 0 -1.08 21.20 0.27 0.01223 0.00570 35 8 1 5 0 1373.420 25.90 20.01 21.20 30.39 33.5 1057.32 -111396 -62796 -103233 -103100 -161440 -103611 -132021 -91579 -99214 -62333 -125739 -36364 -62624 -63447 -24483 -41723 -25836 7464 -28077 5490 14830 23519 15205 -12041 -85 8712 -14931 2056 3087 -19457 2224 -7873 5224 175 4203 -15055 9898 -2074 13388 -2186 13332 1120 11463 2123 1728 1919 3149 150 391 -9813 9452 -467 3544 2967 4405 -795 1913 -1053 4759 51 1827 122 5034 4415 5995 490 384 2225 5122 2606 2350 172 287 -634 -1820 -1467 -2430 -2223 -3077 -600 -2199 -916 -3184 -1411 -505 -33 1371 309 1984 1860 -330 508 -3219 -1460 -60 580 -1366 1105 -126 -658 -1160 -2315 -3791 934 -569 -1370 -1054 831 -349 1019 1499 303 616 389 -336 -964 -100 152 854 405 -556 229 1569 -106 1399 87 -1855 822 928 372 335 -1011 -737 -418 937 -506 -74 600 809 -420 282 -1437 -1607 -616 -1574 -1460 -3912 -1467 -2732 -1421 -1837 -849 -3458 -495 -1398 -1779 -567 -1318 -767 175 -994 146 363 538 406 -452 -3 292 -630 72 110 -985 107 -446 293 10 248 -1083 636 -180 1201 -263 1494 151 1454 300 252 285 473 24 66 -1863 1655 -99 782 707 1074 -212 503 -281 1185 14 512 39 1697 1625 2164 182 146 872 2216 1218 1168 89 143 -299 -841 -621 -1018 -981 -1489 -329 -1399 -644 -2307 -1071 -409 -28 1195 275 1711 1517 -258 374 -2437 -1168 -54 589 -1519 1333 -158 -803 -1323 -2443 -3938 984 -648 -1646 -1352 1067 -499 1582 2362 489 972 616 -511 -1452 -154 245 1378 667 -905 357 2473 -163 2049 125 -2703 1273 1524 672 622 -1993 -1527 -878 2070 -1167 -174 1412 1862 -930 593 -3085 SS 20210717T105433.1Z 7868.454549 87 1 41.75 2 76.84 73.32 145.75 2.22 0.00 1 0.00 1 0 25 2.309e-01 1.251e-02 8.543e-02 4.626e-03 5.529890e-01 2.575594e-03 6.592917e-03 -6.000000e+00 1.419541e-01 232.90 -2.00 3.52 -2.00 320.35 0.00e+00 3.056253e-03 9.505044e-04 2.187957e-03 -6.000000e+00 6.333358e-03 289.37 -2.00 20.00 -2.00 319.62 0.00e+00 4.279 0.001 302.00 328.00 3 3.7645e+00 7.9014e-03 5.2878e-02 -6.0000e+00 3.5616e-01 1.0088e-01 9.7425e-03 3.1711e-02 -6.0000e+00 3.8351e-01 -1.5027e-01 8.0457e-03 1.5729e-02 -6.0000e+00 2.2838e-01 5.8416e-02 4.0424e-03 4.4031e-03 -6.0000e+00 9.6400e-02 9.0912e-05 -1.1781e-03 1.4208e-04 6.7667e-05 -6.0000e+00 6.8793e-03 1.1764e-02 -1.3010e-04 12 9 9 12 1 1 -61.09 21.18 0.16 0.01176 0.00291 17 5 1 5 0 2309.350 25.90 20.01 21.18 30.64 33.3 1058.52 -104573 -85159 -41677 -45868 -104921 -35373 -82771 -89416 -51419 -37410 -55560 -75175 -57628 -40994 -16325 -15643 -19686 25655 -23964 -2102 -17000 18749 14145 24917 -6949 -9388 -13151 -1555 -9194 -7536 -11318 9009 4454 9583 -3710 6937 2424 5082 1355 -2208 1122 5318 4087 2236 -1456 4806 7098 1425 -7496 -9156 6478 1477 5030 978 2008 1352 3265 -442 4042 -66 3436 290 3510 5611 7060 -126 1066 1264 1446 1923 2173 216 942 319 -1101 -3415 -2531 -3517 -2814 -1413 -2863 -1272 -3021 -1746 -260 -681 -158 1120 2736 902 241 538 -2070 -1658 90 1069 -466 1679 324 -1629 -1096 -2242 -2561 -305 -552 -1524 -711 1319 -339 919 1301 404 535 220 -172 -822 473 -144 542 475 -399 326 1450 -414 1706 -382 -1704 764 925 211 160 -1154 -606 -399 534 108 -139 711 764 -511 -176 -1048 -2359 -1830 -597 -633 -2478 -432 -1779 -2301 -996 -665 -1253 -2317 -1849 -1366 -511 -553 -789 756 -1153 -85 -805 667 532 952 -362 -520 -748 -76 -498 -448 -814 596 346 706 -301 542 227 524 174 -337 179 860 697 392 -271 854 1250 274 -1641 -2195 1477 366 1300 282 592 415 998 -138 1191 -21 1105 107 1385 2340 2876 -53 452 559 689 1019 1217 126 525 168 -563 -1639 -1172 -1720 -1493 -856 -1997 -931 -2395 -1456 -230 -610 -147 1035 2561 812 204 431 -1671 -1423 85 1095 -524 2052 413 -2039 -1271 -2517 -2800 -347 -641 -1869 -925 1798 -494 1394 2096 663 857 336 -261 -1232 722 -223 882 787 -656 514 2290 -635 2488 -548 -2460 1168 1506 376 296 -2253 -1193 -831 1133 236 -311 1599 1685 -1088 -371 -2135 SS 20210717T110516.9Z 7868.462001 90 1 48.37 2 74.90 74.96 145.64 6.73 0.00 1 0.00 1 0 25 1.215e-01 8.193e-03 3.494e-02 1.949e-03 4.921368e-01 1.071109e-03 5.749674e-03 -6.000000e+00 7.472406e-02 232.90 -2.00 3.52 -2.00 319.88 0.00e+00 1.298396e-03 3.431280e-04 7.275209e-04 -6.000000e+00 3.332424e-03 289.37 -2.00 20.00 -2.00 319.11 0.00e+00 3.764 0.001 302.00 328.00 3 3.0021e+00 3.1541e-03 4.6160e-02 -6.0000e+00 1.8748e-01 -2.3489e-02 3.8021e-03 2.6575e-02 -6.0000e+00 2.0187e-01 -1.3762e-02 3.0372e-03 1.3115e-02 -6.0000e+00 1.2021e-01 1.0932e-03 1.5514e-03 3.7764e-03 -6.0000e+00 5.0752e-02 3.5324e-04 -4.2363e-04 6.0361e-05 4.7408e-05 -6.0000e+00 3.6202e-03 1.1452e-02 -8.2094e-05 11 8 0 10 0 0 89.89 21.20 0.21 0.01145 0.00827 80 19 1 5 0 604.400 25.90 19.96 21.20 31.06 33.3 1060.88 -17362 -36662 -40843 -42221 -51616 -58078 -25456 -40589 -33295 -29063 -34299 -38715 -10141 -32526 3406 -11905 -2546 -10685 -4211 -7948 -4261 -3537 5560 -1288 -2846 -2193 -6664 -7850 -2242 -5715 604 3062 4449 -1033 -3132 -172 -1183 1133 1469 113 722 -136 1290 -109 204 1209 841 240 -2471 -1721 1677 1357 1607 1150 554 923 429 588 478 42 155 1401 1963 3764 875 -103 -454 -444 1356 1235 259 1277 -414 928 -644 -925 -1468 -2276 -520 -380 -1635 -534 -2224 -1684 -251 -167 610 612 1431 870 465 482 -1257 -149 790 243 -527 1152 294 -676 -482 -2133 -2086 240 128 -1419 -377 -463 -29 477 1117 278 416 252 -477 -533 529 -526 632 220 -196 -194 793 -433 1217 286 -1290 635 920 369 494 -730 -804 -279 723 -254 -254 445 354 -325 285 -907 -213 -595 -713 -693 -892 -1124 -396 -835 -708 -628 -824 -1144 -275 -1338 117 -535 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