File name: Pandora64s1_NewHavenCT_20240227_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240228T050816.6Z 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_20240227_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: 20240227 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 20240227T150036.5Z 8823.625423 366 1 10.49 2 57.23 142.77 114.53 285.86 0.00 1 0.00 1 0 25 1.523e-02 9.092e-03 1.209e-02 3.219e-03 3.306978e-01 1.702841e-03 3.997918e-03 -6.000000e+00 9.126122e-03 225.42 -2.00 3.52 -2.00 317.45 0.00e+00 3.377150e-04 2.557601e-04 2.076414e-04 -6.000000e+00 3.947012e-04 275.77 -2.00 20.00 -2.00 316.86 0.00e+00 1.841 0.000 302.00 328.00 3 4.6583e+00 4.4722e-03 2.5064e-02 -6.0000e+00 2.2597e-02 1.7677e-02 5.0159e-03 1.6831e-02 -6.0000e+00 2.4501e-02 -2.3462e-03 3.1046e-03 8.3993e-03 -6.0000e+00 1.4561e-02 -3.8550e-03 1.5555e-03 2.4133e-03 -6.0000e+00 6.1803e-03 5.1181e-04 -1.7143e-05 9.9382e-05 2.9469e-05 -6.0000e+00 4.5260e-04 -2.5108e-03 1.5445e-05 12 9 1 12 1 1 99.53 21.42 0.15 -0.00251 -0.00264 6 8 1 5 0 1497.660 25.90 20.00 21.42 12.78 37.4 975.89 -1555 2435 -2487 -1466 -5246 -2039 -4674 -1394 926 -2075 -4652 -1159 274 -295 602 2043 -3679 2042 749 1422 591 1030 1053 705 17 2992 -1693 -725 -1705 -4510 -71 -313 985 -1691 -4658 -4412 -2689 -892 768 670 312 -1768 86 -749 511 54 -546 -467 -72 -1302 2150 1665 792 1300 125 547 1325 -527 1154 288 658 1190 2149 2759 1360 -1174 -31 -716 697 1189 702 313 346 -72 -746 -1270 -234 -2539 -1053 -1055 -1448 -903 -1875 -2124 -253 -651 60 268 1015 791 461 -1 -900 437 719 687 -19 1502 812 -164 -905 -1856 -2112 110 222 -1664 153 -857 -91 99 1266 631 149 89 -486 -426 337 -386 583 738 -84 -313 832 224 796 1034 -932 598 846 196 997 -919 -1087 -358 368 -84 -175 767 470 -551 -235 -931 -130 207 -225 -127 -438 -168 -430 -139 93 -224 -519 -138 37 -47 108 373 -743 413 159 313 132 229 247 176 4 785 -455 -181 -418 -1181 -20 -92 298 -520 -1473 -1393 -939 -361 346 327 164 -988 49 -426 288 30 -305 -260 -40 -758 1247 1035 526 868 86 386 939 -376 796 202 485 906 1746 2251 1133 -936 -24 -560 572 1081 654 299 323 -67 -635 -1022 -183 -2024 -873 -950 -1401 -920 -1964 -2359 -287 -782 73 326 1205 918 513 -1 -922 453 781 798 -24 1960 1090 -214 -1148 -2275 -2535 137 286 -2201 210 -1208 -132 148 1949 969 220 126 -667 -583 468 -547 848 1109 -127 -462 1219 313 1097 1359 -1251 804 1187 285 1512 -1414 -1732 -579 609 -145 -298 1315 820 -936 -395 -1523 SS 20240227T150800.5Z 8823.630561 372 1 20.92 2 56.41 144.72 115.84 287.20 0.00 1 0.00 1 0 25 1.814e-02 7.760e-03 4.331e-03 1.227e-03 3.240995e-01 6.489695e-04 3.902376e-03 -6.000000e+00 1.087011e-02 225.42 -2.00 3.52 -2.00 317.41 0.00e+00 5.523363e-04 9.654214e-05 1.326539e-04 -6.000000e+00 4.700422e-04 275.77 -2.00 20.00 -2.00 316.83 0.00e+00 1.802 0.000 302.00 328.00 3 3.6109e+00 1.7026e-03 2.4521e-02 -6.0000e+00 2.6915e-02 1.0077e-02 1.9098e-03 1.6450e-02 -6.0000e+00 2.9180e-02 -1.3001e-03 1.1690e-03 8.2026e-03 -6.0000e+00 1.7341e-02 -3.9485e-03 5.8249e-04 2.3938e-03 -6.0000e+00 7.3634e-03 1.5357e-03 2.6338e-04 3.7799e-05 2.8334e-05 -6.0000e+00 5.3878e-04 -3.4804e-03 9.6647e-05 12 9 1 12 1 1 99.99 21.42 0.16 -0.00348 -0.00150 58 33 1 5 0 354.500 25.90 19.99 21.42 13.59 37.5 979.72 244 -2658 -349 -6064 -15333 -2627 -2353 -617 622 -1428 -4083 -3178 -424 -862 1230 383 -913 844 -295 2120 1030 -29 1068 1664 -346 716 -513 -1175 -963 -814 1638 -73 2314 -180 -4195 -2312 -1735 -1444 171 313 -973 -1028 -76 -841 -54 526 -339 -120 -432 -523 1437 1393 910 1151 115 1005 1217 503 154 182 419 1068 1352 2416 800 -1387 -380 -1271 726 1582 262 609 -30 316 101 -943 -544 -2051 -736 -477 -1233 -1093 -1909 -1901 -482 -460 152 302 1096 503 492 201 -877 -200 596 546 -62 1065 770 -604 -673 -1518 -1802 164 450 -1213 -312 -725 -172 329 886 345 334 49 -74 -159 494 -396 661 386 -149 -261 712 18 1148 721 -992 564 909 349 451 -514 -636 -407 496 -185 -341 397 221 -416 -28 -841 23 -246 -35 -586 -1506 -231 -224 -64 70 -157 -463 -393 -59 -139 223 76 -193 186 -68 496 245 -7 268 405 -90 189 -134 -316 -250 -219 433 -21 713 -56 -1294 -736 -618 -603 77 161 -506 -558 -42 -469 -30 290 -185 -65 -235 -295 856 886 615 767 79 703 860 353 107 127 308 845 1081 2006 654 -1081 -303 -1032 602 1448 243 576 -28 294 87 -783 -423 -1612 -590 -430 -1176 -1144 -2012 -2117 -541 -545 187 374 1331 580 552 209 -921 -213 650 626 -79 1398 1037 -792 -868 -1831 -2128 202 563 -1601 -432 -1007 -253 491 1369 532 491 70 -104 -218 685 -553 975 565 -219 -391 1030 25 1580 953 -1294 759 1313 514 698 -786 -1006 -647 828 -321 -579 681 376 -714 -47 -1355 SS 20240227T151207.0Z 8823.633414 375 1 12.17 2 55.97 145.82 116.56 287.96 0.00 1 0.00 1 0 25 1.447e-02 8.592e-03 7.788e-03 2.272e-03 3.212257e-01 1.202113e-03 3.882946e-03 -6.000000e+00 8.666819e-03 225.42 -2.00 3.52 -2.00 317.27 0.00e+00 5.614965e-04 1.715984e-04 1.604137e-04 -6.000000e+00 3.748354e-04 275.77 -2.00 20.00 -2.00 316.69 0.00e+00 1.781 0.000 302.00 328.00 3 4.2809e+00 3.1478e-03 2.4282e-02 -6.0000e+00 2.1460e-02 1.6140e-02 3.5292e-03 1.6324e-02 -6.0000e+00 2.3268e-02 -4.9973e-07 2.1514e-03 8.1414e-03 -6.0000e+00 1.3828e-02 -5.4014e-03 1.0665e-03 2.3638e-03 -6.0000e+00 5.8693e-03 8.0243e-04 -8.0335e-07 7.0089e-05 2.8845e-05 -6.0000e+00 4.2982e-04 -2.5024e-03 1.8041e-05 12 9 1 12 9 1 99.79 21.42 0.16 -0.00250 -0.00251 12 13 1 5 0 935.410 25.90 20.00 21.42 13.90 37.5 980.75 -2858 -846 -860 -3913 -6434 -1774 -1459 1865 377 381 -4956 -1302 193 -3430 1759 443 -1703 844 -432 517 1566 102 2880 1535 1363 -12 839 -1908 -2086 -1414 2518 -1066 2914 -893 -4234 -3386 -1380 -1274 585 -919 -364 -853 298 -1894 -150 -208 318 -948 -160 -960 1579 736 1368 1096 412 -26 1415 381 114 270 591 1879 1711 2707 682 -1496 -323 -1306 287 1432 590 964 -389 979 62 -1066 -902 -1977 -848 -574 -1435 -457 -2433 -1814 -806 -143 401 446 696 652 292 495 -1097 -387 782 433 -13 1282 785 -326 -763 -1608 -1984 373 19 -1783 -433 -354 -76 585 1035 462 182 306 -526 -258 351 -359 747 433 10 -338 450 232 1187 613 -1103 780 916 130 432 -667 -583 -446 606 -111 -401 486 287 -426 18 -947 -277 -85 -88 -375 -585 -157 -139 193 43 45 -626 -175 30 -588 327 91 -373 191 -103 127 381 25 729 417 387 -3 241 -530 -562 -392 733 -325 931 -293 -1362 -1137 -511 -524 281 -481 -202 -497 168 -1089 -85 -118 185 -556 -93 -553 956 479 935 754 292 -19 1028 276 81 195 447 1450 1423 2340 581 -1215 -252 -1041 249 1307 551 917 -366 901 53 -867 -720 -1591 -708 -515 -1383 -479 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