File name: Pandora177s1_WestportCT_20240430_L2Fit_fout2c7d20230401p1-8.txt File generation date: 20241124T053843.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 177 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora177_OF_v3d20201002.txt Instrument calibration file used: Pandora177s1_CF_v7d20230401.txt Level 1 file used: Pandora177s1_WestportCT_20240430_L1_smca1c7d20230401p1-8.txt Full location name: Westport - Sherwood Island State Park CTDEEP (USEPA AQS ID 09-001-9003) Short location name: WestportCT Country of location: USA Location latitude [deg]: 41.1183 Location longitude [deg]: -73.3367 Location altitude [m]: 4 Local noon date: 20240430 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 218 359 Nominal wavelengths inside fitting window [nm]: 305.1028 305.2437 305.3847 305.5256 305.6665 305.8074 305.9483 306.0891 306.2300 306.3709 306.5117 306.6525 306.7934 306.9342 307.0750 307.2157 307.3565 307.4973 307.6380 307.7788 307.9195 308.0602 308.2009 308.3416 308.4823 308.6230 308.7637 308.9043 309.0450 309.1856 309.3262 309.4668 309.6074 309.7480 309.8886 310.0291 310.1697 310.3102 310.4508 310.5913 310.7318 310.8723 311.0128 311.1533 311.2937 311.4342 311.5746 311.7151 311.8555 311.9959 312.1363 312.2767 312.4170 312.5574 312.6978 312.8381 312.9784 313.1188 313.2591 313.3994 313.5396 313.6799 313.8202 313.9604 314.1007 314.2409 314.3811 314.5213 314.6615 314.8017 314.9419 315.0821 315.2222 315.3623 315.5025 315.6426 315.7827 315.9228 316.0629 316.2030 316.3430 316.4831 316.6231 316.7631 316.9031 317.0432 317.1831 317.3231 317.4631 317.6031 317.7430 317.8829 318.0229 318.1628 318.3027 318.4426 318.5825 318.7223 318.8622 319.0020 319.1419 319.2817 319.4215 319.5613 319.7011 319.8409 319.9807 320.1204 320.2602 320.3999 320.5396 320.6793 320.8190 320.9587 321.0984 321.2381 321.3777 321.5174 321.6570 321.7966 321.9362 322.0758 322.2154 322.3550 322.4946 322.6341 322.7736 322.9132 323.0527 323.1922 323.3317 323.4712 323.6107 323.7501 323.8896 324.0290 324.1684 324.3079 324.4473 324.5867 324.7260 324.8654 --------------------------------------------------------------------------------------- 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 20240430T173549.7Z 8886.733215 444 1 12.68 2 27.83 203.98 117.80 259.61 0.00 1 0.00 1 0 17 1.696e-02 1.286e-02 6.514e-03 3.849e-03 1.668793e-01 2.043985e-03 2.011612e-03 -6.000000e+00 1.020603e-02 229.94 -2.00 3.51 -2.00 315.57 0.00e+00 6.734492e-04 1.947342e-04 1.789056e-04 -6.000000e+00 4.437249e-04 282.00 -2.00 20.00 -2.00 314.94 0.00e+00 1.130 0.000 302.00 328.00 3 5.5065e+00 5.2874e-03 1.4221e-02 -6.0000e+00 2.5488e-02 4.3110e-02 5.8591e-03 8.4674e-03 -6.0000e+00 2.7510e-02 -4.4698e-03 3.3651e-03 4.1185e-03 -6.0000e+00 1.6349e-02 -5.5308e-03 1.5138e-03 1.1484e-03 -6.0000e+00 6.9625e-03 5.8381e-04 -2.2877e-04 1.1726e-04 1.5868e-05 -6.0000e+00 4.9927e-04 -2.3082e-03 0.0000e+00 12 9 9 12 9 1 97.33 23.42 0.40 -0.00231 -0.00403 3 3 1 5 0 3169.650 26.83 20.00 23.42 20.03 24.5 1002.91 2121 381 -143 -981 -4955 2513 2606 2674 -1297 -3959 -5892 -3929 -1109 581 -23 443 35 1449 1814 2488 640 550 2302 1821 987 1641 -956 -1738 -7 -1410 1169 1950 1267 -3666 -5012 -4421 -3074 -1686 -411 -381 19 270 2 -319 -653 159 -215 -420 -1717 455 785 575 718 688 438 1889 132 369 23 215 1278 2346 2725 1756 225 -612 -2417 -1146 1788 1409 1829 1277 863 1887 -874 -1559 -2304 -3447 -2330 -1747 -2170 -2311 -2825 -1520 -280 404 1591 990 1857 1136 547 -216 -1311 -933 -1041 -962 814 1180 406 -508 -1432 -2346 -1443 -702 -1295 -1702 -1060 -1212 1220 1714 2262 1008 487 187 396 -844 -473 -279 263 873 726 1004 1058 560 904 -545 -1210 1081 -576 -480 -881 -1236 -257 -58 754 -9 661 826 665 318 -706 -1906 551 106 -39 -249 -1266 572 629 719 -365 -1160 -1734 -1162 -349 201 -9 179 14 606 775 1081 286 244 1015 840 480 801 -463 -796 -3 -588 492 866 591 -1769 -2332 -2041 -1541 -982 -260 -270 14 211 1 -255 -521 124 -163 -307 -1237 322 576 447 583 575 375 1618 115 320 20 185 1134 2073 2552 1705 214 -570 -2110 -978 1602 1321 1831 1321 888 1842 -811 -1392 -1881 -2746 -1934 -1599 -2074 -2390 -3101 -1735 -318 488 1992 1270 2331 1370 648 -233 -1311 -974 -1081 -1092 994 1463 523 -642 -1795 -2771 -1670 -849 -1593 -2218 -1429 -1700 1750 2429 3269 1455 704 250 513 -1058 -597 -349 351 1225 1041 1415 1441 732 1186 -687 -1478 1308 -748 -621 -1179 -1681 -354 -83 1131 -13 1007 1274 1028 483 -1107 -2933 SS 20240430T174046.8Z 8886.736652 447 1 48.93 2 28.23 206.38 118.67 260.32 0.00 1 0.00 1 0 17 1.505e-02 1.153e-02 1.694e-03 9.561e-04 1.662162e-01 5.059104e-04 2.027168e-03 -6.000000e+00 9.057391e-03 229.94 -2.00 3.51 -2.00 315.83 0.00e+00 7.559232e-04 5.061658e-05 1.757531e-04 -6.000000e+00 3.935752e-04 282.00 -2.00 20.00 -2.00 315.18 0.00e+00 1.134 0.000 302.00 328.00 3 4.1432e+00 1.3104e-03 1.4278e-02 -6.0000e+00 2.2620e-02 3.5731e-02 1.4545e-03 8.5200e-03 -6.0000e+00 2.4410e-02 -6.3001e-03 8.3413e-04 4.1512e-03 -6.0000e+00 1.4507e-02 -5.0113e-03 3.8035e-04 1.1708e-03 -6.0000e+00 6.1815e-03 2.2835e-03 -7.2326e-06 2.9164e-05 1.5454e-05 -6.0000e+00 4.4283e-04 -5.6629e-03 0.0000e+00 12 8 8 10 0 0 99.88 23.43 0.39 -0.00566 -0.00572 76 17 1 5 0 643.530 26.83 20.00 23.43 20.24 24.5 1005.21 2419 604 246 -3325 -3319 -2340 12 2185 -1171 -2717 -4677 -2072 -985 695 678 111 -73 1430 1567 1599 940 426 1468 1524 1846 456 -459 -575 -496 336 1446 1680 614 -3218 -5218 -4537 -3495 -1271 -201 -790 -776 -321 150 118 643 309 -406 -518 -1183 -159 1030 1038 1165 857 468 1333 163 -220 -45 124 1394 2088 2686 2088 158 -1436 -1404 -759 1804 1324 835 1513 1184 1359 30 -1332 -2339 -2950 -1765 -2001 -2441 -2516 -2884 -1630 -355 142 1079 1177 1549 1262 361 -850 -1482 -379 -466 -348 662 1241 610 -385 -1352 -2041 -900 -536 -1682 -1775 -1057 -805 810 1490 1496 1122 710 47 -267 -445 -146 -51 892 466 665 471 920 688 884 -399 -588 707 -128 -166 -734 -1019 -469 124 346 6 575 713 470 -61 -560 -1675 603 161 65 -832 -750 -502 3 529 -316 -755 -1306 -577 -297 231 248 43 -29 575 645 674 402 182 627 677 854 217 -213 -250 -202 132 583 719 277 -1487 -2340 -2015 -1689 -707 -130 -524 -552 -235 111 88 473 224 -288 -354 -790 -116 703 749 878 668 374 1071 133 -179 -36 100 1153 1834 2496 2005 149 -1261 -1134 -603 1508 1233 838 1551 1207 1326 28 -1111 -1968 -2406 -1497 -1716 -2324 -2590 -3148 -1852 -425 181 1312 1456 1885 1605 428 -918 -1480 -369 -479 -391 807 1621 829 -513 -1690 -2398 -1033 -644 -2192 -2446 -1382 -1090 1131 2165 2231 1655 995 67 -349 -556 -183 -68 1253 638 926 648 1331 954 1163 -503 -716 860 -166 -227 -1041 -1467 -687 189 507 9 901 1132 749 -96 -854 -2507 SS 20240430T174841.8Z 8886.742151 453 1 19.68 2 28.93 210.09 120.07 261.47 0.00 1 0.00 1 0 17 1.508e-02 1.159e-02 3.128e-03 1.889e-03 1.668677e-01 1.006399e-03 2.014917e-03 -6.000000e+00 9.073633e-03 229.94 -2.00 3.51 -2.00 315.55 0.00e+00 8.168061e-04 9.536703e-05 1.430897e-04 -6.000000e+00 3.942807e-04 282.00 -2.00 20.00 -2.00 314.93 0.00e+00 1.142 0.000 302.00 328.00 3 4.7651e+00 2.6021e-03 1.4345e-02 -6.0000e+00 2.2660e-02 3.9505e-02 2.8783e-03 8.5418e-03 -6.0000e+00 2.4454e-02 -5.1053e-03 1.6540e-03 4.1464e-03 -6.0000e+00 1.4533e-02 -5.9879e-03 7.4222e-04 1.1852e-03 -6.0000e+00 6.1926e-03 1.2127e-03 8.9457e-05 5.7755e-05 1.5758e-05 -6.0000e+00 4.4363e-04 -5.6739e-03 0.0000e+00 12 9 9 12 1 1 99.94 23.45 0.40 -0.00567 -0.00500 12 7 1 5 0 1513.700 26.83 20.00 23.45 20.94 24.5 1009.10 2249 748 16 -2926 -2838 -2656 -335 1482 -414 -1927 -5632 -2091 -1228 757 847 -52 -55 1442 1319 1965 682 1174 1814 2093 2229 1057 -82 -1361 -588 572 756 1359 1221 -3047 -5130 -4597 -3218 -1112 -214 -1033 -711 -465 401 -155 275 338 88 -664 -1161 224 731 1154 1415 835 1338 1798 160 -202 -654 116 1173 2228 2797 1832 -193 -1139 -1530 -997 1874 1253 403 1193 1168 1253 54 -1366 -2071 -2791 -1969 -2305 -2399 -2223 -2729 -1514 -4 180 1236 1077 1618 1034 477 -742 -1712 -254 -480 -262 858 1307 295 -592 -1291 -2089 -996 -589 -1657 -1673 -1180 -607 1019 1319 1568 1017 754 -52 197 -170 -480 -248 740 532 695 701 1196 606 600 -207 -535 412 -309 -360 -419 -933 -329 85 275 184 472 590 483 -21 -526 -1603 624 222 5 -811 -709 -636 -83 402 -123 -591 -1765 -648 -413 280 345 -20 -22 587 551 836 297 504 782 938 1041 505 -38 -604 -268 251 342 651 611 -1427 -2566 -2281 -1575 -628 -140 -767 -517 -349 303 -118 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