File name: Pandora132s1_Berlin_20231023_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T204818.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20231023_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20231023 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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 20231023T065601.9Z 8696.288911 77 1 44.98 2 81.16 121.94 148.27 17.84 0.00 1 0.00 1 0 25 4.752e-01 3.320e-02 4.284e-01 3.388e-02 7.233889e-01 1.881187e-02 8.760178e-03 -6.000000e+00 2.712908e-01 223.42 -2.00 3.85 -2.00 321.65 0.00e+00 -6.771019e-03 8.790192e-03 2.251070e-03 -6.000000e+00 1.336636e-02 274.36 -2.00 20.00 -2.00 321.16 0.00e+00 6.156 0.005 302.00 328.00 3 3.2312e+00 6.2346e-02 7.3302e-02 -6.0000e+00 6.6884e-01 6.3120e-01 7.9691e-02 4.1983e-02 -6.0000e+00 7.3310e-01 -8.4294e-01 6.9215e-02 2.3086e-02 -6.0000e+00 4.3377e-01 3.4584e-01 3.3787e-02 8.4970e-03 -6.0000e+00 1.8496e-01 2.3515e-05 -7.1599e-04 1.0104e-03 1.2469e-04 -6.0000e+00 1.3451e-02 1.2131e-03 0.0000e+00 12 9 9 12 4 4 99.96 6.15 0.69 0.00121 -0.00417 40 8 4 8 0 1124.310 15.02 6.15 17.93 22.80 23.22 28.1 957.86 -35644 900000 900000 900000 -98747 900000 -169965 -140148 900000 -147229 -59547 -123993 26050 43447 109670 900000 -63562 101992 81811 242891 79379 900000 135080 7106 7032 900000 -16732 72293 900000 -31332 900000 -48645 -18364 42338 7038 13157 -18562 -3741 776 23382 17932 97967 36423 50767 31600 116367 -5102 8377 12518 -4163 58168 50105 15744 56139 50028 43978 10656 61123 44421 30725 16031 29839 17917 1418 11502 3341 -12506 6456 573 3144 6656 20138 14358 389 8047 13516 9070 11353 -13394 -4864 -5547 -6310 -12345 -4682 -38 2415 3993 686 2461 -1820 -3450 -1145 -10726 -605 839 -1469 -3406 1758 -688 208 -2918 -447 -1785 576 -5370 1851 1965 -2829 504 -2459 -3471 900 -4245 -1417 1856 1337 -1233 2028 4217 -957 1137 887 1613 954 1480 2544 1545 1640 2424 2815 596 536 -1707 -295 373 80 682 -220 520 -777 343 -1470 -2200 -1175 900000 900000 900000 -3256 900000 -9342 -7143 900000 -9269 -1964 -7063 859 1433 3617 900000 -3811 3363 2698 8010 2618 900000 4455 256 274 900000 -803 2384 900000 -1597 900000 -3938 -1211 1523 338 592 -1280 -269 65 1823 1613 4112 2839 3348 2463 4221 -566 829 1238 -524 4796 4506 2171 5554 5549 5406 1853 6853 5061 3869 2403 4294 3277 336 2517 771 -3374 1529 163 990 2175 5856 4261 122 2099 2998 2012 2587 -4497 -1779 -2378 -3083 -6958 -2596 -21 1404 2382 428 1475 -1080 -1944 -597 -6110 -336 526 -1097 -2992 1654 -705 207 -2747 -367 -1402 458 -4862 1649 1856 -3036 587 -3333 -5234 1360 -6732 -2102 2537 1792 -1734 2906 6233 -1516 1717 1285 2239 1293 1926 3150 1917 2208 3707 4836 1139 1087 -3756 -684 916 206 1761 -577 1326 -1903 773 -3164 -4735 SS 20231023T092050.2Z 8696.389470 159 1 44.40 2 66.72 155.81 133.84 64.89 0.00 1 0.00 1 0 17 2.652e-02 6.059e-03 1.595e-02 2.562e-03 3.212563e-01 1.272612e-03 4.136319e-03 -6.000000e+00 1.487623e-02 223.41 -2.00 3.85 -2.00 318.76 0.00e+00 4.690735e-04 2.649667e-04 1.171035e-04 -6.000000e+00 6.481780e-04 274.35 -2.00 20.00 -2.00 318.15 0.00e+00 2.511 0.000 302.00 328.00 3 3.6763e+00 3.4369e-03 3.0331e-02 -6.0000e+00 3.6681e-02 4.7465e-02 3.9326e-03 1.7677e-02 -6.0000e+00 4.0118e-02 4.3693e-03 2.6967e-03 8.8300e-03 -6.0000e+00 2.3855e-02 -1.1003e-02 1.4051e-03 2.5935e-03 -6.0000e+00 1.0030e-02 7.6318e-04 -1.8462e-05 7.6932e-05 2.9185e-05 -6.0000e+00 7.2509e-04 1.3710e-03 0.0000e+00 12 1 1 12 4 4 99.97 6.61 0.36 0.00137 0.00123 131 28 4 8 0 338.890 14.97 6.61 22.49 23.11 23.43 28.6 979.70 -1605 3636 -1014 -12621 -1217 -10635 10705 -10164 -1463 -9486 -7532 113 -6033 1435 -4415 4791 -4478 3494 -36 2338 -1028 680 3987 -2848 3231 -3640 782 -2561 -71 1415 2710 3174 629 459 -6480 298 -2772 227 -206 -706 54 -1039 -34 -1349 1233 -1140 -175 -256 -710 -606 416 1291 181 1571 -480 1584 276 627 41 225 940 1195 2245 1024 367 -1101 -215 -487 934 893 275 245 -233 802 -478 323 -1015 -1635 -388 -815 -649 -1622 -1519 -1438 -657 -356 441 397 767 929 625 280 -393 910 -43 410 463 681 12 -381 42 -1505 -281 -494 -752 -1027 -613 -618 140 433 397 215 -4 -195 -274 201 352 -120 208 -677 -5 -211 804 377 775 17 65 996 -47 417 -316 117 -139 163 2 -354 338 363 15 -381 252 -658 -315 -80 186 -54 -700 -55 -521 465 -622 -90 -654 -512 8 -507 132 -493 534 -576 437 -5 320 -147 95 563 -461 523 -648 130 -415 -11 215 446 577 127 92 -1318 57 -618 59 -64 -254 19 -385 -13 -516 507 -479 -72 -103 -287 -253 185 613 93 830 -243 885 144 353 23 125 544 751 1385 674 238 -737 -135 -310 650 636 211 193 -181 644 -357 214 -629 -1011 -259 -622 -557 -1399 -1389 -1386 -673 -388 499 458 868 998 620 279 -370 858 -44 429 541 870 16 -494 50 -1667 -330 -557 -914 -1318 -819 -867 209 690 662 360 -6 -290 -377 265 471 -170 314 -1078 -7 -327 1196 540 1052 24 90 1417 -67 633 -506 192 -234 289 5 -695 675 735 31 -747 470 -1191 -566 SS 20231023T093135.0Z 8696.396933 164 1 48.99 2 66.09 158.60 132.38 67.50 0.00 1 0.00 1 0 17 5.582e-02 1.013e-02 4.562e-02 7.303e-03 3.155766e-01 3.695457e-03 4.204741e-03 -6.000000e+00 3.186701e-02 223.41 -2.00 3.85 -2.00 318.56 0.00e+00 8.400845e-04 7.266794e-04 2.139455e-04 -6.000000e+00 1.372348e-03 274.35 -2.00 20.00 -2.00 317.99 0.00e+00 2.450 0.000 302.00 328.00 3 5.7060e+00 9.8907e-03 2.9840e-02 -6.0000e+00 7.8631e-02 9.6750e-02 1.1258e-02 1.7675e-02 -6.0000e+00 8.5455e-02 -1.1228e-02 7.7317e-03 8.9497e-03 -6.0000e+00 5.0783e-02 -2.4580e-03 4.0812e-03 2.7404e-03 -6.0000e+00 2.1979e-02 1.0377e-04 -1.0737e-04 2.1792e-04 3.0413e-05 -6.0000e+00 1.5294e-03 2.7809e-03 0.0000e+00 12 9 9 12 4 4 99.89 6.61 0.27 0.00278 0.00197 17 4 1 8 0 2880.940 15.04 6.61 23.14 23.11 23.53 28.7 982.78 3282 20683 1362 44077 -8159 20915 -1673 11187 2973 -3840 -4594 -16580 6674 7927 4467 -11450 -2902 5705 5498 2554 -4010 2421 -4924 -5713 6788 -7410 4631 -3096 -508 692 430 3366 8837 -2358 571 -1939 -7061 -1720 -3972 -1600 -1766 2062 865 -687 1407 462 -1658 -1980 -256 -3674 725 -292 761 1592 61 2099 147 696 -724 948 -466 3365 2071 2415 200 590 -1620 -317 1310 1072 1053 5 1536 1452 80 -2841 -2020 -1188 -4606 135 -1713 -1669 -1626 -1759 -1036 -95 1422 783 1429 401 697 309 100 414 -291 313 -723 1697 204 -714 -695 -678 -1727 -851 -756 -2186 974 -858 1121 762 1226 166 -49 -291 103 306 -773 74 -377 43 -579 -44 1175 -310 569 -921 1010 272 470 99 -131 -589 252 372 -223 -13 743 537 -414 36 -231 -916 900000 178 1018 81 1569 -444 839 -92 616 194 -276 -333 -1460 540 744 497 -1631 -398 753 758 375 -633 357 -810 -1010 1120 -1444 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