File name: Pandora132s1_Berlin_20241122_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241122T230039.4Z 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_20241122_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: 20241122 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 20241122T093032.1Z 9092.396204 346 1 51.72 2 74.92 159.99 66.01 265.80 0.00 1 0.00 1 0 17 1.529e-01 5.989e-03 6.161e-02 2.527e-03 5.126202e-01 1.311138e-03 6.525146e-03 -6.000000e+00 8.591210e-02 220.60 -2.00 3.85 -2.00 320.48 0.00e+00 2.148950e-03 4.590989e-04 3.925930e-04 -6.000000e+00 3.692522e-03 270.15 -2.00 20.00 -2.00 320.04 0.00e+00 3.770 0.001 302.00 328.00 3 1.9690e+00 3.8383e-03 4.6709e-02 -6.0000e+00 2.1095e-01 6.2588e-02 4.7791e-03 2.9034e-02 -6.0000e+00 2.3029e-01 -2.8951e-03 4.6645e-03 1.5426e-02 -6.0000e+00 1.3683e-01 -7.2906e-03 2.4076e-03 5.4596e-03 -6.0000e+00 5.9020e-02 9.8285e-04 -6.3437e-04 7.5916e-05 6.1691e-05 -6.0000e+00 4.1921e-03 3.9796e-02 0.0000e+00 11 1 0 11 4 0 99.99 24.52 0.19 0.03980 0.03503 438 93 2 8 0 112.900 14.68 24.52 9.88 29.05 29.36 29.4 937.00 -64603 -22152 -50753 -38306 -37702 -82626 -26938 -67823 -27912 -63961 -7807 -41054 -18458 -17770 -18042 -5539 -18106 -2107 -11189 15017 -11148 2736 -5694 -1474 -4515 -8745 1867 -15792 -1684 -13167 4058 -2533 5707 -856 -5337 2661 -6481 2052 -1931 1825 -1741 1548 -806 1707 2937 -137 3579 -1072 3287 735 3861 1435 2831 1375 607 1916 -476 1770 -1257 834 1064 3693 1457 1265 179 -736 1000 -898 1851 -659 320 -368 180 449 -412 1091 -544 143 -53 -119 -1295 -1658 -2014 -1414 -906 -618 671 -266 1195 21 1001 -353 482 651 192 336 337 744 -482 -57 -575 9 333 -653 -1281 -1095 -505 -443 755 66 215 -327 196 -157 194 796 114 555 -210 -318 -65 324 316 53 627 -484 945 424 219 -92 -499 49 -221 73 -259 -155 306 236 -235 252 -67 -400 900000 -907 -224 -688 -425 -390 -1384 -292 -1270 -385 -1324 -98 -850 -382 -455 -556 -171 -691 -74 -458 492 -478 104 -251 -68 -229 -476 90 -875 -82 -798 243 -187 426 -68 -425 205 -632 224 -265 276 -270 245 -135 282 486 -24 605 -194 652 146 824 344 723 378 175 563 -144 514 -368 242 330 1247 561 521 74 -292 384 -373 851 -348 178 -208 97 225 -188 446 -217 60 -25 -67 -836 -1184 -1537 -1137 -773 -557 622 -250 1081 18 791 -263 350 503 168 336 381 923 -623 -71 -645 9 329 -691 -1458 -1307 -633 -594 1098 106 365 -562 322 -242 282 1124 167 856 -345 -531 -106 507 478 78 869 -649 1245 608 351 -161 -931 95 -446 156 -589 -364 724 563 -552 561 -141 -811 900000 SS 20241122T093559.9Z 9092.399999 348 1 50.47 2 74.64 161.29 66.83 266.86 0.00 1 0.00 1 0 25 1.588e-01 6.946e-03 1.823e-01 5.539e-03 5.071477e-01 2.872381e-03 6.487665e-03 -6.000000e+00 8.922729e-02 220.60 -2.00 3.85 -2.00 320.46 0.00e+00 2.290447e-03 1.007010e-03 5.931978e-04 -6.000000e+00 3.835586e-03 270.15 -2.00 20.00 -2.00 320.02 0.00e+00 3.707 0.001 302.00 328.00 3 3.0766e+00 8.4070e-03 4.6159e-02 -6.0000e+00 2.1909e-01 4.5732e-02 1.0462e-02 2.9074e-02 -6.0000e+00 2.3918e-01 8.1776e-03 1.0246e-02 1.5151e-02 -6.0000e+00 1.4211e-01 -7.2892e-03 5.2902e-03 5.3370e-03 -6.0000e+00 6.1291e-02 3.4753e-04 -7.8806e-04 1.6651e-04 5.9556e-05 -6.0000e+00 4.3546e-03 4.0643e-02 0.0000e+00 11 9 0 11 4 0 99.98 24.31 0.11 0.04064 0.03472 284 60 1 8 0 173.970 14.09 24.31 10.59 29.05 29.36 29.5 940.55 -80618 -60902 33351 -5252 28977 -63391 -55089 -72872 -11546 -56345 24864 -30758 14133 -19791 -25211 2964 -24151 9115 -14213 -4929 -29912 -5172 -9699 -15262 6590 -19065 -2508 -346 6750 -17930 8631 2839 2611 6826 -7421 -3555 -8411 5790 -558 1371 -273 1604 2984 -2094 4092 -2167 1119 -782 4102 -2273 2237 -762 1828 3276 -550 2932 -229 2284 260 479 -334 2922 1783 755 2150 1478 2310 585 2169 -440 -494 -327 -19 491 -330 875 964 750 -1073 -579 -387 -1504 -1840 -1604 -751 -1936 369 -363 942 -560 1578 580 157 1670 -948 203 96 1073 -587 -40 -218 46 221 -130 -408 -1401 -441 -465 709 130 61 -107 -375 98 156 828 203 444 -364 -768 -147 -3 1078 -441 802 -186 960 807 195 -170 -576 301 -159 302 -311 218 121 -5 -401 113 303 -590 900000 -1227 -837 180 -39 156 -809 -730 -1324 -137 -996 228 -581 214 -524 -767 85 -901 290 -551 -200 -1425 -215 -450 -816 303 -1058 -127 -17 306 -1152 499 201 203 505 -609 -294 -768 560 -69 191 -42 256 485 -363 677 -387 196 -143 741 -471 490 -188 476 891 -162 859 -70 666 76 141 -106 1004 692 316 876 578 883 242 1001 -234 -279 -186 -11 249 -152 362 383 314 -525 -328 -249 -1080 -1411 -1301 -645 -1783 345 -345 861 -489 1249 432 115 1284 -844 204 110 1333 -763 -49 -245 47 220 -138 -462 -1686 -555 -626 1036 209 104 -184 -622 152 226 1170 297 686 -598 -1290 -240 -4 1620 -646 1112 -248 1265 1152 312 -298 -1071 576 -321 642 -704 507 286 -12 -938 251 634 -1193 900000 SS 20241122T094751.5Z 9092.408235 350 1 43.59 2 74.11 164.12 68.62 269.14 0.00 1 0.00 1 0 17 2.885e-01 2.011e-02 2.581e-01 1.430e-02 4.815806e-01 7.414031e-03 6.281567e-03 -6.000000e+00 1.633615e-01 220.60 -2.00 3.85 -2.00 320.21 0.00e+00 3.558210e-03 2.388705e-03 1.303823e-03 -6.000000e+00 7.056003e-03 270.15 -2.00 20.00 -2.00 319.76 0.00e+00 3.590 0.001 302.00 328.00 3 5.0447e+00 2.1267e-02 4.4233e-02 -6.0000e+00 4.0157e-01 1.2416e-01 2.5699e-02 2.7048e-02 -6.0000e+00 4.3871e-01 -6.2663e-02 2.3263e-02 1.5151e-02 -6.0000e+00 2.5957e-01 2.3561e-02 1.2151e-02 5.8235e-03 -6.0000e+00 1.1216e-01 5.4224e-05 -1.1885e-03 4.3237e-04 7.1756e-05 -6.0000e+00 8.0617e-03 3.9184e-02 0.0000e+00 12 9 9 12 5 1 100.00 24.94 -0.00 0.03918 0.03025 26 7 1 8 0 1613.840 14.58 24.94 11.88 29.05 29.36 29.7 946.06 63059 900000 94432 -88903 147584 -52635 900000 -59039 53946 -81578 7897 -94623 53762 -25175 -46044 55103 -50326 1045 -49710 63643 -26982 -14229 -19589 -6493 10026 -26004 86563 -34944 36562 -18821 46227 6747 6374 82078 32850 -62 -7583 12588 -6962 16620 22797 14218 7329 -10447 -3939 1431 14670 -2114 5016 5656 -1675 -9756 9403 11577 -4005 6668 -9005 9994 -1798 4002 10995 4174 5157 3506 2584 -2278 10310 -2893 4759 -1281 910 -550 1849 3463 1848 6137 -10189 5584 -4313 1924 -5000 -1261 -3303 -2244 -971 -1464 1162 -2766 1184 -1056 732 666 -1695 611 -2618 1101 -960 -261 -143 1055 987 -2760 -1664 -149 27 -2037 501 283 1677 -362 1741 -360 -865 -372 525 726 -1936 1417 -424 1570 80 1759 1931 -731 1 -3169 2086 -1018 503 437 295 -654 1574 262 -1370 48 -244 1728 -441 -558 -166 -1018 900000 879 900000 1316 -2591 2057 -1000 900000 -1496 752 -2894 132 -4676 824 -957 -2567 1382 -3571 48 -3968 1863 -1778 -829 -1266 -395 546 -2076 2413 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