File name: Pandora132s1_Berlin_20250609_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20250609T231147.6Z 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 v1.8.75 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20250609_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: 20250609 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 20250609T055856.2Z 9291.249262 217 1 36.06 2 64.06 85.49 132.42 286.71 0.00 1 0.00 1 0 17 1.720e-01 1.290e-02 1.394e-01 1.019e-02 3.863427e-01 5.352153e-03 5.006353e-03 -6.000000e+00 1.012865e-01 233.02 -2.00 3.85 -2.00 319.24 0.00e+00 2.099878e-03 1.277733e-03 2.220639e-04 -6.000000e+00 4.311341e-03 279.19 -2.00 20.00 -2.00 318.59 0.00e+00 2.272 0.000 302.00 328.00 3 5.9862e+00 1.4921e-02 3.2258e-02 -6.0000e+00 2.5518e-01 1.0757e-01 1.7161e-02 2.2787e-02 -6.0000e+00 2.7566e-01 -3.4359e-02 1.2585e-02 1.1141e-02 -6.0000e+00 1.6304e-01 7.2755e-03 6.5877e-03 3.7235e-03 -6.0000e+00 6.9004e-02 8.0239e-05 -7.1887e-04 3.0578e-04 3.8921e-05 -6.0000e+00 4.7312e-03 3.9080e-02 0.0000e+00 12 9 9 12 5 1 100.00 11.13 0.79 0.03908 0.03368 12 4 1 8 0 2772.930 14.82 11.13 19.89 30.21 30.65 31.2 999.19 -18376 -6603 86327 4659 28452 -10730 18011 -30248 4363 -29367 162730 18165 -14075 -4316 6260 10498 -1928 -3729 -7048 1606 -5152 6704 12171 -13260 5029 -5159 -10410 -4893 3745 22243 -12944 7029 -6926 2553 -7550 2555 -1203 541 -619 3959 988 1318 -2192 72 4607 -3058 -689 -3495 -2040 96 4699 3738 715 -4286 2458 4254 -1564 3853 -189 659 2749 4698 335 -980 826 804 -456 -3064 1836 -130 -28 466 261 -468 569 -2817 5769 278 -3814 3052 -1721 -718 -2880 -353 -2318 880 689 -1304 -1295 429 179 -119 1590 1180 -822 678 3372 138 486 233 -730 -50 771 -3693 -1126 -42 391 -834 1215 -529 1789 -937 -721 658 -915 31 408 -380 -1124 -1421 537 795 1653 278 1986 -901 439 188 255 -478 566 502 60 805 -418 -913 -79 360 772 -140 -371 -959 900000 -714 -245 1247 139 617 -349 488 -1502 165 -1591 1617 705 -903 -300 452 796 -176 -367 -751 162 -558 648 1165 -1748 581 -671 -1382 -583 402 2109 -1964 978 -1188 390 -1214 385 -216 115 -159 1094 301 418 -736 24 1465 -1049 -229 -1190 -693 33 1702 1475 309 -2040 1125 1960 -767 1757 -88 308 1338 2465 201 -621 497 451 -250 -1793 1151 -92 -21 355 193 -327 357 -1644 2902 151 -2425 2075 -1378 -621 -2689 -341 -2436 952 776 -1512 -1467 450 173 -106 1325 1029 -808 739 4005 185 663 303 -877 -55 830 -4420 -1404 -55 528 -1203 1850 -882 3036 -1622 -1185 988 -1302 43 575 -571 -1810 -2362 868 1240 2463 402 2685 -1190 563 256 379 -771 942 859 106 1506 -838 -1898 -165 759 1596 -281 -708 -1771 900000 SS 20250609T060428.4Z 9291.253107 220 1 51.22 2 63.21 86.56 133.20 287.99 0.00 1 0.00 1 0 25 3.356e-02 5.520e-03 2.717e-02 2.702e-03 3.766741e-01 1.417292e-03 4.863498e-03 -6.000000e+00 1.976940e-02 233.02 -2.00 3.85 -2.00 319.29 0.00e+00 8.205823e-04 3.459894e-04 2.132420e-04 -6.000000e+00 8.410482e-04 279.19 -2.00 20.00 -2.00 318.64 0.00e+00 2.207 0.000 302.00 328.00 3 3.6385e+00 3.9631e-03 3.1377e-02 -6.0000e+00 4.9809e-02 3.6574e-02 4.5787e-03 2.2099e-02 -6.0000e+00 5.3799e-02 2.5672e-02 3.4307e-03 1.0821e-02 -6.0000e+00 3.1821e-02 -1.9287e-02 1.7957e-03 3.1371e-03 -6.0000e+00 1.3472e-02 9.2832e-04 -5.8641e-04 8.1577e-05 3.3889e-05 -6.0000e+00 9.2307e-04 3.6562e-02 0.0000e+00 11 1 0 11 4 0 99.99 10.97 0.07 0.03656 0.03216 345 73 1 8 0 143.440 15.01 10.97 19.88 30.21 30.54 31.4 999.99 -12278 637 -14550 633 -13744 -6288 -6303 -10069 -6526 -18951 -6696 -9618 3284 -4247 5612 -1701 1960 421 -1139 3291 -5814 648 -1780 3662 -2082 -791 -1754 -762 1180 -1430 3588 1024 4421 -3712 -895 -670 -385 339 -1436 -1030 -2377 316 -1709 33 -398 -728 -804 205 -78 375 1774 590 1736 199 756 812 -282 306 1052 1079 432 2081 1039 442 -347 682 -585 187 1798 -747 298 -281 555 183 142 302 158 448 -208 -288 -972 -1567 -1950 -359 -1252 -502 320 134 408 21 1345 278 703 782 585 36 241 228 -366 -97 -592 -22 266 65 -1412 -766 -433 -516 487 64 127 -164 249 -162 466 913 304 185 -296 -582 -596 255 212 120 518 88 1215 791 262 -152 -409 -175 304 250 53 -316 420 -42 -364 -224 -128 -53 900000 -379 19 -491 17 -392 -170 -192 -364 -249 -840 -269 -447 160 -265 367 -131 155 36 -104 298 -581 61 -182 382 -244 -94 -203 -83 123 -162 434 142 639 -571 -128 -99 -66 69 -358 -290 -730 99 -557 11 -129 -238 -260 66 -25 127 645 235 728 89 347 383 -135 144 481 499 213 1112 613 274 -210 380 -318 105 1118 -533 224 -215 410 127 90 171 84 243 -127 -202 -771 -1364 -1803 -346 -1304 -552 363 154 456 22 1292 247 594 687 569 40 296 305 -503 -128 -713 -24 290 75 -1777 -1004 -593 -745 751 98 202 -259 407 -245 657 1246 429 278 -475 -964 -981 404 323 175 717 116 1559 1079 392 -246 -691 -303 544 472 107 -658 885 -90 -769 -455 -247 -98 900000 SS 20250609T060943.0Z 9291.256748 222 1 51.47 2 62.42 87.58 133.94 289.21 0.00 1 0.00 1 0 17 2.056e-02 5.470e-03 9.654e-03 1.215e-03 3.676728e-01 6.315815e-04 4.770652e-03 -6.000000e+00 1.211326e-02 233.02 -2.00 3.85 -2.00 319.03 0.00e+00 8.599960e-04 1.427557e-04 1.541615e-04 -6.000000e+00 5.153145e-04 279.19 -2.00 20.00 -2.00 318.38 0.00e+00 2.148 0.000 302.00 328.00 3 2.7626e+00 1.7422e-03 3.0564e-02 -6.0000e+00 3.0519e-02 5.3121e-02 1.9935e-03 2.1499e-02 -6.0000e+00 3.2964e-02 -1.7805e-03 1.4179e-03 1.0490e-02 -6.0000e+00 1.9497e-02 -9.2561e-03 7.4229e-04 3.0048e-03 -6.0000e+00 8.2551e-03 2.3918e-03 -6.2085e-04 3.6234e-05 3.2921e-05 -6.0000e+00 5.6558e-04 3.6390e-02 0.0000e+00 11 1 0 11 4 0 99.99 10.97 0.20 0.03639 0.03173 347 74 1 8 0 142.530 15.01 10.97 20.02 30.12 30.54 31.4 1000.98 3458 -5252 -4599 -6806 -10822 839 -7170 2310 -8011 -2575 -8952 -396 -2092 281 2304 -2820 2922 -2421 2591 -470 1641 1601 1618 -592 -688 -276 -2754 140 -1932 1680 968 2653 880 -2996 -776 -2734 -629 -783 -180 -2107 -921 -801 -1283 -653 -185 -413 -767 -167 -774 684 426 505 1011 617 677 1053 466 251 554 503 1604 1801 1493 1127 -522 219 -325 658 1334 450 40 -59 63 56 -214 -105 -112 -430 -90 -1041 -1123 -1618 -1410 -988 -629 -340 -43 387 333 521 895 382 744 1114 426 312 482 121 -434 -412 -164 -268 651 -428 -1429 -836 -702 -325 497 135 -8 -72 -16 113 516 712 520 208 -184 -791 -127 -275 303 132 594 64 1134 1068 76 180 -609 152 23 390 -151 -388 276 -96 -275 -161 22 -144 900000 123 -219 -189 -260 -399 28 -290 97 -406 -127 -479 -22 -138 22 199 -280 290 -269 286 -56 191 188 200 -80 -99 -40 -398 19 -256 226 146 440 160 -553 -133 -498 -129 -195 -48 -651 -302 -273 -450 -229 -65 -145 -267 -57 -270 247 167 214 452 290 328 522 234 124 268 247 824 1013 919 727 -331 128 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