File name: Pandora64s1_NewHavenCT_20240303_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240304T082953.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240303_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240303 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240303T133649.3Z 8828.567237 268 1 6.40 2 67.14 122.26 79.51 218.19 0.00 1 0.00 1 0 25 4.092e-02 8.281e-03 1.736e-02 3.119e-03 3.864147e-01 1.647794e-03 4.620505e-03 -6.000000e+00 2.453588e-02 225.64 -2.00 3.52 -2.00 318.10 0.00e+00 1.057718e-03 2.983890e-04 2.168121e-04 -6.000000e+00 1.061676e-03 276.09 -2.00 20.00 -2.00 317.52 0.00e+00 2.554 0.000 302.00 328.00 3 3.3742e+00 4.3921e-03 3.2314e-02 -6.0000e+00 6.0776e-02 4.2098e-02 4.9568e-03 1.9764e-02 -6.0000e+00 6.5886e-02 -3.7141e-03 3.2702e-03 9.8671e-03 -6.0000e+00 3.9156e-02 -4.3895e-03 1.6940e-03 2.9730e-03 -6.0000e+00 1.6616e-02 8.5153e-04 -3.1555e-04 9.5467e-05 3.4372e-05 -6.0000e+00 1.2159e-03 -2.9864e-03 -1.0149e-05 12 9 1 12 1 1 99.30 21.50 0.14 -0.00299 -0.00536 8 16 1 5 0 710.620 26.00 20.00 21.50 16.22 37.9 991.47 -6116 -2358 -4026 -14073 -37030 -10406 -10070 -857 12144 -5129 1261 -1016 -2607 -5224 4145 -443 1577 912 1138 1361 2958 633 3892 80 3428 -2331 1200 -3758 -604 -3199 3066 -601 2375 1 -500 -4224 -1352 -1395 659 -584 -283 -502 547 -2974 -965 -239 303 -288 254 -1867 1231 1063 1651 762 498 -286 1474 -40 501 -341 583 1696 1124 2941 1402 -1507 -521 -196 180 1265 236 282 109 345 -108 -697 -112 -876 -457 445 -1413 -1216 -1719 -1739 -381 -229 270 655 806 755 -59 275 -944 127 823 343 -119 1350 358 -412 -662 -1698 -2141 156 38 -1510 -385 -487 -335 -252 788 41 391 332 -123 -214 263 -154 835 600 -109 -202 897 330 1051 886 -1047 176 1421 484 458 -693 -873 -571 393 204 -193 294 255 -454 -118 -765 -326 -130 -231 -822 -2538 -559 -588 -51 702 -369 87 -81 -233 -564 474 -59 217 136 176 220 474 104 657 14 612 -455 223 -696 -113 -611 613 -136 575 0 -118 -1094 -384 -443 245 -237 -123 -230 257 -1377 -465 -115 143 -138 122 -913 635 590 969 456 306 -183 936 -26 312 -217 387 1157 838 2183 1079 -1124 -379 -145 140 1045 209 255 96 300 -86 -532 -81 -639 -352 386 -1338 -1218 -1760 -1884 -422 -268 315 770 933 856 -65 281 -967 133 902 406 -152 1794 477 -550 -829 -2054 -2527 190 49 -2014 -520 -693 -495 -386 1217 63 600 493 -177 -300 376 -224 1234 916 -166 -301 1327 483 1468 1229 -1442 245 2048 730 729 -1116 -1459 -972 683 366 -345 532 454 -806 -208 -1303 SS 20240303T134411.8Z 8828.572359 274 1 34.63 2 65.98 123.81 80.36 219.56 0.00 1 0.00 1 0 17 3.089e-02 7.972e-03 6.527e-03 1.282e-03 3.711373e-01 6.784356e-04 4.434626e-03 -6.000000e+00 1.852942e-02 225.64 -2.00 3.52 -2.00 317.97 0.00e+00 8.390593e-04 1.180850e-04 2.143699e-04 -6.000000e+00 8.015974e-04 276.09 -2.00 20.00 -2.00 317.39 0.00e+00 2.439 0.000 302.00 328.00 3 3.4829e+00 1.8041e-03 3.0918e-02 -6.0000e+00 4.5899e-02 4.6432e-02 2.0345e-03 1.8964e-02 -6.0000e+00 4.9748e-02 -5.8739e-03 1.3229e-03 9.4653e-03 -6.0000e+00 2.9564e-02 -4.0457e-03 6.7892e-04 2.8317e-03 -6.0000e+00 1.2553e-02 8.7096e-04 1.9954e-04 3.9443e-05 3.2856e-05 -6.0000e+00 9.1758e-04 -4.0948e-03 9.7425e-05 12 9 1 12 1 1 99.98 21.48 0.13 -0.00409 -0.00260 58 20 1 5 0 586.870 26.00 20.00 21.48 16.33 38.0 992.35 -3051 -2910 2516 -5708 -31440 -3782 -3538 -2641 120 -1037 -5782 -4207 -966 -3104 -22 293 -1823 1620 -5 2187 1174 -235 2492 653 399 551 -98 -1981 -1775 -1924 621 -87 2393 329 -4603 -2495 -2463 -367 523 -261 -1152 -981 -223 -1170 67 428 -170 83 -750 -654 1339 1470 1044 1450 530 963 818 639 353 476 775 1570 1330 2435 826 -1434 -296 -943 533 1737 434 438 43 471 -175 -1019 -805 -2092 -962 -550 -1131 -954 -2116 -2109 -587 -344 256 139 1227 655 318 124 -816 -209 690 524 -29 1166 736 -453 -560 -1460 -1791 168 411 -1488 -367 -698 -194 365 835 355 266 40 -296 -261 382 -135 670 560 -29 -62 769 163 903 788 -1197 449 907 319 422 -605 -717 -415 525 -49 -441 484 245 -319 -79 -807 -180 -184 154 -348 -2308 -215 -218 -181 9 -81 -479 -351 -92 -353 -3 41 -276 253 -1 370 202 -41 449 128 82 117 -21 -401 -350 -399 139 -20 581 81 -1136 -635 -707 -122 190 -109 -523 -465 -108 -576 33 209 -83 40 -371 -337 685 805 610 894 338 629 542 419 228 311 531 1087 1000 1916 644 -1074 -215 -700 432 1462 393 405 39 402 -146 -779 -580 -1532 -771 -468 -1082 -949 -2250 -2247 -662 -408 299 165 1418 757 342 131 -827 -216 735 622 -37 1515 985 -591 -718 -1743 -2197 203 531 -1939 -501 -1005 -284 544 1299 553 398 59 -428 -365 544 -192 1008 870 -45 -93 1126 239 1263 1058 -1594 620 1289 487 650 -969 -1189 -692 920 -86 -787 871 436 -571 -136 -1352 SS 20240303T135930.5Z 8828.582992 282 1 39.63 2 63.63 127.12 82.20 222.34 0.00 1 0.00 1 0 17 1.410e-02 7.457e-03 2.311e-03 5.335e-04 3.423771e-01 2.819534e-04 4.107496e-03 -6.000000e+00 8.459538e-03 225.64 -2.00 3.52 -2.00 317.74 0.00e+00 5.982871e-04 4.590709e-05 1.593702e-04 -6.000000e+00 3.659925e-04 276.09 -2.00 20.00 -2.00 317.16 0.00e+00 2.239 0.000 302.00 328.00 3 2.1020e+00 7.4619e-04 2.8432e-02 -6.0000e+00 2.0955e-02 3.3866e-02 8.3881e-04 1.7476e-02 -6.0000e+00 2.2714e-02 -1.6521e-03 5.3063e-04 8.7109e-03 -6.0000e+00 1.3499e-02 -5.8994e-03 2.6932e-04 2.5534e-03 -6.0000e+00 5.7303e-03 4.4132e-03 7.7877e-05 1.6496e-05 3.0080e-05 -6.0000e+00 4.1907e-04 -3.6129e-03 5.1521e-05 12 9 1 12 1 1 99.99 21.45 0.16 -0.00361 -0.00303 465 137 1 5 0 85.020 25.90 20.00 21.45 16.85 38.1 994.88 -19 -717 -242 -3711 -9779 -2516 -2154 677 955 51 -4224 -1730 -761 143 733 1380 -1045 1386 -7 2122 630 -354 725 957 -131 836 -379 -1423 -1706 -45 1342 201 1916 -10 -4665 -2505 -2000 -1207 -20 -152 -1082 -1079 -406 -984 -316 157 -780 -152 -802 -414 1152 -22 855 1369 373 810 1212 599 246 379 649 1366 1435 2409 763 -1334 -245 -1476 733 1534 463 481 23 511 63 -929 -719 -1967 -479 -335 -1126 -731 -1883 -1965 -532 -397 301 267 1054 526 336 329 -785 -82 854 275 -88 1197 699 -378 -406 -1644 -1826 291 449 -1291 -333 -765 -295 397 748 354 167 57 -309 -223 453 -161 649 446 -105 -249 593 59 893 710 -1158 425 855 241 443 -588 -739 -324 480 -66 -406 451 319 -336 77 -729 -1 -56 -19 -276 -717 -175 -162 56 86 5 -386 -171 -87 19 110 225 -183 252 -1 415 126 -72 153 214 -29 187 -91 -325 -380 -10 332 50 515 -3 -1261 -697 -624 -441 -8 -69 -532 -554 -213 -521 -167 83 -408 -79 -420 -224 620 -13 523 880 248 551 831 408 165 257 462 983 1113 1950 610 -1018 -180 -1115 600 1306 422 449 21 441 53 -717 -522 -1444 -382 -284 -1071 -720 -1978 -2184 -594 -468 366 329 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