File name: Pandora64s1_NewHavenCT_20231225_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240123T152954.3Z 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_20231225_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: 20231225 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 20231225T172430.9Z 8759.725358 447 1 48.99 2 65.14 188.31 108.58 23.66 0.00 1 0.00 1 0 25 2.405e-02 8.353e-03 8.582e-03 1.604e-03 3.675241e-01 8.414805e-04 4.429243e-03 -6.000000e+00 1.427654e-02 223.04 -2.00 3.52 -2.00 318.05 0.00e+00 6.653818e-04 1.513662e-04 2.226728e-04 -6.000000e+00 6.242693e-04 276.27 -2.00 20.00 -2.00 317.47 0.00e+00 2.363 0.000 302.00 328.00 3 4.3651e+00 2.2286e-03 3.0032e-02 -6.0000e+00 3.5156e-02 3.2011e-02 2.5209e-03 1.8589e-02 -6.0000e+00 3.8178e-02 7.4152e-04 1.6598e-03 9.3645e-03 -6.0000e+00 2.2737e-02 -7.0019e-03 8.6009e-04 2.7823e-03 -6.0000e+00 9.7020e-03 3.9349e-04 -2.7606e-04 4.9444e-05 3.2747e-05 -6.0000e+00 7.1402e-04 -2.2432e-03 -2.8039e-06 11 8 0 10 0 0 99.83 21.39 -0.03 -0.00224 -0.00432 34 8 1 5 0 1440.630 25.90 20.03 21.39 15.48 37.7 980.33 -244 -696 -1721 -8236 -18394 -7774 -2945 -6642 309 -3999 -7578 -5 -750 -786 810 1753 -2602 1207 -230 1361 1387 -143 3303 1729 370 122 -33 -2142 -1695 -3977 630 615 1708 305 -5042 -2324 -2282 -1331 213 274 -1119 -982 -76 -1389 6 494 -134 363 -692 -1464 1479 324 1344 1462 -230 751 1528 254 413 350 661 1617 1826 2300 1244 -1264 -212 -1260 590 1704 565 843 39 540 -89 -1104 -761 -2463 -1275 -362 -1551 -1544 -1799 -1949 -263 -336 389 375 1090 664 543 79 -1148 -396 642 699 -58 1246 844 -399 -602 -1853 -1832 115 495 -1512 -519 -479 -162 588 1023 551 265 -8 -396 -367 440 -363 561 484 -335 -262 680 263 1113 624 -1352 593 1077 236 269 -636 -777 -302 593 -74 -328 413 435 -425 -82 -794 -13 -40 -103 -482 -1110 -431 -170 -447 21 -301 -602 0 -73 -85 100 235 -385 184 -37 225 231 -24 572 324 74 25 -7 -420 -324 -815 137 138 415 75 -1241 -587 -650 -444 79 117 -494 -453 -36 -666 3 235 -63 171 -332 -738 786 178 778 896 -141 468 957 159 265 227 432 1136 1332 1765 940 -920 -156 -914 466 1427 507 771 35 457 -72 -819 -555 -1834 -997 -306 -1425 -1564 -1861 -2135 -294 -384 459 447 1274 761 597 82 -1179 -401 704 823 -74 1659 1119 -532 -752 -2238 -2153 141 624 -2020 -705 -684 -240 896 1578 851 406 -11 -567 -510 620 -521 851 736 -511 -401 1003 381 1540 859 -1845 811 1587 363 424 -1011 -1279 -506 1045 -132 -596 758 788 -745 -142 -1337 SS 20231225T172919.6Z 8759.728699 450 1 48.43 2 65.28 189.51 108.22 24.67 0.00 1 0.00 1 0 25 2.603e-02 7.940e-03 3.567e-03 7.327e-04 3.683460e-01 3.834684e-04 4.434273e-03 -6.000000e+00 1.545591e-02 223.04 -2.00 3.52 -2.00 317.93 0.00e+00 6.686749e-04 6.637588e-05 1.975935e-04 -6.000000e+00 6.757775e-04 276.27 -2.00 20.00 -2.00 317.35 0.00e+00 2.375 0.000 302.00 328.00 3 2.8719e+00 1.0137e-03 3.0123e-02 -6.0000e+00 3.8060e-02 1.5408e-02 1.1456e-03 1.8574e-02 -6.0000e+00 4.1329e-02 -2.5734e-04 7.4154e-04 9.3515e-03 -6.0000e+00 2.4613e-02 -4.8945e-03 3.8171e-04 2.7854e-03 -6.0000e+00 1.0505e-02 1.7451e-03 -8.9953e-05 2.2425e-05 3.2654e-05 -6.0000e+00 7.7284e-04 -2.7650e-03 3.4052e-05 11 8 0 10 0 0 99.95 21.41 0.15 -0.00277 -0.00344 149 36 1 5 0 325.010 25.90 20.01 21.41 15.82 37.6 982.14 -3242 -2348 -3587 -5531 -24197 -4298 -5727 -2515 -1842 -1527 -6599 -3990 -2268 -1368 326 1229 -1348 1081 241 1768 653 -195 1211 1096 469 984 -125 -1535 -1839 -1018 1703 184 2377 -310 -4747 -2773 -1911 -1650 354 97 -720 -895 199 -890 -46 -6 -348 62 -432 -741 1312 1020 1089 1488 378 811 1158 490 226 285 646 1456 1713 2528 929 -1382 -144 -1425 789 1484 453 561 -24 551 -34 -1070 -1002 -2171 -678 -467 -1264 -906 -2078 -2041 -493 -525 238 202 1027 643 355 341 -884 -51 719 302 15 1256 738 -303 -650 -1601 -1944 151 314 -1334 -369 -701 -264 416 855 411 226 91 -287 -196 374 -259 710 440 -90 -258 708 196 980 716 -1111 502 1041 369 471 -525 -797 -372 529 -117 -475 369 259 -395 31 -720 -200 -153 -242 -349 -1715 -255 -376 -180 -144 -124 -575 -379 -228 -159 43 178 -212 177 42 313 118 -36 231 223 101 217 -27 -323 -379 -219 394 43 603 -80 -1225 -740 -570 -580 135 43 -340 -444 94 -427 -22 -3 -178 32 -208 -373 703 588 667 901 237 521 751 316 144 183 435 1060 1268 1965 715 -1023 -104 -1052 633 1245 407 514 -21 467 -28 -810 -761 -1677 -537 -396 -1207 -901 -2208 -2179 -558 -597 279 240 1195 745 381 360 -898 -53 771 362 19 1648 997 -398 -839 -1929 -2287 185 409 -1756 -510 -978 -392 631 1353 651 344 136 -402 -278 515 -375 1041 667 -136 -382 1055 279 1392 978 -1503 704 1507 550 741 -824 -1298 -635 912 -211 -839 656 455 -697 53 -1235 SS 20231225T173436.2Z 8759.732363 453 1 49.76 2 65.45 190.83 107.81 25.77 0.00 1 0.00 1 0 25 3.745e-02 9.715e-03 1.382e-02 2.381e-03 3.732477e-01 1.250568e-03 4.493997e-03 -6.000000e+00 2.223975e-02 223.04 -2.00 3.52 -2.00 318.14 0.00e+00 7.933647e-04 2.314880e-04 3.064343e-04 -6.000000e+00 9.724250e-04 276.27 -2.00 20.00 -2.00 317.56 0.00e+00 2.391 0.000 302.00 328.00 3 5.0598e+00 3.3175e-03 3.0433e-02 -6.0000e+00 5.4765e-02 5.5474e-02 3.7563e-03 1.8889e-02 -6.0000e+00 5.9471e-02 -8.9981e-03 2.4975e-03 9.5335e-03 -6.0000e+00 3.5417e-02 -1.5166e-03 1.2982e-03 2.8462e-03 -6.0000e+00 1.5115e-02 1.8743e-04 -3.5136e-04 7.3538e-05 3.3837e-05 -6.0000e+00 1.1122e-03 -2.5307e-03 1.7735e-05 12 9 8 11 8 0 99.80 21.45 0.06 -0.00253 -0.00517 14 3 1 5 0 3553.510 25.90 19.99 21.45 16.14 37.6 983.11 -2745 -10831 -9472 -9223 21991 -981 3863 -20161 6724 1163 -7889 -27 -6767 -11600 3144 -1258 -2178 2204 -1992 3795 2865 3546 5672 4173 -1033 5177 -2150 -2700 -1658 -8329 -394 -546 2123 51 -6426 -100 -1896 -2485 330 102 312 327 347 -2738 -1423 -1029 -366 525 -303 -234 1246 3097 2302 1142 11 853 1844 -358 -451 229 306 1654 1785 2346 1424 -1884 116 -1731 854 1888 920 434 -191 696 -174 -1528 40 -2511 -1644 -530 -784 -2472 -1798 -1802 -301 -565 691 413 1286 611 686 959 -1008 -703 766 831 -343 1303 983 -398 -1043 -1664 -2408 -11 -245 -1974 -350 21 53 617 1057 319 246 270 -433 -434 -19 -21 793 809 -338 -182 713 433 897 534 -1424 644 877 550 132 -748 -812 -731 730 -32 -244 615 455 -425 -145 -820 -144 -659 -580 -517 889 -48 196 -1461 409 78 -591 -2 -659 -1315 356 -164 -303 314 -308 577 443 546 903 718 -196 954 -419 -500 -297 -1676 -81 -123 510 12 -1591 -24 -506 -786 121 41 133 146 160 -1308 -675 -487 -170 243 -142 -115 623 1629 1296 689 7 520 1127 -221 -286 146 195 1135 1325 1757 1050 -1407 84 -1286 657 1603 802 388 -167 597 -138 -1160 28 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