File name: Pandora55s1_QueensNY_20201229_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T174204.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20201229_L1_smca1c10d20200414p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20201229 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: None First and last pixel inside fitting window: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20201229T134511.0Z 7668.573044 323 1 50.01 2 77.98 135.60 105.39 321.99 0.00 1 0.00 1 0 25 2.425e-01 6.617e-03 3.172e-02 8.666e-04 6.650380e-01 4.585039e-04 7.663362e-03 -6.000000e+00 1.414933e-01 223.27 -2.00 3.51 -2.00 320.37 0.00e+00 2.163924e-03 1.724856e-04 1.390444e-03 -6.000000e+00 6.217859e-03 276.32 -2.00 20.00 -2.00 319.86 0.00e+00 4.657 0.002 302.00 328.00 3 -1.0724e-01 1.3600e-03 5.7949e-02 -6.0000e+00 3.4839e-01 8.2586e-02 1.7419e-03 3.6106e-02 -6.0000e+00 3.7926e-01 -4.6890e-02 1.7342e-03 1.7851e-02 -6.0000e+00 2.2588e-01 6.6451e-03 8.7546e-04 6.1064e-03 -6.0000e+00 9.5811e-02 2.7448e-03 -9.6183e-04 2.4558e-05 6.8455e-05 -6.0000e+00 7.2737e-03 1.3574e-02 4.0336e-06 11 8 0 10 0 0 -3.78 22.83 0.24 0.01357 0.00635 433 82 1 5 0 114.140 25.68 20.00 22.83 9.37 26.7 1059.87 -64197 -55710 -103033 -87008 -80785 -93536 -63112 -83758 -81393 -86700 -55781 -74983 -42028 -8926 -16748 -28172 944 -5512 -6015 -9018 -11311 -12920 -17841 -19523 -11857 -3228 -15143 -18547 -17167 -7974 -3126 -4637 -7958 -2036 4183 -4222 -3679 2232 -242 -1913 -1959 -3482 -961 -993 1874 -958 1930 760 1580 1040 1376 1476 2750 2325 1016 1481 200 693 126 1612 1975 2149 511 888 599 1943 1273 2480 1719 -153 -83 -471 -532 -432 -37 432 1293 1085 271 -98 -159 -1582 -1434 -1451 -1425 -997 -831 -485 -421 67 499 851 1660 1369 1305 723 690 -428 -431 -308 -317 307 929 -4 -1322 -507 -790 -117 -104 -141 -558 -366 -24 -19 591 1033 1060 488 -352 -852 -483 -142 -205 -95 101 315 1416 1023 116 254 18 345 77 195 -387 -172 152 -367 -461 -89 -43 -42 267 -391 -348 -1062 -735 -621 -854 -480 -899 -949 -1158 -613 -1106 -632 -124 -282 -623 18 -121 -143 -231 -304 -364 -567 -695 -423 -110 -582 -734 -696 -333 -150 -268 -533 -133 254 -290 -262 182 -25 -231 -264 -511 -144 -152 285 -154 311 130 284 189 279 334 676 619 290 439 61 209 37 472 606 732 186 355 250 793 523 1062 829 -79 -47 -275 -304 -231 -19 204 576 502 143 -57 -108 -1153 -1140 -1230 -1210 -894 -779 -463 -397 60 447 715 1345 1161 1166 750 778 -522 -566 -405 -390 359 1002 -5 -1541 -621 -972 -153 -142 -204 -892 -590 -38 -31 917 1534 1572 756 -578 -1387 -779 -232 -321 -143 154 461 1998 1501 182 426 32 650 146 394 -804 -375 340 -801 -1005 -194 -90 -85 521 SS 20201229T135108.9Z 7668.577186 326 1 49.76 2 77.19 136.75 106.05 323.16 0.00 1 0.00 1 0 25 1.962e-01 6.513e-03 2.173e-02 7.306e-04 6.322659e-01 3.841214e-04 7.312065e-03 -6.000000e+00 1.144863e-01 223.27 -2.00 3.51 -2.00 320.14 0.00e+00 2.123608e-03 1.347017e-04 1.031129e-03 -6.000000e+00 5.030741e-03 276.32 -2.00 20.00 -2.00 319.62 0.00e+00 4.393 0.001 302.00 328.00 3 -1.3416e-01 1.1154e-03 5.4591e-02 -6.0000e+00 2.8189e-01 8.1173e-02 1.3900e-03 3.3627e-02 -6.0000e+00 3.0687e-01 -4.4659e-02 1.3305e-03 1.6715e-02 -6.0000e+00 1.8276e-01 5.9785e-03 6.8108e-04 5.6983e-03 -6.0000e+00 7.7526e-02 3.7358e-03 -8.8298e-04 2.0902e-05 6.3907e-05 -6.0000e+00 5.8850e-03 1.3350e-02 9.2784e-06 11 8 0 10 0 0 9.91 22.83 0.22 0.01335 0.00672 502 95 1 5 0 98.120 25.68 20.00 22.83 9.52 26.6 1060.38 -81941 -19506 -89321 -65683 -76826 -60888 -56231 -65059 -55875 -73782 -41433 -55317 -24639 -11768 -13860 -21164 4792 -6814 -1830 -6012 -7058 -5876 -13799 -10756 -9043 874 -13188 -12860 -12161 -2718 -2667 -3329 -4805 -3446 2321 -1864 -2099 -146 128 -1538 -1550 -2405 -1500 -1260 1217 -545 755 720 1533 1424 827 1585 2106 1836 896 1452 452 374 199 1171 2224 1981 1073 444 662 1592 1081 2121 1346 239 -33 -408 -685 -403 -180 449 800 1296 -108 171 -251 -1552 -1550 -1378 -1268 -980 -703 -684 -516 59 643 793 1413 1394 1214 742 775 -259 -672 -413 -390 406 1081 -87 -1038 -618 -691 -198 -51 -219 -556 -266 -33 -3 692 967 1025 492 -320 -843 -448 -167 -271 -6 99 310 1407 959 115 346 -1 280 95 213 -436 -152 155 -365 -452 -109 -112 35 251 -882 -125 -1070 -655 -827 -581 -577 -834 -725 -1123 -558 -939 -432 -210 -309 -591 116 -203 -56 -199 -242 -205 -557 -461 -411 37 -648 -625 -606 -138 -161 -238 -357 -261 164 -142 -183 -15 16 -228 -255 -394 -254 -218 209 -98 137 136 304 306 199 422 610 575 278 466 149 123 64 400 735 727 448 205 316 742 504 1027 683 138 -21 -250 -440 -242 -99 222 401 667 -59 109 -176 -1239 -1270 -1201 -1175 -906 -680 -675 -503 55 592 683 1173 1201 1166 778 883 -319 -892 -548 -485 478 1175 -95 -1222 -767 -862 -262 -70 -321 -894 -429 -54 -5 1064 1425 1580 756 -522 -1366 -722 -271 -425 -9 150 452 1971 1394 177 571 -2 518 178 421 -886 -325 326 -783 -967 -234 -228 70 482 SS 20201229T140458.7Z 7668.586790 337 1 49.37 2 75.45 139.48 107.50 325.92 0.00 1 0.00 1 0 25 1.116e-01 6.352e-03 1.023e-02 5.315e-04 5.685263e-01 2.761264e-04 6.630263e-03 -6.000000e+00 6.512037e-02 223.27 -2.00 3.51 -2.00 319.67 0.00e+00 1.390862e-03 8.236017e-05 6.582919e-04 -6.000000e+00 2.861400e-03 276.32 -2.00 20.00 -2.00 319.11 0.00e+00 3.898 0.001 302.00 328.00 3 -1.7115e-01 7.7811e-04 4.8433e-02 -6.0000e+00 1.6034e-01 6.3273e-02 9.3008e-04 2.9503e-02 -6.0000e+00 1.7455e-01 -3.6376e-02 8.0665e-04 1.4737e-02 -6.0000e+00 1.0396e-01 5.4061e-03 4.2228e-04 4.6471e-03 -6.0000e+00 4.4098e-02 6.6732e-03 -7.4967e-04 1.5511e-05 5.4725e-05 -6.0000e+00 3.3473e-03 1.3263e-02 1.3501e-05 10 0 0 10 0 0 1.39 22.83 0.21 0.01326 0.00763 683 129 1 5 0 71.430 25.68 20.00 22.83 9.73 26.5 1060.78 -46668 -17429 -57062 -30846 -49545 -36488 -30737 -35493 -29767 -37029 -18287 -31061 -12871 -7919 -4477 -11113 -4334 -4327 730 -3085 -2661 -2250 -6418 -3734 -5050 -152 -7259 -4115 -4752 -1440 6 287 -2322 -1800 1603 -1998 -54 283 -413 -2224 -1372 -2215 -955 -603 416 -586 -12 568 837 1636 1010 1844 1614 1669 611 1068 -37 507 718 1399 2166 1496 821 -31 574 690 1089 1762 1209 174 -409 -611 -717 -664 -319 560 651 1419 191 99 -571 -1534 -1427 -1268 -1081 -902 -635 -537 -447 135 652 745 1516 1452 1205 811 741 -355 -656 -376 -468 219 914 -107 -1120 -609 -845 -122 -41 -183 -499 -322 -107 85 696 958 991 503 -268 -714 -477 -184 -341 90 33 412 1407 971 209 330 -34 280 136 219 -293 -222 164 -368 -455 -207 -83 -55 189 -716 -220 -984 -429 -796 -533 -476 -659 -576 -749 -369 -764 -329 -240 -158 -481 -194 -211 36 -165 -144 -125 -395 -244 -360 -11 -543 -293 -346 -111 1 27 -249 -197 167 -223 -7 42 -69 -440 -297 -515 -228 -146 101 -147 -3 147 226 471 300 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