File name: Pandora55s1_QueensNY_20200914_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T165431.0Z 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_20200914_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: 20200914 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 20200914T120949.0Z 7562.506817 194 1 48.03 2 73.05 100.80 34.82 115.67 0.00 1 0.00 1 0 25 1.277e-01 1.412e-02 2.991e-02 2.875e-03 4.082263e-01 1.511610e-03 4.877165e-03 -6.000000e+00 7.628866e-02 229.26 -2.00 3.51 -2.00 318.82 0.00e+00 1.463698e-03 3.484029e-04 6.571973e-04 -6.000000e+00 3.438185e-03 287.98 -2.00 20.00 -2.00 318.02 0.00e+00 3.378 0.001 302.00 328.00 3 3.6362e+00 4.1671e-03 4.0022e-02 -6.0000e+00 1.8969e-01 5.7804e-02 4.8031e-03 2.2149e-02 -6.0000e+00 2.0515e-01 -1.0794e-02 3.3464e-03 1.0450e-02 -6.0000e+00 1.2248e-01 -7.6265e-04 1.7444e-03 3.4386e-03 -6.0000e+00 5.1915e-02 2.9151e-04 -8.2821e-04 8.8363e-05 3.7613e-05 -6.0000e+00 3.8390e-03 1.0291e-02 5.3261e-05 12 9 9 12 33 1 99.43 22.95 0.10 0.01029 0.00407 13 3 1 5 0 3417.840 25.79 20.00 22.95 26.88 26.4 1015.06 2065 -12282 -51551 49937 35341 -15207 66042 -5223 17719 -24173 299 -32643 14023 64213 -4846 -18293 -18325 -4365 8929 28518 -9454 17556 -13154 -10683 -7624 33404 -3224 -20529 -4710 1784 13021 5064 -5894 2810 -1570 -2086 -3644 8535 8826 -4232 4214 -7259 -2927 2125 -1562 -1412 3532 3635 4024 -566 958 -3525 3641 4750 2187 4622 3285 -213 1559 2492 3245 -397 -595 -828 -1461 4273 -2628 3707 932 -244 -1399 -1387 -3287 2052 -1845 1765 2709 1660 -586 -1042 2034 -1732 -983 -3394 -124 -2120 -1064 -1744 381 -1081 -307 940 952 1364 822 201 532 -592 -1015 -51 -318 427 2423 952 -1160 -31 105 254 1221 596 -1337 -152 -359 205 404 1129 888 389 -750 -1877 -503 -661 1170 -537 476 -575 1191 1143 15 556 -42 633 542 726 109 531 73 -663 -812 -99 -808 48 -61 64 -467 -2822 1013 777 -544 1230 -210 623 -1303 13 -2227 732 2485 -411 -1934 -2073 -461 879 2424 -1164 1706 -1772 -1504 -1101 3391 -453 -3274 -642 240 1754 818 -1125 503 -286 -390 -770 1893 2290 -1381 1387 -2746 -1102 774 -594 -538 1291 1331 1497 -227 404 -1653 1706 2320 1127 2402 1741 -116 828 1320 1767 -237 -383 -562 -1003 2714 -1706 2322 639 -184 -1127 -1149 -2740 1593 -1396 1208 1738 1069 -407 -800 1677 -1580 -940 -3447 -129 -2334 -1203 -2019 435 -1214 -328 943 917 1311 834 222 633 -760 -1362 -68 -408 516 2790 1122 -1446 -40 139 349 1739 896 -2118 -243 -572 315 594 1600 1258 566 -1140 -2968 -799 -1043 1790 -813 696 -825 1647 1592 22 856 -68 1046 916 1259 197 984 138 -1275 -1572 -190 -1510 86 -109 SS 20200914T121652.1Z 7562.511714 198 1 50.24 2 71.75 102.04 33.67 117.66 0.00 1 0.00 1 0 25 3.064e-02 7.340e-03 6.802e-03 1.128e-03 3.851831e-01 5.917053e-04 4.601486e-03 -6.000000e+00 1.829752e-02 229.25 -2.00 3.51 -2.00 318.26 0.00e+00 -1.241758e-04 1.148267e-04 2.598709e-04 -6.000000e+00 8.246689e-04 287.98 -2.00 20.00 -2.00 317.43 0.00e+00 3.150 0.001 302.00 328.00 3 2.2969e+00 1.6011e-03 3.7318e-02 -6.0000e+00 4.5497e-02 3.5846e-02 1.8213e-03 2.0219e-02 -6.0000e+00 4.9206e-02 -2.8986e-03 1.1881e-03 9.8239e-03 -6.0000e+00 2.9376e-02 -3.7192e-03 6.1178e-04 2.7065e-03 -6.0000e+00 1.2451e-02 1.4485e-03 -6.1396e-04 3.4570e-05 3.3347e-05 -6.0000e+00 9.2081e-04 1.0297e-02 3.9712e-05 11 8 0 10 0 0 96.45 22.94 0.19 0.01030 0.00568 68 13 1 5 0 738.610 25.79 20.02 22.94 26.95 26.5 1015.41 -8112 17860 -19185 2163 -2985 -5420 -1369 -4215 -3473 -7947 -2093 -7164 673 9183 -2364 -6097 1490 3849 1367 2425 -2013 1496 -2346 -3506 -2064 4169 -772 -3318 -2375 428 1876 1338 -3484 474 3384 -340 -849 1581 371 -2356 -385 -2622 -1551 -881 428 -1348 -184 -480 898 622 486 -206 1479 1867 630 1651 504 1346 750 1610 1725 1114 329 -154 -415 1006 -128 1708 1345 -92 -561 -628 -1080 -453 -347 560 1173 1525 148 -173 -278 -1365 -1361 -1380 -843 -972 -677 -791 -613 -497 327 477 1538 1775 1304 1011 706 -225 -812 -558 -509 50 1168 274 -826 -402 -700 -78 118 -107 -522 -399 -111 -30 612 1001 901 604 -313 -1064 -651 -331 -98 -28 343 324 1442 1108 250 494 178 339 290 402 -269 -146 138 -408 -485 -306 -315 -127 101 -417 769 -1155 101 -139 -265 -71 -253 -225 -556 -145 -574 58 856 -278 -806 196 523 199 360 -317 232 -395 -635 -389 763 -146 -618 -430 78 370 292 -842 112 763 -81 -225 475 130 -938 -162 -1166 -702 -399 194 -616 -83 -217 408 292 242 -109 816 1072 376 1003 312 826 457 978 1080 743 234 -115 -310 722 -90 1196 1003 -74 -483 -553 -949 -385 -280 421 836 1078 111 -142 -247 -1301 -1358 -1432 -908 -1090 -784 -931 -719 -570 359 496 1533 1764 1359 1129 847 -289 -1083 -741 -652 60 1371 328 -1034 -521 -935 -107 168 -160 -808 -627 -172 -46 883 1399 1256 862 -464 -1636 -1010 -509 -148 -41 494 456 1965 1523 358 743 278 544 473 672 -466 -261 250 -749 -897 -558 -564 -221 174 SS 20200914T122251.1Z 7562.515870 201 1 50.26 2 70.64 103.10 32.71 119.43 0.00 1 0.00 1 0 25 2.026e-02 7.088e-03 4.680e-03 9.645e-04 3.657441e-01 5.059620e-04 4.384273e-03 -6.000000e+00 1.209745e-02 229.25 -2.00 3.51 -2.00 317.96 0.00e+00 1.127199e-04 8.973958e-05 2.227140e-04 -6.000000e+00 5.452451e-04 287.98 -2.00 20.00 -2.00 317.13 0.00e+00 2.982 0.000 302.00 328.00 3 2.2020e+00 1.3580e-03 3.5343e-02 -6.0000e+00 3.0080e-02 3.3996e-02 1.5365e-03 1.9172e-02 -6.0000e+00 3.2533e-02 -5.3838e-03 9.6907e-04 9.3075e-03 -6.0000e+00 1.9422e-02 -1.4355e-03 4.9257e-04 2.5808e-03 -6.0000e+00 8.2319e-03 1.9236e-03 -5.7213e-04 2.9615e-05 3.2059e-05 -6.0000e+00 6.0882e-04 1.0311e-02 3.1842e-05 11 8 0 10 0 0 97.44 22.95 0.19 0.01031 0.00601 77 15 1 5 0 652.550 25.79 20.00 22.95 27.04 26.5 1016.11 -4077 5124 -12930 -2622 -1137 -6191 3009 -2641 -2104 -8170 2431 -5243 13 4357 -1676 -4026 -2767 3411 468 1167 -1661 2201 -1296 -1069 -1959 2373 -1613 -1963 -422 1225 2656 1423 -1635 -985 3453 -663 -727 1029 223 -1809 -791 -1857 -1285 -90 -4 -971 -343 -255 593 671 642 228 938 1035 921 1039 641 673 768 1490 1631 906 387 -248 -564 824 162 1825 1177 -183 -513 -634 -921 -605 -198 568 1309 1437 669 -3 -381 -1631 -1249 -1291 -1008 -968 -766 -542 -600 -285 365 538 1519 1674 1451 914 858 -417 -869 -609 -549 63 949 306 -974 -409 -781 -148 55 -91 -532 -349 -249 64 660 922 951 545 -270 -890 -580 -240 -81 -74 152 271 1479 1100 472 543 214 435 226 426 -151 -73 -34 -385 -594 -212 -386 -106 -15 -259 318 -939 -164 -66 -386 190 -196 -168 -715 201 -509 1 517 -236 -630 -452 556 82 208 -310 402 -254 -222 -432 514 -356 -419 -87 258 597 354 -441 -266 880 -179 -216 346 87 -789 -366 -898 -633 -44 -2 -482 -169 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