File name: Pandora55s1_QueensNY_20210113_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T174133.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin 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_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210113_L1_smca1c11d20210101p1-8.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: 20210113 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210113T153719.5Z 7683.650921 190 1 1.08 2 65.30 157.72 70.41 152.19 0.00 1 0.00 1 0 25 3.391e-02 9.261e-03 2.582e-02 5.417e-03 3.935075e-01 2.776216e-03 4.755298e-03 -6.000000e+00 1.980891e-02 223.70 -2.00 3.51 -2.00 317.80 0.00e+00 -5.654632e-04 4.628657e-04 3.409287e-04 -6.000000e+00 8.639565e-04 275.47 -2.00 20.00 -2.00 317.21 0.00e+00 2.377 0.000 302.00 328.00 3 2.0842e+00 7.3348e-03 3.0939e-02 -6.0000e+00 4.8835e-02 2.6079e-02 8.2826e-03 1.9883e-02 -6.0000e+00 5.3129e-02 -9.7834e-03 5.2807e-03 9.9628e-03 -6.0000e+00 3.1642e-02 -8.1810e-04 2.6976e-03 2.8648e-03 -6.0000e+00 1.3315e-02 3.6978e-03 -4.7220e-04 1.6354e-04 3.5839e-05 -6.0000e+00 1.0104e-03 -3.1140e-03 -1.2672e-05 12 9 1 12 1 1 999.00 22.81 0.15 -0.00311 -0.00666 2 32 1 5 0 300.930 25.68 20.00 22.81 12.38 27.3 1065.46 -8864 -9120 11052 -9719 -10333 6513 -20156 -4212 -6939 -1692 -11399 1077 -9203 1545 -1573 -2667 -2138 -3647 77 1039 5248 -2979 8771 -3127 1592 -834 3263 645 184 6454 108 3616 -828 -271 1327 2129 344 1128 514 -684 -1724 220 543 -3576 -2408 -1452 -2532 -1055 505 1072 -177 2515 1625 2618 174 897 768 707 -144 1808 2616 399 1558 -733 -418 277 -1157 601 1715 974 271 -345 -909 -366 -768 -40 614 896 999 823 -650 -598 -2406 -2116 -1490 -1692 -1138 -346 -912 530 429 517 1217 745 2352 1610 1580 821 -385 -656 -530 -561 229 1245 120 -831 -1077 -499 -349 364 78 -917 -274 -619 -68 605 516 1072 785 -654 -870 -293 231 -200 -530 -254 814 1293 816 445 677 87 1158 710 173 -657 -41 301 -724 -718 173 -504 -294 71 -539 -631 674 -707 -712 367 -1486 -297 -562 -142 -1080 95 -982 173 -209 -404 -349 -640 14 191 957 -593 1606 -659 343 -194 746 148 41 1341 24 865 -224 -77 375 586 98 353 185 -283 -789 106 269 -1857 -1246 -751 -1314 -542 257 548 -94 1380 947 1588 111 585 514 477 -97 1195 1721 273 1116 -564 -333 220 -899 449 1290 779 233 -312 -841 -336 -684 -34 486 678 753 650 -561 -556 -2399 -2198 -1595 -1883 -1308 -407 -1093 627 496 575 1284 763 2390 1716 1792 1001 -499 -880 -708 -724 280 1472 145 -1042 -1401 -663 -479 515 116 -1410 -426 -953 -101 865 718 1483 1110 -962 -1317 -447 348 -297 -773 -360 1121 1738 1107 629 1002 133 1810 1133 283 -1113 -70 531 -1294 -1285 304 -871 -495 118 SS 20210113T155951.3Z 7683.666566 206 1 50.67 2 63.87 163.31 68.61 157.16 0.00 1 0.00 1 0 25 5.658e-02 8.776e-03 1.032e-02 1.705e-03 3.814335e-01 8.723664e-04 4.546174e-03 -6.000000e+00 3.307863e-02 223.71 -2.00 3.51 -2.00 318.18 0.00e+00 -4.321309e-04 1.620570e-04 1.502020e-04 -6.000000e+00 1.442037e-03 275.47 -2.00 20.00 -2.00 317.59 0.00e+00 2.257 0.000 302.00 328.00 3 4.0912e+00 2.3230e-03 2.9616e-02 -6.0000e+00 8.1550e-02 5.4159e-02 2.6376e-03 1.9217e-02 -6.0000e+00 8.8687e-02 -8.4326e-03 1.7534e-03 9.6464e-03 -6.0000e+00 5.2826e-02 -4.2185e-03 9.0881e-04 2.7843e-03 -6.0000e+00 2.2251e-02 5.5699e-04 3.9940e-04 5.2150e-05 3.4027e-05 -6.0000e+00 1.6856e-03 -3.9660e-03 2.1316e-04 11 9 0 11 8 0 99.99 22.80 0.24 -0.00397 -0.00096 61 12 1 5 0 830.400 25.68 20.01 22.80 12.48 27.3 1065.71 -16926 -4602 35283 -32589 12340 5130 -5314 12895 -1191 -3917 -17726 2307 -16910 936 10610 -434 -11121 8077 6095 7055 4303 285 743 -4605 -864 -2323 7468 -5492 -691 -6490 -242 2563 -567 -4139 -1246 8230 -1565 -660 2624 -127 -1981 -299 -3311 -2377 -1375 1336 -2005 866 992 503 -51 -741 334 1479 2727 829 2835 1351 1603 1507 926 2603 633 -678 71 -1279 856 -60 2064 1243 -129 -397 378 -1112 175 -585 1186 1142 777 33 -273 -169 -1938 -1147 -1693 -390 -1402 -444 -1168 -492 -78 145 760 1203 606 1321 726 182 -474 -1135 -412 -571 149 1020 469 -799 -608 -312 -73 623 191 -400 -100 -279 -120 443 770 970 480 -120 -844 -523 12 143 -56 182 136 1085 988 54 623 173 369 554 546 -175 -56 152 -272 -1269 -155 -56 -224 -14 -909 -250 1417 -2405 569 239 -279 632 -74 -272 -1452 163 -1576 86 1032 -53 -1623 1049 849 1014 654 46 120 -816 -158 -455 1370 -1108 -128 -1245 -45 511 -128 -1023 -303 1791 -379 -176 796 -46 -809 -129 -1522 -1109 -640 610 -939 394 450 231 -24 -377 179 829 1585 503 1740 844 996 923 570 1632 429 -495 54 -980 622 -42 1453 939 -107 -348 337 -993 149 -475 885 805 547 25 -224 -150 -1877 -1161 -1789 -427 -1612 -524 -1407 -588 -91 160 791 1196 605 1377 819 222 -618 -1545 -555 -740 181 1198 561 -1004 -794 -419 -101 894 288 -627 -159 -438 -182 642 1078 1351 685 -178 -1302 -813 18 215 -82 261 189 1461 1339 76 930 270 588 900 910 -302 -100 276 -499 -2348 -282 -100 -386 -25 SS 20210113T160543.8Z 7683.670646 209 1 49.61 2 63.56 164.80 68.20 158.49 0.00 1 0.00 1 0 25 9.472e-02 1.123e-02 1.396e-02 2.276e-03 3.752476e-01 1.164945e-03 4.464760e-03 -6.000000e+00 5.536515e-02 223.71 -2.00 3.51 -2.00 318.07 0.00e+00 -7.332871e-04 2.101451e-04 1.205522e-04 -6.000000e+00 2.413978e-03 275.47 -2.00 20.00 -2.00 317.49 0.00e+00 2.233 0.000 302.00 328.00 3 4.6814e+00 3.0939e-03 2.9204e-02 -6.0000e+00 1.3649e-01 6.1363e-02 3.5102e-03 1.8868e-02 -6.0000e+00 1.4846e-01 -1.1801e-02 2.3053e-03 9.4766e-03 -6.0000e+00 8.8424e-02 -4.6297e-04 1.1892e-03 2.7627e-03 -6.0000e+00 3.7233e-02 3.1787e-04 1.9959e-04 6.9571e-05 3.3395e-05 -6.0000e+00 2.8220e-03 -3.2781e-03 1.5424e-04 12 8 8 10 0 0 99.92 22.80 0.24 -0.00328 -0.00178 24 5 1 5 0 2066.570 25.68 20.00 22.80 12.65 27.2 1066.19 -28464 10391 82087 -35185 2042 12550 -13021 23972 401 -609 -16286 -6863 -23835 -785 18554 -4246 -14117 3027 11860 10743 12031 -1013 291 -5681 -3074 -601 8234 -4385 -3038 -6258 -2263 5193 -3287 -5158 -1801 11886 -2173 -3330 6294 -605 -2431 -456 -3918 -2884 -593 3371 -1108 3041 274 833 -1719 -114 -332 3683 3560 1540 4497 2457 2065 1017 1419 1991 381 -2341 781 -1954 2187 -1304 2624 1150 -1161 -292 779 -1751 -209 -1371 1257 1860 -132 423 -948 392 -1991 -1288 -1421 -492 -1263 -807 -1784 -304 107 2 855 916 -149 1799 -229 -87 -488 -1232 -545 -260 -95 1218 462 -325 -120 -119 54 1092 444 -339 325 -146 -197 42 679 772 124 72 -1077 -587 295 800 -95 192 -43 750 215 83 488 465 329 313 567 -281 328 241 -148 -566 -392 -520 -314 -240 -1843 533 2292 -2861 111 585 -786 1137 27 -44 -1413 -567 -2530 -78 1786 -569 -2240 436 1656 1578 1801 -173 50 -1072 -605 -122 1582 -922 -607 -1257 -451 1057 -792 -1337 -457 2607 -551 -945 1917 -226 -1031 -204 -1872 -1396 -283 1562 -530 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