File name: Pandora64s1_NewHavenCT_20240104_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240113T055607.9Z 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_20240104_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: 20240104 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 20240104T165527.9Z 8769.705184 431 1 31.00 2 64.02 179.75 93.20 261.75 0.00 1 0.00 1 0 17 1.788e-02 8.047e-03 9.384e-03 1.821e-03 3.728775e-01 9.576824e-04 4.462766e-03 -6.000000e+00 1.063524e-02 223.36 -2.00 3.52 -2.00 317.98 0.00e+00 7.750563e-04 1.679622e-04 2.272751e-04 -6.000000e+00 4.632400e-04 275.66 -2.00 20.00 -2.00 317.41 0.00e+00 2.269 0.000 302.00 328.00 3 4.2086e+00 2.5327e-03 2.9465e-02 -6.0000e+00 2.6214e-02 5.2624e-02 2.8591e-03 1.8781e-02 -6.0000e+00 2.8460e-02 -9.5843e-03 1.8662e-03 9.4655e-03 -6.0000e+00 1.6939e-02 -2.9508e-03 9.6546e-04 2.8351e-03 -6.0000e+00 7.2225e-03 4.9369e-04 -1.7484e-04 5.5896e-05 3.2776e-05 -6.0000e+00 5.3106e-04 -4.5357e-03 2.3579e-05 12 9 1 12 1 1 99.93 21.54 0.14 -0.00454 -0.00585 26 10 1 5 0 1147.990 26.00 19.99 21.54 12.00 37.0 964.80 -1948 -4450 -3107 -8567 -3242 -7580 -3872 -2946 380 -1241 -5618 -4163 -72 -3776 346 -952 -1294 2449 206 2895 -993 1958 2058 1215 328 1005 -1147 -1430 -2347 -3252 763 -87 1674 392 -5104 -1443 -2151 -1145 233 -255 -1188 -1028 -276 -1248 -590 417 -322 -330 -685 -652 1202 1735 1242 1793 505 918 1422 -59 398 832 826 1196 1572 2303 1139 -1683 -902 -1181 811 1218 752 585 -116 533 -27 -972 -180 -2438 -597 -585 -1012 -1257 -1831 -2096 -471 -410 511 227 1199 497 221 326 -736 -330 863 205 26 1111 941 -518 -417 -1691 -1975 71 392 -1306 -460 -608 -227 344 816 351 289 -261 -43 -263 352 -118 766 627 -175 -104 944 393 831 662 -1443 629 714 172 254 -832 -558 -393 616 36 -394 563 269 -431 -5 -815 -113 -283 -199 -532 -178 -442 -237 -200 27 -95 -458 -373 -7 -464 44 -134 -193 376 34 480 -173 331 367 233 66 209 -239 -283 -458 -672 168 -21 436 103 -1346 -386 -652 -377 90 -113 -533 -481 -132 -606 -286 201 -154 -159 -333 -331 648 998 715 1087 318 591 923 -39 253 532 555 870 1162 1788 873 -1246 -650 -865 645 1017 669 532 -103 448 -22 -727 -134 -1865 -466 -519 -950 -1235 -1913 -2320 -523 -481 618 278 1436 566 245 337 -731 -336 950 240 32 1493 1240 -699 -525 -2089 -2376 89 497 -1748 -617 -859 -328 527 1252 539 446 -379 -60 -362 491 -172 1130 955 -267 -155 1412 562 1137 911 -1970 886 1040 258 401 -1308 -905 -669 1057 63 -717 1032 488 -755 -9 -1390 SS 20240104T170029.1Z 8769.708670 435 1 7.17 2 64.03 181.03 94.12 262.54 0.00 1 0.00 1 0 17 3.329e-02 8.597e-03 1.143e-02 2.575e-03 3.717691e-01 1.353855e-03 4.492661e-03 -6.000000e+00 1.978973e-02 223.36 -2.00 3.52 -2.00 317.75 0.00e+00 7.036703e-04 2.217300e-04 2.051124e-04 -6.000000e+00 8.620806e-04 275.66 -2.00 20.00 -2.00 317.18 0.00e+00 2.270 0.000 302.00 328.00 3 3.4694e+00 3.5658e-03 2.9464e-02 -6.0000e+00 4.8777e-02 4.3412e-02 4.0207e-03 1.8780e-02 -6.0000e+00 5.2961e-02 -1.3830e-02 2.5555e-03 9.4364e-03 -6.0000e+00 3.1521e-02 1.1810e-04 1.3033e-03 2.7827e-03 -6.0000e+00 1.3437e-02 1.0421e-03 -4.3711e-04 7.8595e-05 3.3366e-05 -6.0000e+00 9.8845e-04 -3.3862e-03 8.4509e-06 12 9 1 12 1 1 19.67 21.53 0.18 -0.00339 -0.00667 9 16 1 5 0 716.730 26.00 19.99 21.53 12.15 37.2 965.65 -3440 -996 -2460 -8188 -32748 -1160 -9594 985 -1212 -3928 -4350 -5006 -1375 -668 2145 1485 2933 539 1374 2640 2537 -337 3225 858 431 174 938 -1887 -1174 -2484 2030 -1334 2813 -434 -4625 -2955 -1011 -1453 -354 -191 -22 -958 574 -1171 441 -71 215 569 -656 -882 2067 862 1477 1037 -380 260 773 -206 -6 634 224 1322 1203 2436 78 -1261 -213 -1426 336 2106 523 722 -542 1160 -228 -196 -557 -1806 -522 46 -1567 -813 -2129 -2079 -438 -308 244 377 783 876 -80 740 -759 97 623 466 -15 1423 336 -191 -744 -1641 -2351 19 512 -1550 -485 -796 -186 351 1148 382 -200 215 21 -40 500 -106 836 338 -94 -189 969 163 762 807 -905 230 965 54 529 -544 -717 -480 327 26 -589 568 489 -658 89 -718 -235 -71 -182 -589 -2795 -74 -720 75 -103 -360 -406 -524 -150 -84 305 235 482 97 254 503 488 -67 652 189 100 42 219 -429 -259 -582 504 -343 763 -121 -1279 -845 -319 -544 -145 -89 -10 -473 288 -599 223 -36 108 286 -336 -472 1164 526 893 667 -254 177 532 -141 -4 428 159 952 940 1990 64 -979 -160 -1103 268 1837 465 656 -485 1022 -186 -154 -414 -1363 -430 40 -1477 -839 -2237 -2308 -490 -363 298 444 948 1001 -90 766 -797 99 691 548 -19 1842 451 -248 -950 -2043 -2864 22 655 -2012 -660 -1095 -272 525 1787 598 -302 316 30 -56 706 -150 1253 504 -140 -287 1411 228 1060 1076 -1194 316 1366 82 813 -870 -1144 -803 555 46 -1021 989 872 -1140 153 -1202 SS 20240104T170512.3Z 8769.711948 438 1 19.56 2 64.05 182.24 94.99 263.28 0.00 1 0.00 1 0 25 4.512e-02 8.917e-03 1.046e-02 2.207e-03 3.711388e-01 1.158804e-03 4.467105e-03 -6.000000e+00 2.682267e-02 223.36 -2.00 3.52 -2.00 317.83 0.00e+00 1.087049e-03 1.959063e-04 2.174844e-04 -6.000000e+00 1.168466e-03 275.66 -2.00 20.00 -2.00 317.26 0.00e+00 2.272 0.000 302.00 328.00 3 4.1429e+00 3.0566e-03 2.9449e-02 -6.0000e+00 6.6112e-02 5.3827e-02 3.4442e-03 1.8734e-02 -6.0000e+00 7.1784e-02 -1.5896e-02 2.2134e-03 9.4391e-03 -6.0000e+00 4.2724e-02 3.1118e-04 1.1374e-03 2.8783e-03 -6.0000e+00 1.8212e-02 5.2776e-04 -3.2801e-04 6.7604e-05 3.3646e-05 -6.0000e+00 1.3398e-03 -3.8170e-03 -2.0891e-05 12 9 1 12 9 1 97.80 21.51 0.04 -0.00382 -0.00628 13 8 1 5 0 1396.780 26.00 20.00 21.51 12.21 37.2 966.09 -8868 4488 -695 1254 -47925 -4947 -2537 2626 -393 -685 -10604 -2008 -3860 -3172 253 -789 -1171 2458 2020 3053 1038 1700 2056 3306 -135 893 -933 -2044 -41 -2828 1721 1152 2254 391 -4081 -2650 -1174 -694 767 942 -558 -1183 -413 -1284 575 653 312 -425 -176 -1247 1754 977 1263 973 502 345 1181 -11 446 430 318 1185 1482 1882 1675 -1406 -651 -1212 1075 1432 589 682 -271 549 -10 -1394 -598 -2305 -809 -572 -1469 -1258 -1711 -1954 -498 -671 487 473 1218 332 231 83 -1233 -448 317 510 -257 1172 839 -294 -656 -1444 -1892 392 355 -1675 -243 -359 -221 636 963 382 298 116 -180 -621 492 -167 603 842 11 -277 851 153 754 772 -1067 566 814 328 426 -894 -764 -265 392 25 -404 264 327 -124 -91 -899 -591 280 -46 75 -4377 -319 -174 179 -30 -55 -960 -186 -429 -410 37 -120 -188 407 349 545 190 310 394 664 -29 198 -207 -434 -8 -622 401 293 624 110 -1137 -723 -355 -246 303 423 -259 -579 -207 -651 288 327 155 -214 -89 -663 981 562 769 629 334 225 773 -7 299 291 216 870 1124 1505 1308 -1062 -501 -909 875 1240 545 618 -251 478 -8 -1072 -451 -1774 -649 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