File name: Pandora75s1_EssexMD_20241112_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20241113T112631.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20241112_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20241112 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: OoB-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 20241112T161822.3Z 9082.679425 4 1 51.63 2 57.74 171.05 128.18 45.95 0.00 1 0.00 1 0 25 1.098e-02 7.421e-03 2.418e-04 1.313e-04 2.360720e-01 6.973429e-05 2.886669e-03 -6.000000e+00 6.568182e-03 223.73 -2.00 3.48 -2.00 315.84 0.00e+00 6.402077e-04 7.204845e-06 1.215334e-04 -6.000000e+00 2.909840e-04 281.96 -2.00 20.00 -2.00 315.22 0.00e+00 1.867 0.000 302.00 328.00 3 3.5260e-02 1.7838e-04 2.2013e-02 -6.0000e+00 1.6161e-02 2.8405e-02 1.9829e-04 1.1829e-02 -6.0000e+00 1.7485e-02 -1.1195e-02 1.1462e-04 5.8701e-03 -6.0000e+00 1.0449e-02 -2.9260e-03 5.2967e-05 1.6978e-03 -6.0000e+00 4.4994e-03 6.0172e-02 -8.0317e-04 4.1177e-06 2.3812e-05 -6.0000e+00 3.3752e-04 -3.1525e-02 2.2096e-04 11 8 0 10 0 0 99.93 22.06 0.40 -0.03153 -0.03756 3233 526 1 5 0 15.960 24.86 19.99 22.06 23.10 5.7 979.05 -1092 -319 -700 -1272 -2593 -2523 -2499 -1591 -1274 -2005 -2638 -2826 -2109 -1253 -78 337 607 1062 1723 1759 1727 1494 1651 1512 1248 1170 576 -43 -133 36 383 818 337 -1235 -2813 -3229 -2895 -1981 -753 -727 -559 -332 -153 22 191 290 -27 -215 -370 -15 507 872 898 1085 863 871 798 394 295 472 971 1460 1897 1412 599 -161 -436 -362 538 1029 673 745 590 381 -41 -834 -1377 -1678 -1641 -1494 -1713 -1923 -1940 -1626 -846 -421 147 582 576 455 239 -46 -417 -167 -20 187 597 646 151 -328 -838 -1259 -707 -435 -732 -964 -552 -237 424 794 766 554 284 21 -74 56 296 470 562 362 305 459 535 525 426 147 186 379 298 36 -185 -392 -273 80 51 100 285 198 -95 -232 -591 -970 -241 -70 -161 -308 -579 -529 -535 -368 -323 -499 -669 -731 -589 -392 -27 120 226 409 683 718 718 623 697 666 535 519 257 -19 -58 15 167 351 155 -594 -1324 -1499 -1433 -1039 -432 -483 -385 -240 -114 16 143 216 -20 -154 -259 -11 368 633 688 870 717 698 649 321 237 378 796 1270 1680 1322 563 -143 -382 -309 479 958 652 755 600 374 -40 -775 -1173 -1445 -1388 -1395 -1698 -1997 -2058 -1815 -958 -506 177 719 711 542 276 -51 -450 -174 -22 214 718 814 192 -414 -1045 -1534 -823 -520 -899 -1256 -721 -324 582 1105 1110 809 399 29 -97 73 382 607 773 507 436 650 739 722 557 191 234 480 398 49 -255 -557 -397 116 77 154 452 320 -155 -369 -911 -1512 SS 20241112T162344.6Z 9082.683155 7 1 51.62 2 57.59 172.56 127.44 47.28 0.00 1 0.00 1 0 17 1.123e-02 7.777e-03 2.501e-04 1.382e-04 2.350699e-01 7.328731e-05 2.879059e-03 -6.000000e+00 6.721007e-03 223.73 -2.00 3.48 -2.00 315.79 0.00e+00 6.652492e-04 7.463523e-06 1.272612e-04 -6.000000e+00 2.977665e-04 281.96 -2.00 20.00 -2.00 315.17 0.00e+00 1.859 0.000 302.00 328.00 3 1.6280e-01 1.8719e-04 2.1922e-02 -6.0000e+00 1.6537e-02 2.4827e-02 2.0814e-04 1.1776e-02 -6.0000e+00 1.7892e-02 -1.1275e-02 1.2028e-04 5.8513e-03 -6.0000e+00 1.0692e-02 -2.8992e-03 5.5511e-05 1.6954e-03 -6.0000e+00 4.6039e-03 5.3533e-02 -8.8076e-04 4.3213e-06 2.3648e-05 -6.0000e+00 3.4540e-04 -3.1566e-02 2.0288e-04 11 8 0 10 0 0 98.38 22.55 0.41 -0.03157 -0.03818 2515 409 1 5 0 20.520 25.47 20.01 22.55 23.22 5.7 979.34 -949 -113 -415 -1084 -2432 -2561 -2399 -1470 -1096 -1962 -2728 -2909 -2121 -1219 -77 440 711 1135 1838 1846 1866 1589 1643 1529 1231 1172 585 -95 -242 -16 255 793 328 -1187 -2911 -3393 -3046 -2115 -721 -631 -516 -266 -89 111 204 360 22 -207 -362 -25 496 900 902 1114 927 896 803 392 237 443 957 1472 1972 1532 713 -179 -507 -442 451 1087 737 814 687 429 -31 -909 -1528 -1863 -1825 -1610 -1720 -1930 -1939 -1666 -832 -422 226 673 627 477 245 -113 -533 -301 -135 147 594 689 237 -246 -858 -1312 -830 -500 -754 -955 -578 -215 443 831 841 605 351 12 -120 -5 215 473 586 409 384 486 557 531 431 133 117 297 289 32 -195 -432 -312 52 67 99 296 233 -46 -219 -595 -1040 -201 -26 -100 -253 -569 -564 -539 -357 -267 -512 -727 -790 -622 -400 -26 163 278 458 709 733 755 644 676 656 554 544 274 -43 -102 -7 108 357 158 -597 -1438 -1653 -1477 -1164 -433 -413 -351 -190 -65 82 151 265 16 -146 -251 -18 356 683 685 886 762 752 649 317 200 371 781 1274 1741 1428 667 -159 -442 -376 400 1009 713 824 697 421 -30 -841 -1297 -1595 -1619 -1497 -1700 -2003 -2059 -1863 -944 -489 274 836 778 571 284 -126 -575 -315 -148 168 717 873 303 -312 -1075 -1605 -972 -601 -931 -1203 -761 -284 613 1168 1231 891 498 16 -159 -6 279 615 782 578 534 695 776 736 568 174 148 379 374 44 -271 -619 -441 76 100 155 459 368 -73 -340 -930 -1585 SS 20241112T162855.7Z 9082.686756 10 1 51.61 2 57.48 174.01 126.71 48.53 0.00 1 0.00 1 0 17 1.095e-02 7.578e-03 2.241e-04 1.258e-04 2.354688e-01 6.672111e-05 2.881806e-03 -6.000000e+00 6.552123e-03 223.73 -2.00 3.48 -2.00 315.74 0.00e+00 6.072158e-04 6.736995e-06 1.198372e-04 -6.000000e+00 2.902368e-04 281.96 -2.00 20.00 -2.00 315.13 0.00e+00 1.853 0.000 302.00 328.00 3 -1.0397e-02 1.7046e-04 2.1884e-02 -6.0000e+00 1.6121e-02 2.6130e-02 1.8942e-04 1.1792e-02 -6.0000e+00 1.7441e-02 -1.0931e-02 1.0939e-04 5.8574e-03 -6.0000e+00 1.0422e-02 -2.8770e-03 5.0399e-05 1.6918e-03 -6.0000e+00 4.4893e-03 6.3911e-02 -8.7912e-04 3.9336e-06 2.4013e-05 -6.0000e+00 3.3661e-04 -3.3608e-02 2.0636e-04 11 8 0 10 0 0 98.67 22.89 0.39 -0.03361 -0.04021 2700 440 1 5 0 19.110 25.79 20.00 22.89 23.23 5.6 978.69 -971 -169 -495 -1108 -2465 -2546 -2410 -1589 -1115 -1778 -2576 -2773 -2071 -1189 -29 392 692 1054 1676 1767 1778 1511 1625 1583 1279 1245 673 44 -147 -4 318 873 375 -1137 -2861 -3244 -2963 -2008 -746 -642 -558 -333 -139 37 132 280 -28 -256 -407 -70 474 845 905 1041 869 866 799 397 239 470 925 1458 1931 1475 646 -161 -484 -408 510 1013 717 761 633 423 -45 -848 -1450 -1766 -1728 -1492 -1729 -1912 -1965 -1648 -852 -430 162 612 573 457 250 -77 -453 -202 -72 167 592 653 227 -291 -835 -1299 -777 -462 -714 -961 -568 -226 413 799 807 588 314 42 -88 10 247 470 565 385 346 490 537 519 427 157 166 340 306 40 -206 -404 -296 72 58 104 290 216 -64 -241 -608 -1014 -215 -41 -125 -270 -553 -585 -565 -369 -284 -484 -716 -786 -633 -376 -10 141 262 413 675 733 751 640 698 709 560 563 307 19 -65 -2 141 410 176 -558 -1377 -1538 -1497 -1078 -440 -414 -396 -235 -101 27 97 204 -20 -179 -295 -50 337 635 717 821 709 721 675 336 200 391 788 1254 1778 1371 603 -149 -420 -346 448 936 693 770 642 415 -43 -781 -1285 -1498 -1516 -1375 -1700 -1979 -2086 -1842 -969 -499 196 762 714 550 291 -85 -488 -211 -79 191 715 798 293 -371 -1051 -1532 -910 -554 -884 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