dihydroxyacetone 20-FETue Mar 08 17:38:24 2005 LINES REQUESTED= 2360 NUMBER OF PARAMETERS= 45 NUMBER OF ITERATIONS= 10 MARQUARDT PARAMETER =0.0000E+000 max (OBS-CALC)/ERROR =1.0000E+001 PARAMETERS - A.PRIORI ERROR 1 1 0 0.0000000000000E+000 1.000000E-030 2 2 11 2.8000000000000E+006 1.000000E-020 3 3 22 4.4000000000000E+006 1.000000E-020 4 4 33 4.5000000000000E+006 1.000000E-020 5 5 44 5.5000000000000E+006 1.000000E-020 6 6 10000 9.8012943195589E+003 5.538710E+020 A0 7 7 20000 2.0515256181812E+003 1.059238E+020 B0 8 8 30000 1.7351648751632E+003 1.152051E+020 C0 9 9 200 -1.8236730488649E-004 2.542571E+020 -D_J0 10 10 1100 -6.5705543748021E-004 3.642399E+020 -D_JK0 11 11 2000 -5.3665748553178E-003 2.051829E+020 -D_K0 12 12 40100 -2.7673957600811E-005 1.093777E+020 -d_1 0 13 13 41000 -5.6926237507469E-004 9.704605E+020 -d_2 0 14 14 10011 9.7644805758916E+003 5.538710E+020 A1 15 15 20011 2.0498467133203E+003 1.059238E+020 B1 16 16 30011 1.7363222733532E+003 1.152051E+020 C1 17 17 211 -1.8329434319100E-004 2.542571E+020 -D_J1 18 18 1111 -8.4860926404991E-004 3.642399E+020 -D_JK1 19 19 2011 -5.4790728118428E-003 2.051829E+020 -D_K1 20 20 40111 -2.7411932282055E-005 1.093777E+020 -d_1 1 21 21 41011 -6.4167019234075E-004 9.704605E+020 -d_2 1 22 22 10022 9.7016776254612E+003 5.538710E+020 A2 23 23 20022 2.0515498567070E+003 1.059238E+020 B2 24 24 30022 1.7379292587000E+003 1.152051E+020 C2 25 25 222 -1.8507082568970E-004 2.542571E+020 -D_J2 26 26 1122 -5.0306946826657E-004 3.642399E+020 -D_JK2 27 27 2022 -3.4761398148931E-003 2.051829E+020 -D_K2 28 28 40122 -2.7558229367096E-005 1.093777E+020 -d_1 2 29 29 41022 -3.5869442839065E-004 9.704605E+020 -d_2 2 30 30 10033 9.6621112025353E+003 5.538710E+020 A3 31 31 20033 2.0500216456360E+003 1.059238E+020 B3 32 32 30033 1.7394192828826E+003 1.152051E+020 C3 33 33 233 -1.8715735550145E-004 2.542571E+020 -D_J3 34 34 1133 -6.0653208054935E-004 3.642399E+020 -D_JK3 35 35 2033 -7.1177045379725E-003 2.051829E+020 -D_K3 36 36 40133 -2.6594883734917E-005 1.093777E+020 -d_1 3 37 37 41033 -3.1731009062316E-004 9.704605E+020 -d_2 3 38 38 10044 1.0328319772696E+004 5.538710E+020 A4 39 39 20044 2.0651842459420E+003 1.059238E+020 B4 40 40 30044 1.7351240474661E+003 1.152051E+020 C4 41 41 244 -1.8237059777054E-004 2.542571E-020 -D_J4 42 42 1144 -6.5704419881386E-004 3.642399E-020 -D_JK4 43 43 2044 -5.3667178615884E-003 2.051829E-020 -D_K4 44 44 40144 -2.7672915086651E-005 1.093777E-020 -d_1 4 45 45 41044 -5.6941169111975E-004 9.704605E-020 -d_2 4 45 parameters read, 45 independent parameters ENERGY SORT OF WANG SUB-BLOCKS PROLATE ROTOR V KMIN KMAX WTPL WTMN ESYMWT NSYM SPINS 0 0 80 1 1 99 1 1 0 80 1 1 99 1 2 0 80 1 1 99 1 3 0 80 1 1 99 1 4 0 80 1 1 99 1 BLOCK - WT - SYM - V - TSP - N - other quanta (rel. to F=0 ) 1 1 x 0 -1 2 1 c 0 -1 3 1 b 0 -1 4 1 a 0 -1 5 1 x 1 -1 6 1 c 1 -1 7 1 b 1 -1 8 1 a 1 -1 9 1 x 2 -1 10 1 c 2 -1 11 1 b 2 -1 12 1 a 2 -1 13 1 x 3 -1 14 1 c 3 -1 15 1 b 3 -1 16 1 a 3 -1 17 1 x 4 -1 18 1 c 4 -1 19 1 b 4 -1 20 1 a 4 -1 Maximum Dimension for Hamiltonian = 41 EXP.FREQ. - CALC.FREQ. - DIFF. - EXP.ERR.- EST.ERR.-AVG. 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20329.75780 20329.77394 -0.01614 0.00400 0.00000 16: 7 2 5 0 7 1 6 0 20592.87210 20592.88226 -0.01016 0.00400 0.00000 17: 7 0 7 0 6 1 6 0 20897.90530 20897.89912 0.00618 0.00400 0.00000 18: 6 2 4 0 6 1 5 0 21132.70610 21132.71737 -0.01127 0.00400 0.00000 19: 4 1 4 0 3 0 3 0 21495.94920 21495.95455 -0.00535 0.00400 0.00000 20: 5 2 3 0 5 1 4 0 21720.51070 21720.52064 -0.00994 0.00400 0.00000 21: 4 2 2 0 4 1 3 0 22301.86130 22301.87089 -0.00959 0.00400 0.00000 22: 3 2 1 0 3 1 2 0 22828.07130 22828.08150 -0.01020 0.00400 0.00000 23: 2 2 0 0 2 1 1 0 23258.69630 23258.70717 -0.01087 0.00400 0.00000 24: 2 2 1 0 2 1 2 0 24198.28610 24198.29160 -0.00550 0.00400 0.00000 25: 5 1 5 0 4 0 4 0 24546.40230 24546.40642 -0.00412 0.00400 0.00000 26: 3 2 2 0 3 1 3 0 24678.65140 24678.65840 -0.00700 0.00400 0.00000 27: 26 13 14 0 27 12 15 0 94930.29470 94930.27400 0.02070 0.08000 0.00000 94930.27400 0.02070 0.2500 28: 26 13 13 0 27 12 16 0 94930.29470 94930.27400 0.02070 0.08000 0.00000 94930.27400 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0 241599.75780 241599.72982 0.02798 0.08000 0.00000 241599.73162 0.02618 0.2500 1761: 62 16 47 0 62 15 48 0 241599.75780 241599.73342 0.02438 0.08000 0.00000 241599.73162 0.02618 0.2500 1762: 20 11 10 0 19 10 9 0 241772.68160 241772.64787 0.03373 0.08000 0.00000 241772.64787 0.03373 0.2500 1763: 20 11 9 0 19 10 9 0 241772.68160 241772.64787 0.03373 0.08000 0.00000 241772.64787 0.03373 0.2500 1764: 20 11 10 0 19 10 10 0 241772.68160 241772.64787 0.03373 0.08000 0.00000 241772.64787 0.03373 0.2500 1765: 20 11 9 0 19 10 10 0 241772.68160 241772.64787 0.03373 0.08000 0.00000 241772.64787 0.03373 0.2500 1766: 61 16 46 0 61 15 47 0 241816.37300 241816.37546 -0.00246 0.08000 0.00000 241816.37436 -0.00136 0.2500 1767: 61 16 45 0 61 15 47 0 241816.37300 241816.37556 -0.00256 0.08000 0.00000 241816.37436 -0.00136 0.2500 1768: 61 16 46 0 61 15 46 0 241816.37300 241816.37315 -0.00015 0.08000 0.00000 241816.37436 -0.00136 0.2500 1769: 61 16 45 0 61 15 46 0 241816.37300 241816.37325 -0.00025 0.08000 0.00000 241816.37436 -0.00136 0.2500 1770: 60 16 44 0 60 15 46 0 242022.17930 242022.14530 0.03400 0.08000 0.00000 242022.14457 0.03473 0.2500 1771: 60 16 45 0 60 15 45 0 242022.17930 242022.14383 0.03547 0.08000 0.00000 242022.14457 0.03473 0.2500 1772: 60 16 44 0 60 15 45 0 242022.17930 242022.14389 0.03541 0.08000 0.00000 242022.14457 0.03473 0.2500 1773: 60 16 45 0 60 15 46 0 242022.17930 242022.14524 0.03406 0.08000 0.00000 242022.14457 0.03473 0.2500 1774: 59 16 43 0 59 15 44 0 242217.51680 242217.46794 0.04886 0.08000 0.00000 242217.46835 0.04845 0.2500 1775: 59 16 44 0 59 15 45 0 242217.51680 242217.46876 0.04804 0.08000 0.00000 242217.46835 0.04845 0.2500 1776: 59 16 43 0 59 15 45 0 242217.51680 242217.46879 0.04801 0.08000 0.00000 242217.46835 0.04845 0.2500 1777: 59 16 44 0 59 15 44 0 242217.51680 242217.46791 0.04889 0.08000 0.00000 242217.46835 0.04845 0.2500 1778: 87 4 83 0 87 3 84 0 242228.79920 242228.79468 0.00452 0.08000 0.00000 242228.80818 -0.00898 0.5000 1779: 87 5 83 0 87 4 84 0 242228.79920 242228.82168 -0.02248 0.08000 0.00000 242228.80818 -0.00898 0.5000 1780: 33 8 25 0 32 7 26 0 242257.23760 242257.27075 -0.03315 0.08000 0.00000 1781: 40 7 34 0 39 6 33 0 242295.61850 242295.60742 0.01108 0.08000 0.00000 1782: 58 16 42 0 58 15 44 0 242402.76590 242402.75671 0.00919 0.08000 0.00000 242402.75644 0.00946 0.2500 1783: 58 16 43 0 58 15 44 0 242402.76590 242402.75669 0.00921 0.08000 0.00000 242402.75644 0.00946 0.2500 1784: 58 16 43 0 58 15 43 0 242402.76590 242402.75618 0.00972 0.08000 0.00000 242402.75644 0.00946 0.2500 1785: 58 16 42 0 58 15 43 0 242402.76590 242402.75620 0.00970 0.08000 0.00000 242402.75644 0.00946 0.2500 1786: 16 12 4 0 15 11 5 0 242440.25230 242440.24985 0.00245 0.08000 0.00000 242440.24985 0.00245 0.2500 1787: 16 12 4 0 15 11 4 0 242440.25230 242440.24985 0.00245 0.08000 0.00000 242440.24985 0.00245 0.2500 1788: 16 12 5 0 15 11 5 0 242440.25230 242440.24985 0.00245 0.08000 0.00000 242440.24985 0.00245 0.2500 1789: 16 12 5 0 15 11 4 0 242440.25230 242440.24985 0.00245 0.08000 0.00000 242440.24985 0.00245 0.2500 1790: 57 16 41 0 57 15 43 0 242578.47110 242578.40525 0.06585 0.08000 0.00000 242578.40509 0.06601 0.2500 1791: 57 16 42 0 57 15 43 0 242578.47110 242578.40524 0.06586 0.08000 0.00000 242578.40509 0.06601 0.2500 1792: 57 16 41 0 57 15 42 0 242578.47110 242578.40495 0.06615 0.08000 0.00000 242578.40509 0.06601 0.2500 1793: 57 16 42 0 57 15 42 0 242578.47110 242578.40494 0.06616 0.08000 0.00000 242578.40509 0.06601 0.2500 1794: 56 16 41 0 56 15 41 0 242744.76010 242744.79671 -0.03661 0.08000 0.00000 242744.79680 -0.03670 0.2500 1795: 56 16 40 0 56 15 41 0 242744.76010 242744.79672 -0.03662 0.08000 0.00000 242744.79680 -0.03670 0.2500 1796: 56 16 40 0 56 15 42 0 242744.76010 242744.79689 -0.03679 0.08000 0.00000 242744.79680 -0.03670 0.2500 1797: 56 16 41 0 56 15 42 0 242744.76010 242744.79689 -0.03679 0.08000 0.00000 242744.79680 -0.03670 0.2500 1798: 67 7 60 0 66 8 59 0 242807.73450 242807.47685 0.25765 0.08000 0.00000 1799: 55 16 40 0 55 15 40 0 242902.38850 242902.30100 0.08750 0.08000 0.00000 242902.30106 0.08744 0.2500 1800: 55 16 39 0 55 15 40 0 242902.38850 242902.30101 0.08749 0.08000 0.00000 242902.30106 0.08744 0.2500 1801: 55 16 39 0 55 15 41 0 242902.38850 242902.30111 0.08739 0.08000 0.00000 242902.30106 0.08744 0.2500 1802: 55 16 40 0 55 15 41 0 242902.38850 242902.30111 0.08739 0.08000 0.00000 242902.30106 0.08744 0.2500 1803: 65 5 60 0 64 6 59 0 242983.25590 242983.34179 -0.08589 0.08000 0.00000 1804: 54 16 39 0 54 15 40 0 243051.29890 243051.27502 0.02388 0.08000 0.00000 243051.27499 0.02391 0.2500 1805: 54 16 38 0 54 15 39 0 243051.29890 243051.27496 0.02394 0.08000 0.00000 243051.27499 0.02391 0.2500 1806: 54 16 39 0 54 15 39 0 243051.29890 243051.27496 0.02394 0.08000 0.00000 243051.27499 0.02391 0.2500 1807: 54 16 38 0 54 15 40 0 243051.29890 243051.27502 0.02388 0.08000 0.00000 243051.27499 0.02391 0.2500 1808: 52 16 36 0 52 15 37 0 243325.17160 243325.00216 0.16944 0.08000 0.00000 243325.00217 0.16943 0.2500 1809: 52 16 37 0 52 15 37 0 243325.17160 243325.00216 0.16944 0.08000 0.00000 243325.00217 0.16943 0.2500 1810: 52 16 36 0 52 15 38 0 243325.17160 243325.00218 0.16942 0.08000 0.00000 243325.00217 0.16943 0.2500 1811: 52 16 37 0 52 15 38 0 243325.17160 243325.00218 0.16942 0.08000 0.00000 243325.00217 0.16943 0.2500 1812: 66 4 62 0 65 5 61 0 243407.79120 243407.92620 -0.13500 0.08000 0.00000 1813: 51 16 36 0 51 15 36 0 243450.40090 243450.41308 -0.01218 0.08000 0.00000 243450.41309 -0.01219 0.2500 1814: 51 16 36 0 51 15 37 0 243450.40090 243450.41309 -0.01219 0.08000 0.00000 243450.41309 -0.01219 0.2500 1815: 51 16 35 0 51 15 36 0 243450.40090 243450.41308 -0.01218 0.08000 0.00000 243450.41309 -0.01219 0.2500 1816: 51 16 35 0 51 15 37 0 243450.40090 243450.41309 -0.01219 0.08000 0.00000 243450.41309 -0.01219 0.2500 1817: 66 5 62 0 65 4 61 0 243457.76150 243457.83729 -0.07579 0.08000 0.00000 1818: 50 16 35 0 50 15 36 0 243568.60700 243568.60999 -0.00299 0.08000 0.00000 243568.60998 -0.00298 0.2500 1819: 50 16 34 0 50 15 35 0 243568.60700 243568.60998 -0.00298 0.08000 0.00000 243568.60998 -0.00298 0.2500 1820: 50 16 34 0 50 15 36 0 243568.60700 243568.60999 -0.00299 0.08000 0.00000 243568.60998 -0.00298 0.2500 1821: 50 16 35 0 50 15 35 0 243568.60700 243568.60998 -0.00298 0.08000 0.00000 243568.60998 -0.00298 0.2500 1822: 67 3 64 0 66 4 63 0 243590.99430 243590.97559 0.01871 0.08000 0.00000 1823: 67 4 64 0 66 3 63 0 243592.99350 243592.90465 0.08885 0.08000 0.00000 1824: 49 16 33 0 49 15 35 0 243679.99280 243679.89638 0.09642 0.08000 0.00000 243679.89638 0.09642 0.2500 1825: 49 16 34 0 49 15 34 0 243679.99280 243679.89638 0.09642 0.08000 0.00000 243679.89638 0.09642 0.2500 1826: 49 16 34 0 49 15 35 0 243679.99280 243679.89638 0.09642 0.08000 0.00000 243679.89638 0.09642 0.2500 1827: 49 16 33 0 49 15 34 0 243679.99280 243679.89638 0.09642 0.08000 0.00000 243679.89638 0.09642 0.2500 1828: 48 16 33 0 48 15 33 0 243784.72760 243784.56641 0.16119 0.08000 0.00000 243784.56641 0.16119 0.2500 1829: 48 16 32 0 48 15 34 0 243784.72760 243784.56641 0.16119 0.08000 0.00000 243784.56641 0.16119 0.2500 1830: 48 16 32 0 48 15 33 0 243784.72760 243784.56641 0.16119 0.08000 0.00000 243784.56641 0.16119 0.2500 1831: 48 16 33 0 48 15 34 0 243784.72760 243784.56641 0.16119 0.08000 0.00000 243784.56641 0.16119 0.2500 1832: 68 3 66 0 67 2 65 0 243816.73270 243816.67648 0.05622 0.08000 0.00000 243816.66643 0.06627 0.5000 1833: 68 2 66 0 67 2 65 0 243816.73270 243816.65637 0.07633 0.08000 0.00000 243816.66643 0.06627 0.5000 1834: 29 9 20 0 28 8 21 0 243826.97290 243826.86337 0.10953 0.08000 0.00000 1835: 65 6 60 0 64 5 59 0 243847.26910 243847.21139 0.05771 0.08000 0.00000 1836: 47 16 31 0 47 15 32 0 243882.94860 243882.90521 0.04339 0.08000 0.00000 243882.90521 0.04339 0.2500 1837: 47 16 32 0 47 15 32 0 243882.94860 243882.90521 0.04339 0.08000 0.00000 243882.90521 0.04339 0.2500 1838: 47 16 32 0 47 15 33 0 243882.94860 243882.90521 0.04339 0.08000 0.00000 243882.90521 0.04339 0.2500 1839: 47 16 31 0 47 15 33 0 243882.94860 243882.90521 0.04339 0.08000 0.00000 243882.90521 0.04339 0.2500 1840: 68 3 66 1 67 3 65 1 243917.24720 243917.29675 -0.04955 0.08000 0.00000 243917.30106 -0.05386 0.2500 1841: 68 3 66 1 67 2 65 1 243917.24720 243917.32641 -0.07921 0.08000 0.00000 243917.30106 -0.05386 0.2500 1842: 68 2 66 1 67 3 65 1 243917.24720 243917.27571 -0.02851 0.08000 0.00000 243917.30106 -0.05386 0.2500 1843: 68 2 66 1 67 2 65 1 243917.24720 243917.30537 -0.05817 0.08000 0.00000 243917.30106 -0.05386 0.2500 1844: 46 16 30 0 46 15 31 0 243975.17290 243975.18928 -0.01638 0.08000 0.00000 243975.18928 -0.01638 0.2500 1845: 46 16 31 0 46 15 32 0 243975.17290 243975.18928 -0.01638 0.08000 0.00000 243975.18928 -0.01638 0.2500 1846: 46 16 30 0 46 15 32 0 243975.17290 243975.18928 -0.01638 0.08000 0.00000 243975.18928 -0.01638 0.2500 1847: 46 16 31 0 46 15 31 0 243975.17290 243975.18928 -0.01638 0.08000 0.00000 243975.18928 -0.01638 0.2500 1848: 45 16 30 0 45 15 31 0 244061.65380 244061.68677 -0.03297 0.08000 0.00000 244061.68677 -0.03297 0.2500 1849: 45 16 29 0 45 15 30 0 244061.65380 244061.68677 -0.03297 0.08000 0.00000 244061.68677 -0.03297 0.2500 1850: 45 16 29 0 45 15 31 0 244061.65380 244061.68677 -0.03297 0.08000 0.00000 244061.68677 -0.03297 0.2500 1851: 45 16 30 0 45 15 30 0 244061.65380 244061.68677 -0.03297 0.08000 0.00000 244061.68677 -0.03297 0.2500 1852: 69 2 68 0 68 2 67 0 244072.99690 244073.05233 -0.05543 0.08000 0.00000 244073.05240 -0.05550 0.2500 1853: 69 1 68 0 68 2 67 0 244072.99690 244073.05204 -0.05514 0.08000 0.00000 244073.05240 -0.05550 0.2500 1854: 69 1 68 0 68 1 67 0 244072.99690 244073.05246 -0.05556 0.08000 0.00000 244073.05240 -0.05550 0.2500 1855: 69 2 68 0 68 1 67 0 244072.99690 244073.05276 -0.05586 0.08000 0.00000 244073.05240 -0.05550 0.2500 1856: 25 10 16 1 24 9 16 1 244091.75150 244091.74571 0.00579 0.10000 0.00000 244091.74526 0.00624 0.2500 1857: 25 10 15 1 24 9 16 1 244091.75150 244091.74575 0.00575 0.10000 0.00000 244091.74526 0.00624 0.2500 1858: 25 10 16 1 24 9 15 1 244091.75150 244091.74478 0.00672 0.10000 0.00000 244091.74526 0.00624 0.2500 1859: 25 10 15 1 24 9 15 1 244091.75150 244091.74482 0.00668 0.10000 0.00000 244091.74526 0.00624 0.2500 1860: 68 3 66 2 67 2 65 2 244101.98550 244102.08349 -0.09799 0.10000 0.00000 244102.06067 -0.07517 0.2500 1861: 68 2 66 2 67 3 65 2 244101.98550 244102.03785 -0.05235 0.10000 0.00000 244102.06067 -0.07517 0.2500 1862: 68 2 66 2 67 2 65 2 244101.98550 244102.06457 -0.07907 0.10000 0.00000 244102.06067 -0.07517 0.2500 1863: 68 3 66 2 67 3 65 2 244101.98550 244102.05678 -0.07128 0.10000 0.00000 244102.06067 -0.07517 0.2500 1864: 44 16 28 0 44 15 30 0 244142.76130 244142.65781 0.10349 0.08000 0.00000 244142.65781 0.10349 0.2500 1865: 44 16 28 0 44 15 29 0 244142.76130 244142.65781 0.10349 0.08000 0.00000 244142.65781 0.10349 0.2500 1866: 44 16 29 0 44 15 30 0 244142.76130 244142.65781 0.10349 0.08000 0.00000 244142.65781 0.10349 0.2500 1867: 44 16 29 0 44 15 29 0 244142.76130 244142.65781 0.10349 0.08000 0.00000 244142.65781 0.10349 0.2500 1868: 69 1 68 1 68 2 67 1 244197.99910 244197.94572 0.05338 0.08000 0.00000 244197.94610 0.05300 0.2500 1869: 69 2 68 1 68 2 67 1 244197.99910 244197.94603 0.05307 0.08000 0.00000 244197.94610 0.05300 0.2500 1870: 69 1 68 1 68 1 67 1 244197.99910 244197.94617 0.05293 0.08000 0.00000 244197.94610 0.05300 0.2500 1871: 69 2 68 1 68 1 67 1 244197.99910 244197.94648 0.05262 0.08000 0.00000 244197.94610 0.05300 0.2500 1872: 42 16 26 0 42 15 28 0 244289.04110 244289.02234 0.01876 0.08000 0.00000 244289.02234 0.01876 0.2500 1873: 42 16 26 0 42 15 27 0 244289.04110 244289.02234 0.01876 0.08000 0.00000 244289.02234 0.01876 0.2500 1874: 42 16 27 0 42 15 28 0 244289.04110 244289.02234 0.01876 0.08000 0.00000 244289.02234 0.01876 0.2500 1875: 42 16 27 0 42 15 27 0 244289.04110 244289.02234 0.01876 0.08000 0.00000 244289.02234 0.01876 0.2500 1876: 70 1 70 0 69 1 69 0 244343.45710 244343.33758 0.11952 0.08000 0.00000 244343.33758 0.11952 0.2500 1877: 70 1 70 0 69 0 69 0 244343.45710 244343.33758 0.11952 0.08000 0.00000 244343.33758 0.11952 0.2500 1878: 70 0 70 0 69 0 69 0 244343.45710 244343.33758 0.11952 0.08000 0.00000 244343.33758 0.11952 0.2500 1879: 70 0 70 0 69 1 69 0 244343.45710 244343.33757 0.11953 0.08000 0.00000 244343.33758 0.11952 0.2500 1880: 41 16 26 0 41 15 26 0 244354.96030 244354.89818 0.06212 0.08000 0.00000 244354.89818 0.06212 0.2500 1881: 41 16 25 0 41 15 26 0 244354.96030 244354.89818 0.06212 0.08000 0.00000 244354.89818 0.06212 0.2500 1882: 41 16 26 0 41 15 27 0 244354.96030 244354.89818 0.06212 0.08000 0.00000 244354.89818 0.06212 0.2500 1883: 41 16 25 0 41 15 27 0 244354.96030 244354.89818 0.06212 0.08000 0.00000 244354.89818 0.06212 0.2500 1884: 69 2 68 2 68 1 67 2 244398.54270 244398.54122 0.00148 0.10000 0.00000 244398.54088 0.00182 0.2500 1885: 69 1 68 2 68 2 67 2 244398.54270 244398.54054 0.00216 0.10000 0.00000 244398.54088 0.00182 0.2500 1886: 69 2 68 2 68 2 67 2 244398.54270 244398.54082 0.00188 0.10000 0.00000 244398.54088 0.00182 0.2500 1887: 69 1 68 2 68 1 67 2 244398.54270 244398.54094 0.00176 0.10000 0.00000 244398.54088 0.00182 0.2500 1888: 40 16 24 0 40 15 25 0 244416.22510 244416.21268 0.01242 0.08000 0.00000 244416.21268 0.01242 0.2500 1889: 40 16 25 0 40 15 25 0 244416.22510 244416.21268 0.01242 0.08000 0.00000 244416.21268 0.01242 0.2500 1890: 40 16 25 0 40 15 26 0 244416.22510 244416.21268 0.01242 0.08000 0.00000 244416.21268 0.01242 0.2500 1891: 40 16 24 0 40 15 26 0 244416.22510 244416.21268 0.01242 0.08000 0.00000 244416.21268 0.01242 0.2500 1892: 70 0 70 1 69 0 69 1 244492.43410 244492.42922 0.00488 0.08000 0.00000 244492.42922 0.00488 0.2500 1893: 70 1 70 1 69 1 69 1 244492.43410 244492.42922 0.00488 0.08000 0.00000 244492.42922 0.00488 0.2500 1894: 70 1 70 1 69 0 69 1 244492.43410 244492.42922 0.00488 0.08000 0.00000 244492.42922 0.00488 0.2500 1895: 70 0 70 1 69 1 69 1 244492.43410 244492.42922 0.00488 0.08000 0.00000 244492.42922 0.00488 0.2500 1896: 38 16 22 0 38 15 24 0 244526.12630 244526.04517 0.08113 0.08000 0.00000 244526.04517 0.08113 0.2500 1897: 38 16 23 0 38 15 24 0 244526.12630 244526.04517 0.08113 0.08000 0.00000 244526.04517 0.08113 0.2500 1898: 38 16 22 0 38 15 23 0 244526.12630 244526.04517 0.08113 0.08000 0.00000 244526.04517 0.08113 0.2500 1899: 38 16 23 0 38 15 23 0 244526.12630 244526.04517 0.08113 0.08000 0.00000 244526.04517 0.08113 0.2500 1900: 37 16 21 0 37 15 23 0 244575.07250 244574.99027 0.08223 0.08000 0.00000 244574.99027 0.08223 0.2500 1901: 37 16 22 0 37 15 23 0 244575.07250 244574.99027 0.08223 0.08000 0.00000 244574.99027 0.08223 0.2500 1902: 37 16 21 0 37 15 22 0 244575.07250 244574.99027 0.08223 0.08000 0.00000 244574.99027 0.08223 0.2500 1903: 37 16 22 0 37 15 22 0 244575.07250 244574.99027 0.08223 0.08000 0.00000 244574.99027 0.08223 0.2500 1904: 36 16 21 0 36 15 21 0 244620.39660 244620.22859 0.16801 0.08000 0.00000 244620.22859 0.16801 0.2500 1905: 36 16 20 0 36 15 22 0 244620.39660 244620.22859 0.16801 0.08000 0.00000 244620.22859 0.16801 0.2500 1906: 36 16 21 0 36 15 22 0 244620.39660 244620.22859 0.16801 0.08000 0.00000 244620.22859 0.16801 0.2500 1907: 36 16 20 0 36 15 21 0 244620.39660 244620.22859 0.16801 0.08000 0.00000 244620.22859 0.16801 0.2500 1908: 35 16 20 0 35 15 20 0 244661.98220 244661.95775 0.02445 0.08000 0.00000 244661.95775 0.02445 0.2500 1909: 35 16 19 0 35 15 20 0 244661.98220 244661.95775 0.02445 0.08000 0.00000 244661.95775 0.02445 0.2500 1910: 35 16 19 0 35 15 21 0 244661.98220 244661.95775 0.02445 0.08000 0.00000 244661.95775 0.02445 0.2500 1911: 35 16 20 0 35 15 21 0 244661.98220 244661.95775 0.02445 0.08000 0.00000 244661.95775 0.02445 0.2500 1912: 70 0 70 2 69 1 69 2 244708.93100 244708.88523 0.04577 0.10000 0.00000 244708.88524 0.04576 0.2500 1913: 70 1 70 2 69 1 69 2 244708.93100 244708.88524 0.04576 0.10000 0.00000 244708.88524 0.04576 0.2500 1914: 70 0 70 2 69 0 69 2 244708.93100 244708.88524 0.04576 0.10000 0.00000 244708.88524 0.04576 0.2500 1915: 70 1 70 2 69 0 69 2 244708.93100 244708.88524 0.04576 0.10000 0.00000 244708.88524 0.04576 0.2500 1916: 33 16 18 0 33 15 18 0 244735.74280 244735.64847 0.09433 0.08000 0.00000 244735.64847 0.09433 0.2500 1917: 33 16 17 0 33 15 18 0 244735.74280 244735.64847 0.09433 0.08000 0.00000 244735.64847 0.09433 0.2500 1918: 33 16 18 0 33 15 19 0 244735.74280 244735.64847 0.09433 0.08000 0.00000 244735.64847 0.09433 0.2500 1919: 33 16 17 0 33 15 19 0 244735.74280 244735.64847 0.09433 0.08000 0.00000 244735.64847 0.09433 0.2500 1920: 32 16 16 0 32 15 18 0 244768.01830 244767.97502 0.04328 0.08000 0.00000 244767.97502 0.04328 0.2500 1921: 32 16 17 0 32 15 18 0 244768.01830 244767.97502 0.04328 0.08000 0.00000 244767.97502 0.04328 0.2500 1922: 32 16 16 0 32 15 17 0 244768.01830 244767.97502 0.04328 0.08000 0.00000 244767.97502 0.04328 0.2500 1923: 32 16 17 0 32 15 17 0 244768.01830 244767.97502 0.04328 0.08000 0.00000 244767.97502 0.04328 0.2500 1924: 21 11 11 1 20 10 10 1 244771.65870 244771.61655 0.04215 0.10000 0.00000 244771.61655 0.04215 0.2500 1925: 21 11 10 1 20 10 11 1 244771.65870 244771.61655 0.04215 0.10000 0.00000 244771.61655 0.04215 0.2500 1926: 21 11 10 1 20 10 10 1 244771.65870 244771.61655 0.04215 0.10000 0.00000 244771.61655 0.04215 0.2500 1927: 21 11 11 1 20 10 11 1 244771.65870 244771.61655 0.04215 0.10000 0.00000 244771.61655 0.04215 0.2500 1928: 31 16 16 0 31 15 16 0 244797.40410 244797.52258 -0.11848 0.08000 0.00000 244797.52258 -0.11848 0.2500 1929: 31 16 16 0 31 15 17 0 244797.40410 244797.52258 -0.11848 0.08000 0.00000 244797.52258 -0.11848 0.2500 1930: 31 16 15 0 31 15 16 0 244797.40410 244797.52258 -0.11848 0.08000 0.00000 244797.52258 -0.11848 0.2500 1931: 31 16 15 0 31 15 17 0 244797.40410 244797.52258 -0.11848 0.08000 0.00000 244797.52258 -0.11848 0.2500 1932: 25 10 15 0 24 9 16 0 244801.87690 244801.87513 0.00177 0.08000 0.00000 244801.87463 0.00227 0.2500 1933: 25 10 15 0 24 9 15 0 244801.87690 244801.87416 0.00274 0.08000 0.00000 244801.87463 0.00227 0.2500 1934: 25 10 16 0 24 9 16 0 244801.87690 244801.87509 0.00181 0.08000 0.00000 244801.87463 0.00227 0.2500 1935: 25 10 16 0 24 9 15 0 244801.87690 244801.87412 0.00278 0.08000 0.00000 244801.87463 0.00227 0.2500 1936: 30 16 15 0 30 15 15 0 244824.51610 244824.45909 0.05701 0.08000 0.00000 244824.45909 0.05701 0.2500 1937: 30 16 14 0 30 15 15 0 244824.51610 244824.45909 0.05701 0.08000 0.00000 244824.45909 0.05701 0.2500 1938: 30 16 15 0 30 15 16 0 244824.51610 244824.45909 0.05701 0.08000 0.00000 244824.45909 0.05701 0.2500 1939: 30 16 14 0 30 15 16 0 244824.51610 244824.45909 0.05701 0.08000 0.00000 244824.45909 0.05701 0.2500 1940: 29 16 13 0 29 15 14 0 244848.96530 244848.94685 0.01845 0.08000 0.00000 244848.94685 0.01845 0.2500 1941: 29 16 14 0 29 15 14 0 244848.96530 244848.94685 0.01845 0.08000 0.00000 244848.94685 0.01845 0.2500 1942: 29 16 13 0 29 15 15 0 244848.96530 244848.94685 0.01845 0.08000 0.00000 244848.94685 0.01845 0.2500 1943: 29 16 14 0 29 15 15 0 244848.96530 244848.94685 0.01845 0.08000 0.00000 244848.94685 0.01845 0.2500 1944: 28 16 13 0 28 15 13 0 244871.18860 244871.14254 0.04606 0.08000 0.00000 244871.14254 0.04606 0.2500 1945: 28 16 12 0 28 15 13 0 244871.18860 244871.14254 0.04606 0.08000 0.00000 244871.14254 0.04606 0.2500 1946: 28 16 12 0 28 15 14 0 244871.18860 244871.14254 0.04606 0.08000 0.00000 244871.14254 0.04606 0.2500 1947: 28 16 13 0 28 15 14 0 244871.18860 244871.14254 0.04606 0.08000 0.00000 244871.14254 0.04606 0.2500 1948: 27 16 12 0 27 15 12 0 244891.17110 244891.19733 -0.02623 0.08000 0.00000 244891.19733 -0.02623 0.2500 1949: 27 16 12 0 27 15 13 0 244891.17110 244891.19733 -0.02623 0.08000 0.00000 244891.19733 -0.02623 0.2500 1950: 27 16 11 0 27 15 13 0 244891.17110 244891.19733 -0.02623 0.08000 0.00000 244891.19733 -0.02623 0.2500 1951: 27 16 11 0 27 15 12 0 244891.17110 244891.19733 -0.02623 0.08000 0.00000 244891.19733 -0.02623 0.2500 1952: 70 1 70 3 69 0 69 3 244900.04280 244900.15131 -0.10851 0.10000 0.00000 244900.15130 -0.10850 0.2500 1953: 70 0 70 3 69 1 69 3 244900.04280 244900.15130 -0.10850 0.10000 0.00000 244900.15130 -0.10850 0.2500 1954: 70 0 70 3 69 0 69 3 244900.04280 244900.15130 -0.10850 0.10000 0.00000 244900.15130 -0.10850 0.2500 1955: 70 1 70 3 69 1 69 3 244900.04280 244900.15130 -0.10850 0.10000 0.00000 244900.15130 -0.10850 0.2500 1956: 24 16 8 0 24 15 10 0 244940.12850 244939.94586 0.18264 0.08000 0.00000 244939.94586 0.18264 0.2500 1957: 24 16 8 0 24 15 9 0 244940.12850 244939.94586 0.18264 0.08000 0.00000 244939.94586 0.18264 0.2500 1958: 24 16 9 0 24 15 10 0 244940.12850 244939.94586 0.18264 0.08000 0.00000 244939.94586 0.18264 0.2500 1959: 24 16 9 0 24 15 9 0 244940.12850 244939.94586 0.18264 0.08000 0.00000 244939.94586 0.18264 0.2500 1960: 17 12 6 1 16 11 5 1 245374.97770 245374.95723 0.02047 0.10000 0.00000 245374.95723 0.02047 0.2500 1961: 17 12 5 1 16 11 6 1 245374.97770 245374.95723 0.02047 0.10000 0.00000 245374.95723 0.02047 0.2500 1962: 17 12 6 1 16 11 6 1 245374.97770 245374.95723 0.02047 0.10000 0.00000 245374.95723 0.02047 0.2500 1963: 17 12 5 1 16 11 5 1 245374.97770 245374.95723 0.02047 0.10000 0.00000 245374.95723 0.02047 0.2500 1964: 21 11 10 0 20 10 10 0 245553.48910 245553.50779 -0.01869 0.08000 0.00000 245553.50779 -0.01869 0.2500 1965: 21 11 11 0 20 10 10 0 245553.48910 245553.50779 -0.01869 0.08000 0.00000 245553.50779 -0.01869 0.2500 1966: 21 11 11 0 20 10 11 0 245553.48910 245553.50779 -0.01869 0.08000 0.00000 245553.50779 -0.01869 0.2500 1967: 21 11 10 0 20 10 11 0 245553.48910 245553.50779 -0.01869 0.08000 0.00000 245553.50779 -0.01869 0.2500 1968: 13 13 1 1 12 12 1 1 245955.30120 245955.12064 0.18056 0.10000 0.00000 245955.12064 0.18056 0.2500 1969: 13 13 0 1 12 12 1 1 245955.30120 245955.12064 0.18056 0.10000 0.00000 245955.12064 0.18056 0.2500 1970: 13 13 0 1 12 12 0 1 245955.30120 245955.12064 0.18056 0.10000 0.00000 245955.12064 0.18056 0.2500 1971: 13 13 1 1 12 12 0 1 245955.30120 245955.12064 0.18056 0.10000 0.00000 245955.12064 0.18056 0.2500 1972: 17 12 6 0 16 11 5 0 246227.78110 246227.58860 0.19250 0.08000 0.00000 246227.58860 0.19250 0.2500 1973: 17 12 5 0 16 11 6 0 246227.78110 246227.58860 0.19250 0.08000 0.00000 246227.58860 0.19250 0.2500 1974: 17 12 6 0 16 11 6 0 246227.78110 246227.58860 0.19250 0.08000 0.00000 246227.58860 0.19250 0.2500 1975: 17 12 5 0 16 11 5 0 246227.78110 246227.58860 0.19250 0.08000 0.00000 246227.58860 0.19250 0.2500 1976: 66 5 61 0 65 6 60 0 246524.80180 246524.73944 0.06236 0.08000 0.00000 1977: 13 13 1 0 12 12 1 0 246878.20380 246878.22429 -0.02049 0.08000 0.00000 246878.22429 -0.02049 0.2500 1978: 13 13 1 0 12 12 0 0 246878.20380 246878.22429 -0.02049 0.08000 0.00000 246878.22429 -0.02049 0.2500 1979: 13 13 0 0 12 12 1 0 246878.20380 246878.22429 -0.02049 0.08000 0.00000 246878.22429 -0.02049 0.2500 1980: 13 13 0 0 12 12 0 0 246878.20380 246878.22429 -0.02049 0.08000 0.00000 246878.22429 -0.02049 0.2500 1981: 68 3 65 0 67 4 64 0 247051.09570 247051.06816 0.02754 0.08000 0.00000 1982: 68 4 65 0 67 3 64 0 247052.44840 247052.46358 -0.01518 0.08000 0.00000 1983: 68 3 65 1 67 4 64 1 247129.64670 247129.62772 0.01898 0.08000 0.00000 1984: 68 4 65 1 67 3 64 1 247131.00390 247131.08322 -0.07932 0.08000 0.00000 1985: 66 6 61 0 65 5 60 0 247184.28320 247184.41538 -0.13218 0.08000 0.00000 1986: 69 2 67 0 68 2 66 0 247278.43960 247278.48459 -0.04499 0.08000 0.00000 247278.48166 -0.04206 0.2500 1987: 69 2 67 0 68 3 66 0 247278.43960 247278.46448 -0.02488 0.08000 0.00000 247278.48166 -0.04206 0.2500 1988: 69 3 67 0 68 2 66 0 247278.43960 247278.49883 -0.05923 0.08000 0.00000 247278.48166 -0.04206 0.2500 1989: 69 3 67 0 68 3 66 0 247278.43960 247278.47872 -0.03912 0.08000 0.00000 247278.48166 -0.04206 0.2500 1990: 69 2 67 1 68 3 66 1 247381.34050 247381.33961 0.00089 0.08000 0.00000 247381.35759 -0.01709 0.2500 1991: 69 2 67 1 68 2 66 1 247381.34050 247381.36065 -0.02015 0.08000 0.00000 247381.35759 -0.01709 0.2500 1992: 69 3 67 1 68 3 66 1 247381.34050 247381.35453 -0.01403 0.08000 0.00000 247381.35759 -0.01709 0.2500 1993: 69 3 67 1 68 2 66 1 247381.34050 247381.37557 -0.03507 0.08000 0.00000 247381.35759 -0.01709 0.2500 1994: 70 1 69 0 69 2 68 0 247535.56360 247535.54171 0.02189 0.08000 0.00000 247535.54196 0.02164 0.2500 1995: 70 2 69 0 69 1 68 0 247535.56360 247535.54221 0.02139 0.08000 0.00000 247535.54196 0.02164 0.2500 1996: 70 2 69 0 69 2 68 0 247535.56360 247535.54192 0.02168 0.08000 0.00000 247535.54196 0.02164 0.2500 1997: 70 1 69 0 69 1 68 0 247535.56360 247535.54201 0.02159 0.08000 0.00000 247535.54196 0.02164 0.2500 1998: 69 2 67 2 68 2 66 2 247569.21360 247569.22754 -0.01394 0.10000 0.00000 247569.22478 -0.01118 0.2500 1999: 69 3 67 2 68 3 66 2 247569.21360 247569.22201 -0.00841 0.10000 0.00000 247569.22478 -0.01118 0.2500 2000: 69 3 67 2 68 2 66 2 247569.21360 247569.24093 -0.02733 0.10000 0.00000 247569.22478 -0.01118 0.2500 2001: 69 2 67 2 68 3 66 2 247569.21360 247569.20862 0.00498 0.10000 0.00000 247569.22478 -0.01118 0.2500 2002: 70 2 69 1 69 1 68 1 247662.70440 247662.66325 0.04115 0.08000 0.00000 247662.66298 0.04142 0.2500 2003: 70 2 69 1 69 2 68 1 247662.70440 247662.66294 0.04146 0.08000 0.00000 247662.66298 0.04142 0.2500 2004: 70 1 69 1 69 1 68 1 247662.70440 247662.66303 0.04137 0.08000 0.00000 247662.66298 0.04142 0.2500 2005: 70 1 69 1 69 2 68 1 247662.70440 247662.66272 0.04168 0.08000 0.00000 247662.66298 0.04142 0.2500 2006: 71 1 71 0 70 1 70 0 247806.03580 247805.97530 0.06050 0.08000 0.00000 247805.97530 0.06050 0.2500 2007: 71 1 71 0 70 0 70 0 247806.03580 247805.97530 0.06050 0.08000 0.00000 247805.97530 0.06050 0.2500 2008: 71 0 71 0 70 1 70 0 247806.03580 247805.97530 0.06050 0.08000 0.00000 247805.97530 0.06050 0.2500 2009: 71 0 71 0 70 0 70 0 247806.03580 247805.97530 0.06050 0.08000 0.00000 247805.97530 0.06050 0.2500 2010: 70 1 69 2 69 1 68 2 247866.29580 247866.36372 -0.06792 0.10000 0.00000 247866.36367 -0.06787 0.2500 2011: 70 2 69 2 69 1 68 2 247866.29580 247866.36391 -0.06811 0.10000 0.00000 247866.36367 -0.06787 0.2500 2012: 70 1 69 2 69 2 68 2 247866.29580 247866.36344 -0.06764 0.10000 0.00000 247866.36367 -0.06787 0.2500 2013: 70 2 69 2 69 2 68 2 247866.29580 247866.36363 -0.06783 0.10000 0.00000 247866.36367 -0.06787 0.2500 2014: 71 1 71 1 70 1 70 1 247957.21930 247957.29428 -0.07498 0.08000 0.00000 247957.29428 -0.07498 0.2500 2015: 71 1 71 1 70 0 70 1 247957.21930 247957.29428 -0.07498 0.08000 0.00000 247957.29428 -0.07498 0.2500 2016: 71 0 71 1 70 1 70 1 247957.21930 247957.29428 -0.07498 0.08000 0.00000 247957.29428 -0.07498 0.2500 2017: 71 0 71 1 70 0 70 1 247957.21930 247957.29428 -0.07498 0.08000 0.00000 247957.29428 -0.07498 0.2500 2018: 70 1 69 3 69 2 68 3 248034.03480 248033.98094 0.05386 0.10000 0.00000 248033.98119 0.05361 0.2500 2019: 70 2 69 3 69 2 68 3 248034.03480 248033.98115 0.05365 0.10000 0.00000 248033.98119 0.05361 0.2500 2020: 70 2 69 3 69 1 68 3 248034.03480 248033.98144 0.05336 0.10000 0.00000 248033.98119 0.05361 0.2500 2021: 70 1 69 3 69 1 68 3 248034.03480 248033.98123 0.05357 0.10000 0.00000 248033.98119 0.05361 0.2500 2022: 71 0 71 2 70 1 70 2 248176.92280 248176.86637 0.05643 0.10000 0.00000 248176.86637 0.05643 0.2500 2023: 71 1 71 2 70 0 70 2 248176.92280 248176.86637 0.05643 0.10000 0.00000 248176.86637 0.05643 0.2500 2024: 71 0 71 2 70 0 70 2 248176.92280 248176.86637 0.05643 0.10000 0.00000 248176.86637 0.05643 0.2500 2025: 71 1 71 2 70 1 70 2 248176.92280 248176.86637 0.05643 0.10000 0.00000 248176.86637 0.05643 0.2500 2026: 71 1 71 3 70 0 70 3 248370.80770 248370.86911 -0.06141 0.10000 0.00000 248370.86911 -0.06141 0.2500 2027: 71 0 71 3 70 0 70 3 248370.80770 248370.86911 -0.06141 0.10000 0.00000 248370.86911 -0.06141 0.2500 2028: 71 1 71 3 70 1 70 3 248370.80770 248370.86911 -0.06141 0.10000 0.00000 248370.86911 -0.06141 0.2500 2029: 71 0 71 3 70 1 70 3 248370.80770 248370.86911 -0.06141 0.10000 0.00000 248370.86911 -0.06141 0.2500 2030: 22 11 12 1 21 10 11 1 248549.87430 248549.81924 0.05506 0.10000 0.00000 248549.81924 0.05506 0.2500 2031: 22 11 11 1 21 10 12 1 248549.87430 248549.81924 0.05506 0.10000 0.00000 248549.81924 0.05506 0.2500 2032: 22 11 11 1 21 10 11 1 248549.87430 248549.81924 0.05506 0.10000 0.00000 248549.81924 0.05506 0.2500 2033: 22 11 12 1 21 10 12 1 248549.87430 248549.81924 0.05506 0.10000 0.00000 248549.81924 0.05506 0.2500 2034: 26 10 16 0 25 9 17 0 248559.58560 248559.50444 0.08116 0.08000 0.00000 248559.50337 0.08223 0.2500 2035: 26 10 17 0 25 9 17 0 248559.58560 248559.50436 0.08124 0.08000 0.00000 248559.50337 0.08223 0.2500 2036: 26 10 17 0 25 9 16 0 248559.58560 248559.50230 0.08330 0.08000 0.00000 248559.50337 0.08223 0.2500 2037: 26 10 16 0 25 9 16 0 248559.58560 248559.50238 0.08322 0.08000 0.00000 248559.50337 0.08223 0.2500 2038: 64 7 58 0 63 6 57 0 248580.02500 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0.18226 0.2500 2360: 33 21 13 0 32 20 13 0 448957.12520 448956.94294 0.18226 0.08000 0.00000 448956.94294 0.18226 0.2500 NORMALIZED DIAGONAL: 1 1.00000E+000 2 1.00000E+000 3 1.00000E+000 4 1.00000E+000 5 1.00000E+000 6 5.87818E-001 7 1.00000E+000 8 2.15994E-001 9 9.81537E-001 10 7.11019E-001 11 9.91773E-001 12 4.37064E-001 13 7.76398E-001 14 4.17171E-001 15 9.89073E-001 16 1.71377E-001 17 1.00000E+000 18 7.35913E-001 19 9.99875E-001 20 2.11835E-001 21 7.76743E-001 22 4.04862E-001 23 9.99472E-001 24 2.35228E-001 25 9.92172E-001 26 1.00000E+000 27 6.05147E-001 28 1.77475E-001 29 5.52719E-001 30 2.97318E-001 31 9.79957E-001 32 1.98545E-001 33 1.00000E+000 34 6.44049E-001 35 9.99935E-001 36 1.98360E-001 37 6.61633E-001 38 1.32180E-002 39 3.44074E-001 40 1.00000E+000 41 1.00000E+000 42 1.00000E+000 43 1.00000E+000 44 1.00000E+000 45 1.00000E+000 MARQUARDT PARAMETER = 0, TRUST EXPANSION = 1.00 NEW PARAMETER (EST. ERROR) -- CHANGE THIS ITERATION 1 0 -0(1000000)E-36 -0E-36 2 11 2800000.0000000( 0) 0.0000000 3 22 4400000.0000000( 0) -0.0000000 4 33 4500000.0000000( 0) 0.0000000 5 44 5500000.0000000( 0) 0.0000000 6 10000 A0 9801.294320(272) -0.000000 7 20000 B0 2051.525618( 76) 0.000000 8 30000 C0 1735.164875( 78) 0.000000 9 200 -D_J0 -0.1823673( 97)E-03 -0.0000000E-03 10 1100 -D_JK0 -0.657055( 89)E-03 0.000000E-03 11 2000 -D_K0 -5.36657( 51)E-03 -0.00000E-03 12 40100 -d_1 0 -0.02767396(184)E-03 0.00000000E-03 13 41000 -d_2 0 -0.569262(166)E-03 -0.000000E-03 14 10011 A1 9764.48058(118) -0.00000 15 20011 B1 2049.846713(287) -0.000000 16 30011 C1 1736.322273(258) -0.000000 17 211 -D_J1 -0.183294( 35)E-03 0.000000E-03 18 1111 -D_JK1 -0.84861( 42)E-03 0.00000E-03 19 2011 -D_K1 -5.4791( 58)E-03 0.0000E-03 20 40111 -d_1 1 -0.0274119(151)E-03 0.0000000E-03 21 41011 -d_2 1 -0.64167(106)E-03 -0.00000E-03 22 10022 A2 9701.67763(185) 0.00000 23 20022 B2 2051.54986( 49) 0.00000 24 30022 C2 1737.92926( 37) -0.00000 25 222 -D_J2 -0.185071( 74)E-03 -0.000000E-03 26 1122 -D_JK2 -0.50307(108)E-03 0.00000E-03 27 2022 -D_K2 -3.4761(112)E-03 -0.0000E-03 28 40122 -d_1 2 -0.027558( 38)E-03 -0.000000E-03 29 41022 -d_2 2 -0.35869(228)E-03 -0.00000E-03 30 10033 A3 9662.11120(278) 0.00000 31 20033 B3 2050.02165( 46) -0.00000 32 30033 C3 1739.41928( 38) -0.00000 33 233 -D_J3 -0.187157( 64)E-03 -0.000000E-03 34 1133 -D_JK3 -0.60653( 81)E-03 -0.00000E-03 35 2033 -D_K3 -7.1177(187)E-03 -0.0000E-03 36 40133 -d_1 3 -0.0265949(300)E-03 -0.0000000E-03 37 41033 -d_2 3 -0.31731(222)E-03 0.00000E-03 38 10044 A4 10328.3(107) -0.0 39 20044 B4 2065.18( 41) 0.00 40 30044 C4 1735.12405( 81) 0.00000 41 244 -D_J4 -0.182370598( 0)E-03 -0.000000000E-03 42 1144 -D_JK4 -0.657044199( 0)E-03 -0.000000000E-03 43 2044 -D_K4 -5.366717862( 0)E-03 -0.000000000E-03 44 40144 -d_1 4 -0.027672915( 0)E-03 0.000000000E-03 45 41044 -d_2 4 -0.569411691( 0)E-03 0.000000000E-03 MICROWAVE AVG = 0.004821 MHz, IR AVG = 0.00000 MICROWAVE RMS 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41 0.000000 45 42 0.000000 45 43 0.000000 45 44 -0.000000 dihydroxyacetone 20-FETue Mar 08 17:38:25 2005