s the temperature increases the minor isotopomers become less ccurate because of missing levels. T 1H1H16O 1H1H17O 1H1H18O 1H2H16O 170625 30215 30445 42016 levels 10 1.328 1.330 1.332 1.399 20 3.349 3.361 3.373 2.945 30 6.192 6.217 6.240 5.085 40 9.417 9.457 9.492 7.617 50 12.962 13.017 13.066 10.476 60 16.819 16.891 16.955 13.628 70 20.980 21.070 21.151 17.047 80 25.432 25.542 25.641 20.715 90 30.161 30.292 30.409 24.615 100 35.153 35.306 35.444 28.735 110 40.396 40.573 40.731 33.064 120 45.879 46.080 46.260 37.592 130 51.593 51.819 52.022 42.312 140 57.528 57.781 58.007 47.217 150 63.677 63.957 64.208 52.299 160 70.034 70.342 70.618 57.553 170 76.591 76.928 77.231 62.974 180 83.343 83.711 84.040 68.557 190 90.286 90.685 91.042 74.299 200 97.414 97.845 98.230 80.195 210 104.724 105.186 105.601 86.241 220 112.210 112.706 113.151 92.436 230 119.870 120.401 120.876 98.776 240 127.701 128.266 128.773 105.258 250 135.699 136.300 136.839 111.882 260 143.862 144.500 145.071 118.644 270 152.187 152.862 153.467 125.544 280 160.673 161.386 162.025 132.579 290 169.317 170.069 170.743 139.751 300 178.119 178.910 179.619 147.057 310 187.076 187.907 188.653 154.496 320 196.187 197.060 197.842 162.070 330 205.452 206.367 207.187 169.776 340 214.869 215.827 216.685 177.616 350 224.439 225.441 226.338 185.590 360 234.161 235.207 236.144 193.698 370 244.035 245.126 246.103 201.940 380 254.060 255.197 256.215 210.318 390 264.237 265.421 266.481 218.831 400 274.565 275.797 276.900 227.480 410 285.046 286.326 287.473 236.267 420 295.680 297.010 298.201 245.192 430 306.466 307.846 309.082 254.256 440 317.406 318.838 320.120 263.461 450 328.502 329.985 331.313 272.808 460 339.752 341.289 342.665 282.299 470 351.158 352.748 354.173 291.933 480 362.722 364.367 365.841 301.714 490 374.443 376.145 377.668 311.643 500 386.323 388.082 389.657 321.720 510 398.364 400.180 401.808 331.947 520 410.567 412.443 414.122 342.327 530 422.931 424.867 426.601 352.860 540 435.461 437.458 439.245 363.550 550 448.155 450.213 452.057 374.396 560 461.015 463.137 465.038 385.401 570 474.044 476.230 478.188 396.568 580 487.242 489.493 491.510 407.897 590 500.611 502.928 505.005 419.391 600 514.150 516.535 518.673 431.051 610 527.865 530.318 532.518 442.881 620 541.754 544.278 546.540 454.880 630 555.822 558.417 560.742 467.053 640 570.068 572.736 575.125 479.401 650 584.494 587.234 589.690 491.925 660 599.102 601.919 604.440 504.628 670 613.895 616.786 619.375 517.510 680 628.872 631.839 634.500 530.578 690 644.036 647.084 649.813 543.831 700 659.390 662.516 665.317 557.272 710 674.935 678.143 681.016 570.904 720 690.673 693.963 696.911 584.728 730 706.607 709.979 713.001 598.749 740 722.736 726.193 729.292 612.965 750 739.064 742.607 745.784 627.381 760 755.593 759.225 762.479 642.001 770 772.324 776.046 779.379 656.823 780 789.260 793.072 796.487 671.857 790 806.406 810.308 813.805 687.094 800 823.758 827.753 831.336 702.551 810 841.322 845.413 849.078 718.217 820 859.098 863.287 867.039 734.104 830 877.093 881.378 885.217 750.210 840 895.300 899.688 903.616 766.541 850 913.732 918.221 922.240 783.091 860 932.388 936.976 941.087 799.877 870 951.266 955.958 960.162 816.890 880 970.369 975.168 979.468 834.141 890 989.703 994.610 999.007 851.624 900 1009.269 1014.285 1018.780 869.349 910 1029.065 1034.189 1038.781 887.314 920 1049.100 1054.339 1059.031 905.525 930 1069.376 1074.727 1079.526 923.988 940 1089.889 1095.362 1100.261 942.700 950 1110.654 1116.241 1121.247 961.662 960 1131.662 1137.367 1142.483 980.887 970 1152.920 1158.745 1163.965 1000.366 980 1174.432 1180.383 1185.710 1020.115 990 1196.193 1202.271 1207.715 1040.111 1000 1218.217 1224.418 1229.976 1060.387 1010 1240.498 1246.828 1252.497 1080.940 1020 1263.045 1269.507 1275.296 1101.767 1030 1285.850 1292.445 1298.356 1122.867 1040 1308.929 1315.657 1321.690 1144.254 1050 1332.275 1339.145 1345.295 1165.926 1060 1355.903 1362.903 1369.178 1187.886 1070 1379.801 1386.942 1393.347 1210.141 1080 1403.978 1411.269 1417.793 1232.690 1090 1428.439 1435.874 1442.531 1255.526 1100 1453.187 1460.763 1467.551 1278.675 1110 1478.221 1485.947 1492.872 1302.125 1120 1503.546 1511.423 1518.480 1325.889 1130 1529.169 1537.194 1544.389 1349.949 1140 1555.082 1563.268 1570.605 1374.333 1150 1581.294 1589.638 1597.122 1399.038 1160 1607.815 1616.321 1623.940 1424.057 1170 1634.640 1643.303 1651.077 1449.405 1180 1661.772 1670.605 1678.520 1475.088 1190 1689.226 1698.220 1706.280 1501.102 1200 1716.983 1726.155 1734.367 1527.434 1210 1745.063 1754.404 1762.769 1554.132 1220 1773.463 1782.975 1791.498 1581.161 1230 1802.195 1811.878 1820.564 1608.542 1240 1831.249 1841.116 1849.954 1636.258 1250 1860.636 1870.684 1879.682 1664.337 1260 1890.359 1900.590 1909.759 1692.774 1270 1920.412 1930.826 1940.169 1721.576 1280 1950.817 1961.419 1970.930 1750.728 1290 1981.564 1992.352 2002.034 1780.258 1300 2012.648 2023.642 2033.500 1810.175 1310 2044.089 2055.256 2065.280 1840.449 1320 2075.855 2087.235 2097.446 1871.111 1330 2108.000 2119.583 2129.974 1902.162 1340 2140.509 2152.304 2162.873 1933.592 1350 2173.386 2185.388 2196.147 1965.422 1360 2206.637 2218.840 2229.783 1997.649 1370 2240.250 2252.672 2263.819 2030.266 1380 2274.240 2286.883 2298.214 2063.235 1390 2308.605 2321.462 2333.001 2096.653 1400 2343.366 2356.450 2368.177 2130.488 1410 2378.509 2391.808 2403.747 2164.714 1420 2414.033 2427.569 2439.703 2199.403 1430 2449.961 2463.714 2476.057 2234.498 1440 2486.266 2500.278 2512.827 2270.016 1450 2522.994 2537.229 2549.997 2305.973 1460 2560.105 2574.589 2587.581 2342.388 1470 2597.654 2612.354 2625.566 2379.223 1480 2635.578 2650.545 2663.967 2416.502 1490 2673.947 2689.168 2702.823 2454.238 1500 2712.708 2728.185 2742.043 2492.437 1510 2751.926 2767.639 2781.737 2531.063 1520 2791.535 2807.522 2821.860 2570.180 1530 2831.586 2847.843 2862.416 2609.750 1540 2872.099 2888.599 2903.406 2649.810 1550 2913.016 2929.804 2944.840 2690.335 1560 2954.377 2971.445 2986.753 2731.326 1570 2996.198 3013.542 3029.076 2772.818 1580 3038.468 3056.077 3071.883 2814.796 1590 3081.186 3099.068 3115.138 2857.285 1600 3124.356 3142.542 3158.857 2900.261 1610 3168.007 3186.464 3203.038 2943.723 1620 3212.103 3230.869 3247.688 2987.708 1630 3256.670 3275.743 3292.846 3032.213 1640 3301.721 3321.082 3338.452 3077.222 1650 3347.244 3366.924 3384.567 3122.748 1660 3393.266 3413.236 3431.162 3168.793 1670 3439.760 3460.039 3478.243 3215.410 1680 3486.730 3507.340 3525.825 3262.518 1690 3534.211 3555.160 3573.917 3310.182 1700 3582.190 3603.449 3622.501 3358.403 1710 3630.679 3652.236 3671.611 3407.138 1720 3679.660 3701.579 3721.225 3456.459 1730 3729.171 3751.423 3771.358 3506.263 1740 3779.179 3801.756 3822.025 3556.689 1750 3829.699 3852.638 3873.195 3607.657 1760 3880.767 3904.019 3924.924 3659.141 1770 3932.354 3955.964 3977.165 3711.240 1780 3984.484 4008.430 4029.942 3763.867 1790 4037.139 4061.417 4083.274 3817.100 1800 4090.336 4114.924 4137.055 3870.918 1810 4143.912 4168.974 4191.463 3925.328 1820 4198.162 4223.628 4246.426 3980.317 1830 4253.000 4278.789 4301.958 4035.916 1840 4308.377 4334.555 4358.094 4092.141 1850 4364.316 4390.856 4414.759 4148.972 1860 4420.876 4447.768 4471.987 4206.407 1870 4477.960 4505.220 4529.779 4264.462 1880 4535.660 4563.284 4588.192 4323.096 1890 4593.925 4621.879 4647.134 4382.389 1900 4652.753 4681.073 4706.742 4442.301 1910 4712.239 4740.857 4766.898 4502.857 1920 4772.264 4801.199 4827.639 4564.104 1930 4832.908 4862.193 4889.005 4625.906 1940 4894.191 4923.783 4950.974 4688.442 1950 4956.031 4985.978 5013.529 4751.609 1960 5018.490 5048.805 5076.763 4815.522 1970 5081.608 5112.215 5140.542 4879.975 1980 5145.312 5176.285 5205.071 4945.164 1990 5209.723 5241.011 5270.164 5010.991 2000 5274.674 5306.295 5335.865 5077.557 2010 5340.332 5372.226 5402.260 5144.834 2020 5406.619 5438.834 5469.246 5212.708 2030 5473.537 5506.062 5536.919 5281.279 2040 5541.102 5573.957 5605.254 5350.549 2050 5609.377 5642.458 5674.170 5420.571 2060 5678.281 5711.615 5743.742 5491.294 2070 5747.886 5781.460 5814.046 5562.669 2080 5818.190 5851.946 5885.013 5634.788 2090 5889.079 5923.096 5956.628 5707.649 2100 5960.713 5994.901 6028.840 5781.163 2110 6033.034 6067.416 6101.839 5855.451 2120 6106.066 6140.620 6175.515 5930.499 2130 6179.826 6214.464 6249.852 6006.257 2140 6254.232 6289.051 6324.908 6082.717 2150 6329.337 6364.307 6400.622 6160.025 2160 6405.211 6440.240 6477.092 6238.042 2170 6481.835 6516.907 6554.250 6316.799 2180 6559.099 6594.299 6632.096 6396.300 2190 6637.161 6672.463 6710.721 6476.555 2200 6715.905 6751.183 6790.058 6557.660 2210 6795.452 6830.791 6870.082 6639.505 2220 6875.753 6911.058 6950.882 6722.118 2230 6956.804 6992.040 7032.386 6805.450 2240 7038.547 7073.747 7114.697 6889.630 2250 7121.150 7156.271 7197.697 6974.597 2260 7204.476 7239.478 7281.458 7060.294 2270 7288.591 7323.418 7365.949 7146.863 2280 7373.468 7408.184 7451.276 7234.205 2290 7459.223 7493.645 7537.266 7322.417 2300 7545.665 7579.896 7624.094 7411.350 2310 7632.952 7666.847 7711.643 7501.178 2320 7721.102 7754.675 7800.031 7591.713 2330 7809.914 7843.201 7889.112 7683.169 2340 7899.633 7932.547 7979.042 7775.421 2350 7990.208 8022.672 8069.720 7868.540 2360 8081.607 8113.562 8161.216 7962.398 2370 8173.808 8205.269 8253.512 8057.166 2380 8266.215 8297.772 8346.637 8152.741 2390 8359.877 8391.041 8440.519 8249.168 2400 8454.461 8485.118 8535.287 8346.552 2410 8549.993 8579.987 8630.813 8444.679 2420 8646.373 8675.759 8727.165 8543.589 2430 8743.600 8772.226 8824.273 8643.492 2440 8841.841 8869.506 8922.209 8744.164 2450 8940.813 8967.731 9021.115 8845.766 2460 9040.884 9066.677 9120.702 8948.291 2470 9141.588 9166.476 9221.201 9051.571 2480 9243.324 9267.267 9322.547 9155.802 2490 9346.069 9368.668 9424.721 9260.970 2500 9449.575 9471.039 9527.775 9366.958 2510 9554.089 9574.320 9631.695 9473.851 2520 9659.548 9678.324 9736.337 9581.619 2530 9765.855 9783.240 9841.914 9690.272 2540 9873.179 9888.968 9948.451 9799.831 2550 9981.407 9995.569 10055.812 9910.373 2560 10090.531 10103.111 10163.988 10021.619 2570 10200.861 10211.455 10273.158 10133.973 2580 10311.933 10320.693 10383.043 10247.180 2590 10423.938 10430.983 10493.873 10361.231 2600 10536.993 10541.867 10605.733 10476.330 2610 10651.176 10653.741 10718.316 10592.255 2620 10766.163 10766.584 10831.874 10709.100 2630 10882.306 10880.225 10946.300 10826.876 2640 10999.394 10994.751 11061.634 10945.635 2650 11117.454 11110.237 11177.870 11065.271 2660 11236.496 11226.596 11294.989 11185.915 2670 11356.658 11343.957 11413.208 11307.475 2680 11477.925 11462.121 11532.051 11429.952 2690 11599.859 11581.222 11652.013 11553.365 2700 11723.160 11701.234 11772.883 11677.931 2710 11847.544 11822.229 11894.672 11803.005 2720 11972.899 11944.035 12017.372 11929.363 2730 12099.412 12066.819 12140.983 12056.567 2740 12226.848 12190.613 12265.614 12184.817 2750 12355.403 12315.219 12391.085 12313.932 2760 12485.052 12440.898 12517.606 12444.098 2770 12615.942 12567.488 12645.018 12575.148 2780 12747.717 12694.834 12773.316 12707.208 2790 12880.531 12823.271 12902.725 12840.227 2800 13014.757 12952.696 13032.974 12974.231 2810 13150.041 13083.197 13164.261 13109.199 2820 13286.431 13214.424 13296.338 13245.038 2830 13423.803 13346.688 13429.540 13381.977 2840 13562.559 13479.925 13563.817 13519.908 2850 13702.386 13614.018 13698.819 13658.959 2860 13843.304 13749.207 13834.945 13798.723 2870 13985.364 13885.345 13972.027 13939.725 2880 14128.693 14022.452 14110.066 14081.520 2890 14273.009 14160.588 14249.158 14224.179 2900 14418.754 14299.671 14389.154 14368.021 2910 14565.700 14439.771 14530.240 14512.854 2920 14713.871 14580.803 14672.193 14658.737 2930 14862.980 14722.790 14815.213 14805.498 2940 15013.481 14865.838 14959.215 14953.436 2950 15165.240 15009.846 15104.219 15102.261 2960 15318.204 15155.002 15250.234 15252.163 2970 15472.358 15300.935 15397.255 15402.950 2980 15627.914 15447.872 15545.305 15554.702 2990 15784.557 15595.990 15694.334 15707.716 3000 15942.584 15744.972 15844.388 15861.500 3010 16101.908 15894.979 15995.535 16016.447 3020 16262.266 16046.031 16147.582 16172.230 3030 16422.793 16198.099 16300.755 16329.125 3040 16584.393 16351.201 16454.941 16486.994 3050 16748.184 16505.420 16610.002 16646.037 3060 16913.389 16660.357 16766.316 16805.967 3070 17080.068 16816.574 16923.553 16967.041 3080 17247.914 16973.760 17081.730 17128.893 3090 17417.406 17131.969 17241.152 17291.941 3100 17588.150 17291.117 17401.518 17455.922 3110 17760.535 17451.502 17562.842 17621.074 3120 17933.854 17612.703 17725.271 17787.082 3130 18108.566 17775.064 17888.732 17954.230 3140 18285.063 17938.387 18053.252 18122.434 3150 18462.584 18102.848 18218.912 18291.428 3160 18641.686 18268.313 18385.414 18461.680 3170 18822.205 18434.684 18553.092 18632.879 3180 19004.260 18602.365 18721.809 18804.979 3190 19187.371 18770.896 18891.605 18978.291 3200 19372.217 18940.537 19062.590 19152.609 3210 19558.295 19111.373 19234.412 19328.000 3220 19745.783 19283.037 19407.459 19504.371 3230 19935.133 19455.775 19581.330 19681.715 3240 20125.654 19629.738 19756.381 19860.293 3250 20317.914 19804.654 19932.438 20039.668 3260 20511.063 19980.566 20109.875 20220.318 3270 20705.865 20157.633 20288.143 20401.656 3280 20902.436 20335.725 20467.430 20584.287 3290 21100.262 20514.922 20647.941 20767.840 3300 21299.604 20695.176 20829.361 20952.402 3310 21500.195 20876.361 21011.902 21138.170 3320 21702.510 21058.727 21195.568 21324.842 3330 21906.156 21242.121 21380.459 21512.553 3340 22111.125 21426.715 21566.139 21701.125 3350 22318.297 21612.225 21753.156 21891.152 3360 22526.240 21798.832 21940.979 22081.957 3370 22735.988 21986.521 22129.977 22273.857 3380 22947.555 22175.279 22320.234 22466.783 3390 23159.975 22365.186 22511.482 22660.588 3400 23374.201 22556.146 22703.766 22855.887 3410 23590.012 22748.125 22897.152 23051.705 3420 23807.584 22941.250 23091.582 23248.842 3430 24026.318 23135.619 23287.256 23446.961 3440 24247.084 23330.531 23483.842 23646.027 3450 24468.982 23526.883 23681.529 23846.037 3460 24693.059 23724.361 23880.383 24047.223 3470 24918.152 23922.977 24080.447 24249.465 3480 25145.186 24122.408 24281.285 24452.836 3490 25373.695 24323.176 24483.545 24657.148 3500 25604.094 24524.719 24686.650 24862.219 3510 25836.248 24727.639 24890.908 25068.756 3520 26069.682 24931.635 25096.332 25276.076 3530 26305.021 25136.648 25302.932 25484.668 3540 26541.701 25342.787 25510.498 25694.057 3550 26780.359 25549.842 25719.096 25904.391 3560 27021.010 25758.223 25928.887 26116.025 3570 27263.098 25967.689 26139.783 26328.551 3580 27506.986 26177.965 26351.766 26542.098 3590 27752.490 26389.629 26564.734 26756.736 3600 27999.580 26602.193 26778.926 26972.398 3610 28248.992 26815.838 26994.268 27188.811 3620 28498.980 27030.846 27210.547 27406.676 3630 28751.801 27246.686 27428.057 27625.176 3640 29005.744 27463.664 27646.699 27845.166 3650 29261.797 27681.705 27866.348 28065.762 3660 29519.611 27900.928 28087.025 28287.336 3670 29778.768 28121.309 28308.971 28510.199 3680 30040.301 28342.459 28532.012 28733.871 3690 30302.908 28565.016 28756.162 28958.660 3700 30567.371 28788.549 28981.244 29184.563 3710 30834.252 29013.145 29207.471 29411.445 3720 31102.369 29238.916 29434.934 29639.438 3730 31372.684 29465.689 29663.369 29868.281 3740 31644.158 29693.646 29892.908 30098.025 3750 31917.787 29922.529 30123.398 30328.832 3760 32193.127 30152.740 30355.287 30560.967 3770 32470.443 30384.043 30588.158 30793.691 3780 32749.523 30616.115 30822.223 31027.643 3790 33031.852 30849.537 31057.219 31262.449 3800 33315.066 31083.916 31293.434 31498.393 3810 33600.109 31319.520 31530.697 31735.107 3820 33886.617 31556.170 31769.035 31973.252 3830 34175.648 31793.832 32008.449 32211.955 3840 34465.813 32032.656 32249.084 32452.158 3850 34758.531 32272.551 32490.494 32693.008 3860 35053.031 32513.434 32733.406 32934.836 3870 35349.250 32755.627 32977.344 33177.898 3880 35647.629 32998.742 33222.070 33421.738 3890 35947.430 33242.953 33468.160 33666.516 3900 36249.691 33488.316 33715.566 33912.453 3910 36553.621 33734.680 33963.684 34159.363 3920 36859.090 33982.047 34213.141 34407.250 3930 37167.367 34230.684 34463.395 34656.004 3940 37477.363 34480.637 34715.063 34905.914 3950 37788.637 34731.055 34967.336 35156.531 3960 38102.059 34982.891 35221.270 35408.297 3970 38417.766 35235.672 35475.949 35661.105 3980 38735.324 35489.883 35731.746 35915.148 3990 39055.141 35744.941 35988.750 36169.660 4000 39376.418 36001.141 36246.770 36425.223 4010 39699.734 36258.270 36505.746 36681.848 4020 40025.941 36516.652 36766.098 36939.285 4030 40353.012 36775.879 37027.500 37198.031 4040 40682.551 37036.301 37289.656 37457.391 4050 41013.875 37297.793 37553.168 37718.113 4060 41347.516 37560.469 37817.621 37979.496 4070 41683.504 37823.965 38083.523 38241.668 4080 42020.895 38088.793 38349.879 38505.480 4090 42361.137 38354.605 38617.762 38769.680 4100 42703.605 38621.516 38886.555 39035.043 4110 43047.629 38889.332 39156.465 39301.078 4120 43393.672 39158.164 39427.313 39568.570 4130 43742.332 39428.477 39699.629 39836.477 4140 44092.766 39699.789 39972.801 40105.469 4150 44445.348 39971.555 40246.973 40375.547 4160 44801.035 40245.035 40522.184 40646.578 4170 45157.574 40519.367 40798.582 40918.484 4180 45517.000 40794.820 41075.910 41191.289 4190 45878.277 41070.961 41354.496 41465.082 4200 46241.855 41348.320 41633.816 41739.719 4210 46607.902 41626.973 41914.445 42015.680 4220 46976.043 41906.336 42196.148 42291.922 4230 47345.789 42187.012 42478.957 42569.391 4240 47718.352 42468.633 42762.828 42848.051 4250 48093.301 42751.785 43047.457 43127.094 4260 48469.898 43035.492 43333.438 43407.277 4270 48849.422 43320.008 43620.508 43688.355 4280 49229.738 43605.887 43908.559 43970.684 4290 49613.633 43892.934 44197.617 44253.621 4300 49999.375 44181.102 44487.563 44537.551 4310 50388.371 44470.000 44778.645 44822.074 4320 50777.953 44759.914 45070.941 45108.113 4330 51170.703 45050.738 45364.207 45394.480 4340 51565.117 45342.852 45658.520 45682.023 4350 51962.012 45636.145 45953.598 45970.410 4360 52361.359 45930.297 46249.996 46260.047 4370 52762.871 46225.598 46547.398 46550.113 4380 53166.910 46521.383 46845.957 46840.859 4390 53572.410 46818.512 47145.469 47132.844 4400 53981.137 47117.109 47446.051 47425.957 4410 54392.156 47416.246 47747.480 47719.258 4420 54805.473 47716.543 48049.984 48014.156 4430 55220.582 48017.898 48353.664 48309.527 4440 55638.254 48320.375 48658.246 48605.797 4450 56058.043 48623.621 48963.922 48903.086 4460 56480.125 48927.922 49270.359 49201.121 4470 56904.875 49233.375 49578.512 49500.074 4480 57332.676 49539.840 49886.855 49799.879 4490 57761.457 49846.938 50196.664 50100.898 4500 58193.953 50155.457 50507.238 50402.273 4510 58627.504 50464.703 50819.105 50704.652 4520 59063.934 50775.156 51132.066 51008.203 4530 59502.664 51086.477 51445.668 51312.129 4540 59944.020 51398.762 51760.262 51617.328 4550 60387.672 51712.465 52076.285 51922.941 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