SF: 600.000 MHz, H-1 [col-H]Cl, Eberle, Ballmann, JACS 2024, 146, 7979

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137.215225 136.650223 136.083496 135.518219 134.954208 134.393997 133.828506 133.266678 132.708298 132.143921 131.585724 131.021240 130.462570 129.900345 129.337418 128.773788 128.209030 127.643303 127.076324 126.510880 125.937874 125.369339 124.795853 124.220589 123.643173 123.060661 122.482002 121.897873 121.311340 120.722282 120.133667 119.536240 118.939117 118.342125 117.736221 117.133400 116.524551 115.912605 115.297630 114.679398 114.058159 113.433640 112.805946 112.175056 111.543976 110.903595 110.262985 109.622292 108.972275 108.325157 107.671867 107.012413 106.356018 105.693459 105.028114 104.359619 103.688316 103.014275 102.337418 101.657852 100.975777 100.291183 99.604019 98.914658 98.222977 97.532211 96.833221 96.135406 95.435646 94.734276 94.031204 93.326569 92.620621 91.913292 91.204865 90.492409 89.785011 89.073837 88.358986 87.646622 86.936920 86.220848 85.507698 84.794556 84.078529 83.365761 82.653412 81.941620 81.230507 80.520103 79.807663 79.099319 78.392159 77.683243 76.975868 76.273109 75.571991 74.869713 74.169388 73.474159 72.775063 72.084419 71.393074 70.701279 70.015198 69.331879 68.651466 67.967911 67.290520 66.616302 65.939407 65.268898 64.598793 63.929401 63.269760 62.610825 61.958828 61.307747 60.666721 60.029713 59.393845 58.765137 58.140690 57.523537 56.904678 56.296246 55.692268 55.086674 54.491673 53.901237 53.315369 52.731129 52.154587 51.582684 51.018581 50.453167 49.895512 49.342663 48.794628 48.251419 47.712990 47.182491 46.650787 46.126961 45.611012 45.096920 44.584709 44.083416 43.583912 43.092354 42.599625 42.117771 41.637749 41.162563 40.692177 40.229675 39.768887 39.312927 38.861706 38.418259 37.976486 37.539467 37.107079 36.682430 36.259296 35.840897 35.426975 35.020691 34.615864 34.218597 33.819767 33.431427 33.044430 32.664860 32.283607 31.912716 31.543041 31.180677 30.816483 30.462526 30.109667 29.760899 29.416275 29.075655 28.742086 28.409433 28.080706 27.755959 27.435017 27.117891 26.807598 26.495028 26.189182 25.887012 25.591526 25.296600 25.002266 24.714458 24.430149 24.149298 23.874908 23.597914 23.327248 23.059891 22.795834 22.535000 22.274433 22.020021 21.765697 21.517527 21.272432 21.027414 20.788385 20.552315 20.316135 20.085909 19.855591 19.631100 19.406351 19.187416 18.971220 18.754776 18.540937 18.332779 18.127228 17.921206 17.717821 17.519924 17.324509 17.128498 16.937954 16.749784 16.561043 16.377579 16.193390 16.014492 15.837833 15.660437 15.488197 15.318100 15.150127 14.984246 14.820430 14.655720 14.495980 14.338225 14.182428 14.028560 13.876596 13.723580 13.575381 13.432024 13.287457 13.144667 13.003626 12.861397 12.726842 12.590959 12.456736 12.324145 12.196193 12.063896 11.936122 11.812909 11.688222 11.565033 11.446352 11.323186 11.207439 11.090126 10.974205 10.862690 10.749540 10.640739 10.527356 10.421220 10.313404 10.206850 10.104568 10.000524 9.900714 9.796193 9.698815 9.599608 9.504573 9.410666 9.314915 9.223257 9.126804 9.037364 8.946003 8.858692 8.769427 8.684187 8.599951 8.510814 8.428598 8.344362 8.264084 8.184740 8.103353 8.025872 7.949292 7.867739 7.792974 7.719074 7.643075 7.570895 7.499541 7.426064 7.356369 7.284568 7.213535 7.146250 7.079730 7.011016 6.946025 6.881768 6.815287 6.749600 6.687545 6.626185 6.562586 6.502621 6.443328 6.381752 6.323802 6.266498 6.206941 6.147989 6.092620 6.037860 5.983703 5.927216 5.874271 5.821908 5.770115 5.713085 5.662470 5.612405 5.562883 5.510970 5.462543 5.414640 5.367253 5.317439 5.268213 5.222386 5.177053 5.132203 5.084909 5.041038 4.997633 4.954688 4.912199 4.867242 4.822801 4.781693 4.741016 4.700766 4.658023 4.618638 4.579664 4.541097 4.502930 4.462240 4.422016 4.385073 4.348511 4.312326 4.276512 4.238163 4.203106 4.168410 4.134068 4.100074 4.066428 4.027364 3.994445 3.961859 3.929601 3.897671 3.866061 3.831868 3.800915 3.770271 3.739934 3.709900 3.680165 3.647883 3.615873 3.587059 3.558532 3.530286 3.502318 3.474625 3.447203 3.417173 3.390310 3.363709 3.337368 3.308447 3.282636 3.257076 3.228882 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1.432662 1.423540 1.414491 1.405513 1.396607 1.387772 1.379006 1.370310 1.361682 1.353123 1.344631 1.336206 1.327847 1.316790 1.308579 1.300432 1.292349 1.284328 1.276370 1.265756 1.257938 1.250179 1.242481 1.234842 1.227262 1.219741 1.212277 1.204870 1.197521 1.190227 1.182989 1.173063 1.165952 1.158895 1.151891 1.144940 1.138042 1.131196 1.124402 1.117659 1.110967 1.104324 1.097732 1.088496 1.082018 1.075587 1.069205 1.062871 1.056583 1.050341 1.044147 1.035280 1.029193 1.023150 1.017152 1.011198 1.005288 0.999421 0.993597 0.987816 0.982077 0.976379 0.970723 0.965108 0.959534 0.954000 0.948506 0.943052 0.937638 0.929589 0.924267 0.918983 0.913737 0.905836 0.900681 0.895562 0.890480 0.885433 0.880423 0.875449 0.870509 0.865605 0.860735 0.855900 0.851098 0.846330 0.841596 0.836896 0.832228 0.827592 0.822989 0.818419 0.813880 0.809372 0.804896 0.800451 0.796037 0.788981 0.784642 0.777699 0.773434 0.769199 0.764993 0.760816 0.756667 0.752547 0.748455 0.744390 0.740354 0.736345 0.732363 0.728408 0.724480 0.720578 0.716703 0.712854 0.709031 0.705234 0.701462 0.697716 0.693994 0.690298 0.686626 0.682979 0.679356 0.673122 0.669562 0.666025 0.662511 0.659021 0.655553 0.652109 0.646084 0.642699 0.639335 0.635994 0.632674 0.629377 0.626100 0.622845 0.619612 0.616399 0.613208 0.610037 0.606887 0.603757 0.600647 0.597558 0.594488 0.591438 0.588408 0.585397 0.582406 0.579434 0.576481 0.573547 0.568029 0.565145 0.562280 0.559433 0.556604 0.553793 0.551000 0.548225 0.545467 0.542727 0.540004 0.537298 0.534609 0.529365 0.526723 0.524097 0.521487 0.518893 0.516316 0.513755 0.511210 0.508681 0.506167 0.503669 0.501186 0.498719 0.496267 0.493830 0.491408 0.489001 0.486609 0.484232 0.481869 0.479521 0.477186 0.472295 0.470002 0.467723 0.465458 0.463207 0.460969 0.458745 0.456534 0.454337 0.452153 0.449982 0.447824 0.445680 0.443548 0.441429 0.439322 0.437228 0.435147 0.433078 0.431022 0.428978 0.426946 0.422409 0.420413 0.418428 0.416456 0.414495 0.412545 0.410608 0.408681 0.406766 0.404862 0.402969 0.401088 0.399217 0.397358 0.395509 0.393671 0.391844 0.390027 0.388221 0.386426 0.382124 0.380361 0.378609 0.376866 0.375133 0.373411 0.371698 0.369995 0.368302 0.366619 0.364945 0.363281 0.361627 0.359982 0.358346 0.356720 0.355103 0.353495 0.351896 0.350306 0.348726 0.347154 0.345591 0.344037 0.342492 0.340955 0.339428 0.337908 0.336397 0.334895 0.330934 0.329459 0.327993 0.326534 0.325084 0.323642 0.322208 0.320783 0.319365 0.317954 0.316552 0.315157 0.313771 0.309458 0.304324 0.297962 0.289671 0.278147 0.258336 0.229923 0.182274 H-1 0 0 1 powder static SF: 600.000 MHz, H-1 [col-H]Cl, Eberle, Ballmann, JACS 2024, 146, 7979 10410.000000 9840.000000 1.000000 -0.047142 10410.000000 9840.000000 1.000000 0.000000 1 1 1 1 1 100.000000 no Multi Spin HR: Spin-1/2 -- Spin-S (Relaxation) liquid 2 1 H-1 0.500000 99.987999 1 16.841000 0.000000 0.000000 0.000000 0.000000 0.000000 2 N-14 1.000000 100.000000 0.002600 0 2 1 0.000000 100.000000 0.000000 0.000000 0.000000 1 2 65.699997 0.000000 0.000000 0.000000 0.000000 0.000000 1 100.000000 0.000000 1.000000