download nmr filepath = NMR_spectra/DOH-29Si-Groenen-1985-spec.txt
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Groenen et al. Zeolites, 5, 361-363 (1985) Figure 1b
##freq 1
##col_ ppm Spectrum Model Si3 Si1/Si2 Si4 Si2/Si1
-----
-106.06 -0.13007 0.01009 0.00091 0.00267 0.00136 0.00514
-106.09 -0.15530 0.01015 0.00091 0.00269 0.00137 0.00517
-106.12 -0.17847 0.01021 0.00091 0.00270 0.00137 0.00520
-106.15 -0.22362 0.01027 0.00092 0.00271 0.00138 0.00524
-106.18 -0.27199 0.01033 0.00092 0.00273 0.00139 0.00527
-106.21 -0.31761 0.01039 0.00093 0.00274 0.00140 0.00530
-106.24 -0.35216 0.01045 0.00093 0.00276 0.00141 0.00534
-106.27 -0.37285 0.01051 0.00093 0.00277 0.00142 0.00538
-106.3 -0.38882 0.01058 0.00094 0.00279 0.00142 0.00541
-106.33 -0.39115 0.01064 0.00094 0.00280 0.00143 0.00545
-106.36 -0.39253 0.01070 0.00095 0.00282 0.00144 0.00548
-106.39 -0.37856 0.01077 0.00095 0.00283 0.00145 0.00552
-106.42 -0.36056 0.01083 0.00095 0.00285 0.00146 0.00556
-106.45 -0.33674 0.01090 0.00096 0.00286 0.00147 0.00559
-106.48 -0.31193 0.01096 0.00096 0.00288 0.00147 0.00563
-106.51 -0.25124 0.01103 0.00097 0.00289 0.00148 0.00567
-106.54 -0.19043 0.01110 0.00097 0.00291 0.00149 0.00571
-106.57 -0.16780 0.01117 0.00098 0.00293 0.00150 0.00575
-106.6 -0.13789 0.01124 0.00098 0.00294 0.00151 0.00579
-106.63 -0.10886 0.01131 0.00098 0.00296 0.00152 0.00583
-106.66 -0.08617 0.01138 0.00099 0.00298 0.00153 0.00587
-106.69 -0.06358 0.01145 0.00099 0.00299 0.00154 0.00591
-106.72 -0.06633 0.01152 0.00100 0.00301 0.00155 0.00595
-106.75 -0.07542 0.01159 0.00100 0.00303 0.00156 0.00599
-106.78 -0.07673 0.01166 0.00101 0.00304 0.00157 0.00603
-106.81 -0.07858 0.01174 0.00101 0.00306 0.00158 0.00608
-106.84 -0.09889 0.01181 0.00101 0.00308 0.00159 0.00612
-106.87 -0.11609 0.01189 0.00102 0.00309 0.00160 0.00616
-106.9 -0.11599 0.01196 0.00102 0.00311 0.00161 0.00621
-106.93 -0.11885 0.01204 0.00103 0.00313 0.00162 0.00625
-106.96 -0.13069 0.01212 0.00103 0.00315 0.00163 0.00629
-106.99 -0.13740 0.01219 0.00104 0.00317 0.00164 0.00634
-107.02 -0.13614 0.01227 0.00104 0.00318 0.00165 0.00639
-107.05 -0.13608 0.01235 0.00105 0.00320 0.00166 0.00643
-107.08 -0.13665 0.01243 0.00105 0.00322 0.00167 0.00648
-107.11 -0.12911 0.01251 0.00106 0.00324 0.00168 0.00653
-107.14 -0.12130 0.01260 0.00106 0.00326 0.00169 0.00657
-107.17 -0.10437 0.01268 0.00107 0.00328 0.00170 0.00662
-107.2 -0.08267 0.01276 0.00107 0.00330 0.00171 0.00667
-107.23 -0.06804 0.01285 0.00108 0.00331 0.00172 0.00672
-107.26 -0.06002 0.01293 0.00108 0.00333 0.00173 0.00677
-107.29 -0.05765 0.01302 0.00109 0.00335 0.00174 0.00682
-107.32 -0.05617 0.01311 0.00109 0.00337 0.00176 0.00687
-107.35 -0.05646 0.01319 0.00110 0.00339 0.00177 0.00692
-107.38 -0.05642 0.01328 0.00110 0.00341 0.00178 0.00697
-107.41 -0.05624 0.01337 0.00111 0.00343 0.00179 0.00703
-107.44 -0.05701 0.01346 0.00111 0.00345 0.00180 0.00708
-107.47 -0.05322 0.01355 0.00112 0.00347 0.00181 0.00713
-107.5 -0.04734 0.01365 0.00112 0.00350 0.00183 0.00719
-107.53 -0.04633 0.01374 0.00113 0.00352 0.00184 0.00724
-107.56 -0.04629 0.01384 0.00113 0.00354 0.00185 0.00730
-107.59 -0.04927 0.01393 0.00114 0.00356 0.00186 0.00736
-107.62 -0.05512 0.01403 0.00114 0.00358 0.00188 0.00741
-107.65 -0.05583 0.01412 0.00115 0.00360 0.00189 0.00747
-107.68 -0.06464 0.01422 0.00115 0.00362 0.00190 0.00753
-107.71 -0.08363 0.01432 0.00116 0.00365 0.00191 0.00759
-107.74 -0.11913 0.01442 0.00116 0.00367 0.00193 0.00765
-107.77 -0.14115 0.01453 0.00117 0.00369 0.00194 0.00771
-107.8 -0.15466 0.01463 0.00118 0.00371 0.00195 0.00777
-107.83 -0.17059 0.01473 0.00118 0.00374 0.00197 0.00783
-107.86 -0.17864 0.01484 0.00119 0.00376 0.00198 0.00790
-107.89 -0.18679 0.01494 0.00119 0.00378 0.00199 0.00796
-107.92 -0.18093 0.01505 0.00120 0.00381 0.00201 0.00802
-107.95 -0.17326 0.01516 0.00120 0.00383 0.00202 0.00809
-107.98 -0.15969 0.01527 0.00121 0.00386 0.00204 0.00815
-108.01 -0.14223 0.01538 0.00122 0.00388 0.00205 0.00822
-108.04 -0.12606 0.01549 0.00122 0.00391 0.00206 0.00829
-108.07 -0.11675 0.01561 0.00123 0.00393 0.00208 0.00836
-108.1 -0.11668 0.01572 0.00123 0.00396 0.00209 0.00843
-108.13 -0.10935 0.01584 0.00124 0.00398 0.00211 0.00850
-108.16 -0.10540 0.01596 0.00125 0.00401 0.00212 0.00857
-108.19 -0.11344 0.01608 0.00125 0.00403 0.00214 0.00864
-108.22 -0.11677 0.01620 0.00126 0.00406 0.00215 0.00871
-108.25 -0.11574 0.01632 0.00126 0.00408 0.00217 0.00879
-108.28 -0.11765 0.01644 0.00127 0.00411 0.00219 0.00886
-108.31 -0.10718 0.01657 0.00128 0.00414 0.00220 0.00894
-108.34 -0.08828 0.01669 0.00128 0.00416 0.00222 0.00901
-108.37 -0.07232 0.01682 0.00129 0.00419 0.00223 0.00909
-108.4 -0.06270 0.01695 0.00130 0.00422 0.00225 0.00917
-108.43 -0.05041 0.01708 0.00130 0.00425 0.00227 0.00925
-108.46 -0.03936 0.01721 0.00131 0.00428 0.00228 0.00933
-108.49 -0.02810 0.01735 0.00132 0.00430 0.00230 0.00941
-108.52 -0.01451 0.01748 0.00132 0.00433 0.00232 0.00949
-108.55 0.00002 0.01762 0.00133 0.00436 0.00234 0.00958
-108.58 0.00232 0.01776 0.00134 0.00439 0.00235 0.00966
-108.61 0.00261 0.01790 0.00134 0.00442 0.00237 0.00975
-108.64 0.01511 0.01804 0.00135 0.00445 0.00239 0.00983
-108.67 0.03541 0.01818 0.00136 0.00448 0.00241 0.00992
-108.7 0.07286 0.01833 0.00136 0.00451 0.00243 0.01001
-108.73 0.09759 0.01847 0.00137 0.00454 0.00244 0.01010
-108.76 0.11672 0.01862 0.00138 0.00457 0.00246 0.01019
-108.79 0.13448 0.01877 0.00138 0.00460 0.00248 0.01029
-108.82 0.12555 0.01893 0.00139 0.00464 0.00250 0.01038
-108.85 0.10855 0.01908 0.00140 0.00467 0.00252 0.01048
-108.88 0.04277 0.01924 0.00141 0.00470 0.00254 0.01058
-108.91 -0.01917 0.01940 0.00141 0.00473 0.00256 0.01067
-108.94 -0.06806 0.01956 0.00142 0.00477 0.00258 0.01077
-108.97 -0.11386 0.01972 0.00143 0.00480 0.00260 0.01088
-109. -0.13969 0.01988 0.00144 0.00483 0.00262 0.01098
-109.03 -0.15559 0.02005 0.00144 0.00487 0.00264 0.01108
-109.06 -0.15069 0.02022 0.00145 0.00490 0.00266 0.01119
-109.09 -0.12785 0.02039 0.00146 0.00494 0.00269 0.01129
-109.12 -0.09031 0.02057 0.00147 0.00497 0.00271 0.01140
-109.15 -0.04099 0.02074 0.00147 0.00501 0.00273 0.01151
-109.18 0.00431 0.02092 0.00148 0.00505 0.00275 0.01163
-109.21 0.05127 0.02110 0.00149 0.00508 0.00277 0.01174
-109.24 0.08585 0.02128 0.00150 0.00512 0.00280 0.01185
-109.27 0.09072 0.02147 0.00151 0.00516 0.00282 0.01197
-109.3 0.09292 0.02166 0.00151 0.00519 0.00284 0.01209
-109.33 0.05738 0.02185 0.00152 0.00523 0.00287 0.01221
-109.36 0.01082 0.02204 0.00153 0.00527 0.00289 0.01233
-109.39 -0.05463 0.02223 0.00154 0.00531 0.00291 0.01246
-109.42 -0.10387 0.02243 0.00155 0.00535 0.00294 0.01258
-109.45 -0.12739 0.02263 0.00156 0.00539 0.00296 0.01271
-109.48 -0.15183 0.02284 0.00156 0.00543 0.00299 0.01284
-109.51 -0.15188 0.02304 0.00157 0.00547 0.00301 0.01297
-109.54 -0.14599 0.02325 0.00158 0.00551 0.00304 0.01311
-109.57 -0.12551 0.02347 0.00159 0.00555 0.00307 0.01324
-109.6 -0.10035 0.02368 0.00160 0.00559 0.00309 0.01338
-109.63 -0.07861 0.02390 0.00161 0.00564 0.00312 0.01352
-109.66 -0.05205 0.02412 0.00162 0.00568 0.00315 0.01366
-109.69 -0.03467 0.02435 0.00163 0.00572 0.00317 0.01381
-109.72 -0.01956 0.02458 0.00163 0.00577 0.00320 0.01396
-109.75 -0.00780 0.02481 0.00164 0.00581 0.00323 0.01411
-109.78 0.00182 0.02504 0.00165 0.00586 0.00326 0.01426
-109.81 0.01213 0.02528 0.00166 0.00590 0.00329 0.01441
-109.84 0.01756 0.02552 0.00167 0.00595 0.00332 0.01457
-109.87 0.02288 0.02577 0.00168 0.00600 0.00335 0.01473
-109.9 0.02378 0.02602 0.00169 0.00604 0.00338 0.01489
-109.93 0.02374 0.02627 0.00170 0.00609 0.00341 0.01505
-109.96 0.03704 0.02653 0.00171 0.00614 0.00344 0.01522
-109.99 0.05572 0.02679 0.00172 0.00619 0.00347 0.01539
-110.02 0.07602 0.02705 0.00173 0.00624 0.00350 0.01557
-110.05 0.09222 0.02732 0.00174 0.00629 0.00353 0.01574
-110.08 0.10769 0.02759 0.00175 0.00634 0.00357 0.01592
-110.11 0.11833 0.02787 0.00176 0.00639 0.00360 0.01610
-110.14 0.12610 0.02815 0.00177 0.00644 0.00363 0.01629
-110.17 0.12976 0.02844 0.00178 0.00649 0.00367 0.01648
-110.2 0.12732 0.02873 0.00179 0.00655 0.00370 0.01667
-110.23 0.12440 0.02902 0.00180 0.00660 0.00374 0.01686
-110.26 0.11912 0.02932 0.00181 0.00666 0.00377 0.01706
-110.29 0.10587 0.02962 0.00182 0.00671 0.00381 0.01726
-110.32 0.09219 0.02993 0.00183 0.00677 0.00385 0.01747
-110.35 0.06590 0.03025 0.00185 0.00682 0.00388 0.01768
-110.38 0.04619 0.03057 0.00186 0.00688 0.00392 0.01789
-110.41 0.03242 0.03089 0.00187 0.00694 0.00396 0.01811
-110.44 0.01586 0.03122 0.00188 0.00700 0.00400 0.01833
-110.47 -0.00304 0.03156 0.00189 0.00706 0.00404 0.01856
-110.5 -0.01696 0.03190 0.00190 0.00712 0.00408 0.01879
-110.53 -0.01622 0.03225 0.00191 0.00718 0.00412 0.01902
-110.56 -0.01650 0.03260 0.00193 0.00724 0.00416 0.01926
-110.59 -0.01645 0.03296 0.00194 0.00730 0.00420 0.01950
-110.62 -0.01638 0.03332 0.00195 0.00737 0.00424 0.01975
-110.65 -0.01409 0.03369 0.00196 0.00743 0.00429 0.02000
-110.68 -0.00165 0.03407 0.00197 0.00750 0.00433 0.02026
-110.71 0.01191 0.03446 0.00199 0.00756 0.00437 0.02052
-110.74 0.02261 0.03485 0.00200 0.00763 0.00442 0.02078
-110.77 0.03199 0.03524 0.00201 0.00770 0.00447 0.02106
-110.8 0.04002 0.03565 0.00202 0.00777 0.00451 0.02133
-110.83 0.04613 0.03606 0.00203 0.00784 0.00456 0.02162
-110.86 0.04917 0.03648 0.00205 0.00791 0.00461 0.02190
-110.89 0.04844 0.03691 0.00206 0.00798 0.00466 0.02220
-110.92 0.04425 0.03734 0.00207 0.00805 0.00471 0.02250
-110.95 0.04339 0.03779 0.00209 0.00813 0.00476 0.02280
-110.98 0.02824 0.03824 0.00210 0.00820 0.00481 0.02312
-111.01 0.00774 0.03870 0.00211 0.00828 0.00486 0.02344
-111.04 -0.01236 0.03917 0.00213 0.00835 0.00491 0.02376
-111.07 -0.02755 0.03965 0.00214 0.00843 0.00497 0.02409
-111.1 -0.03518 0.04013 0.00215 0.00851 0.00502 0.02443
-111.13 -0.03115 0.04063 0.00217 0.00859 0.00508 0.02478
-111.16 -0.02019 0.04113 0.00218 0.00867 0.00513 0.02514
-111.19 -0.01725 0.04165 0.00220 0.00875 0.00519 0.02550
-111.22 -0.01413 0.04218 0.00221 0.00884 0.00525 0.02587
-111.25 -0.00646 0.04271 0.00223 0.00892 0.00531 0.02625
-111.28 0.00003 0.04326 0.00224 0.00901 0.00537 0.02663
-111.31 0.00020 0.04382 0.00225 0.00909 0.00543 0.02703
-111.34 -0.00086 0.04439 0.00227 0.00918 0.00549 0.02743
-111.37 -0.01281 0.04497 0.00228 0.00927 0.00555 0.02784
-111.4 -0.02889 0.04556 0.00230 0.00936 0.00562 0.02826
-111.43 -0.05747 0.04616 0.00232 0.00945 0.00568 0.02870
-111.46 -0.08452 0.04678 0.00233 0.00955 0.00575 0.02914
-111.49 -0.09922 0.04741 0.00235 0.00964 0.00582 0.02959
-111.52 -0.10817 0.04806 0.00236 0.00974 0.00589 0.03005
-111.55 -0.09043 0.04871 0.00238 0.00984 0.00596 0.03053
-111.58 -0.06486 0.04939 0.00239 0.00994 0.00603 0.03101
-111.61 -0.03416 0.05007 0.00241 0.01004 0.00610 0.03151
-111.64 0.00148 0.05077 0.00243 0.01014 0.00618 0.03202
-111.67 0.03639 0.05149 0.00244 0.01024 0.00625 0.03254
-111.7 0.07323 0.05223 0.00246 0.01035 0.00633 0.03307
-111.73 0.10386 0.05297 0.00248 0.01046 0.00641 0.03362
-111.76 0.1228 0.05374 0.00249 0.01057 0.00649 0.03418
-111.79 0.13397 0.05452 0.00251 0.01068 0.00657 0.03475
-111.82 0.13121 0.05533 0.00253 0.01079 0.00665 0.03534
-111.85 0.12418 0.05615 0.00255 0.01090 0.00674 0.03594
-111.88 0.08860 0.05699 0.00257 0.01102 0.00682 0.03656
-111.91 0.05458 0.05785 0.00258 0.01114 0.00691 0.03720
-111.94 0.02544 0.05873 0.00260 0.01126 0.00700 0.03785
-111.97 0.00113 0.05963 0.00262 0.01138 0.00709 0.03852
-112. -0.01405 0.06055 0.00264 0.01150 0.00719 0.03921
-112.03 -0.02670 0.06150 0.00266 0.01163 0.00728 0.03992
-112.06 -0.02634 0.06247 0.00268 0.01176 0.00738 0.04064
-112.09 -0.02583 0.06346 0.00270 0.01189 0.00748 0.04139
-112.12 -0.01595 0.06448 0.00272 0.01202 0.00758 0.04215
-112.15 -0.00564 0.06552 0.00273 0.01215 0.00768 0.04294
-112.18 -0.00231 0.06659 0.00275 0.01229 0.00778 0.04375
-112.21 -0.01247 0.06769 0.00277 0.01243 0.00789 0.04458
-112.24 -0.02332 0.06882 0.00280 0.01257 0.00800 0.04544
-112.27 -0.04786 0.06998 0.00282 0.01271 0.00811 0.04632
-112.3 -0.07737 0.07117 0.00284 0.01286 0.00823 0.04723
-112.33 -0.1035 0.07239 0.00286 0.01301 0.00834 0.04816
-112.36 -0.11593 0.07364 0.00288 0.01316 0.00846 0.04913
-112.39 -0.12324 0.07493 0.00290 0.01331 0.00858 0.05012
-112.42 -0.13585 0.07625 0.00292 0.01347 0.00871 0.05114
-112.45 -0.13308 0.07762 0.00294 0.01363 0.00883 0.05219
-112.48 -0.12691 0.07902 0.00297 0.01379 0.00896 0.05328
-112.51 -0.12633 0.08046 0.00299 0.01396 0.00910 0.05440
-112.54 -0.12577 0.08194 0.00301 0.01413 0.00923 0.05555
-112.57 -0.12921 0.08346 0.00303 0.01430 0.00937 0.05675
-112.6 -0.13601 0.08504 0.00306 0.01447 0.00951 0.05798
-112.63 -0.14499 0.08665 0.00308 0.01465 0.00966 0.05925
-112.66 -0.14285 0.08832 0.00311 0.01483 0.00980 0.06057
-112.69 -0.12700 0.09004 0.00313 0.01501 0.00996 0.06192
-112.72 -0.08542 0.09181 0.00315 0.01520 0.01011 0.06333
-112.75 -0.04932 0.09364 0.00318 0.01539 0.01027 0.06478
-112.78 -0.00306 0.09552 0.00320 0.01559 0.01043 0.06628
-112.81 0.03973 0.09747 0.00323 0.01579 0.01060 0.06784
-112.84 0.09981 0.09948 0.00325 0.01599 0.01077 0.06945
-112.87 0.16256 0.10155 0.00328 0.01620 0.01094 0.07112
-112.9 0.22007 0.10370 0.00331 0.01641 0.01112 0.07285
-112.93 0.25996 0.10592 0.00333 0.01662 0.01131 0.07464
-112.96 0.26128 0.10821 0.00336 0.01684 0.01149 0.07650
-112.99 0.26343 0.11058 0.00339 0.01706 0.01169 0.07843
-113.02 0.24949 0.11304 0.00341 0.01729 0.01188 0.08044
-113.05 0.23296 0.11558 0.00344 0.01752 0.01208 0.08252
-113.08 0.21562 0.11822 0.00347 0.01776 0.01229 0.08468
-113.11 0.20534 0.12095 0.00350 0.01800 0.01251 0.08693
-113.14 0.21923 0.12379 0.00353 0.01825 0.01272 0.08927
-113.17 0.2498 0.12673 0.00356 0.01850 0.01295 0.09171
-113.2 0.29073 0.12978 0.00359 0.01876 0.01318 0.09424
-113.23 0.34338 0.13295 0.00362 0.01902 0.01341 0.09689
-113.26 0.38940 0.13624 0.00365 0.01929 0.01366 0.09964
-113.29 0.43668 0.13967 0.00368 0.01956 0.01391 0.10251
-113.32 0.47243 0.14324 0.00371 0.01984 0.01416 0.10551
-113.35 0.49494 0.14695 0.00374 0.02012 0.01443 0.10864
-113.38 0.51470 0.15081 0.00377 0.02041 0.01470 0.11192
-113.41 0.52042 0.15484 0.00380 0.02071 0.01498 0.11534
-113.44 0.52329 0.15905 0.00384 0.02102 0.01526 0.11892
-113.47 0.52270 0.16343 0.00387 0.02133 0.01556 0.12267
-113.5 0.52284 0.16802 0.00390 0.02165 0.01586 0.12659
-113.53 0.52298 0.17281 0.00394 0.02197 0.01617 0.13071
-113.56 0.52229 0.17782 0.00397 0.02231 0.01649 0.13503
-113.59 0.52568 0.18306 0.00400 0.02265 0.01682 0.13957
-113.62 0.53266 0.18855 0.00404 0.02299 0.01717 0.14434
-113.65 0.54085 0.19431 0.00408 0.02335 0.01752 0.14935
-113.68 0.54336 0.20036 0.00411 0.02371 0.01788 0.15464
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