##TITLE=              31P MAS NMR spectrum of dehydrated PST-14 (calcined from PST-13)
##JCAMP-DX=           5.01
##DATA TYPE=          NMR SPECTRUM
##DATA CLASS=         XYDATA
##ORIGIN=             Seo et al. Angew. Chem. Int. Ed., 57, 3727-3732 (2018) Figure S3d
##OWNER=              Digitized and processed by Brouwer Lab, Redeemer University
##LONG DATE=          2020/07/22 10:04:18
##SOURCE REFERENCE=   POR-31P-Seo-2018-calcined
##DATA PROCESSING=    Spectrum digitized with WebPlotDigitizer and deconvoluted with Mathematica notebook

$$Sample information 
##NAMES=              POR
##NAMES=              PST-14
##SAMPLE DESCRIPTION= PST-14, calcined, dehydrated

$$Bibliographic information 
##$AUTHORS=           Seo, S., Yang, T., Shin, J., Jo, D., Zou, X., Hong, S.B.
##$TITLE=             Two Aluminophosphate Molecular Sieves Built from Pairs of Enantiomeric Structural Building Units
##$JOURNAL=           Angewandte Chemie International Edition
##$VOLUME=            57
##$PAGES=             3727-3732
##$YEAR=              2018
##$DOI=               10.1002/anie.201800791
##$FIGURE=            Figure S3d

$$Peak information    (Positions in ppm, Relative peak areas, Peak widths in ppm, Lorentzian/Gaussian shape parameter)
##$NUM PEAKS=         4
##$PEAK LABELS=        A          B          C          D         
##$PEAK TSITES=       
##$PEAK POSITIONS=    -30.2548   -30.1048   -27.6968   -25.7042   
##$PEAK AREAS=         1.         1.         1.         1.        
##$PEAK WIDTHS=        1.68342    1.68342    2.04482    1.95986   
##$PEAK SHAPES=        0.96472    0.96472    0          0         
##$NUMBERING REF=     Seo et al. Angew. Chem. Int. Ed., 57, 3727-3732 (2018)
##$ASSIGN REF=        
##$ASSIGN METHOD=     
##$COMMENT=           Peak assignments are not available

$$Spectrum acquisition information 
##.OBSERVE NUCLEUS=   ^31P
##.OBSERVE FREQUENCY= 202.493
##.PULSE SEQUENCE=    single pulse
##.MAS FREQUENCY=     22000

$$Spectrum data information 
##XUNITS=             PPM
##YUNITS=             ARBITRARY UNITS
##FIRSTX=             -0.1                  
##LASTX=              -50.                  
##XFACTOR=            1
##YFACTOR=            1
##NPOINTS=            500
##FIRSTY=              0.00086              

$$Spectrum data
##XYDATA=             (X++(Y..Y))
 -0.1                 0.00086              
 -0.2                 0.00082              
 -0.3                 0.00033              
 -0.4                -0.00090              
 -0.5                -0.00143              
 -0.6                -0.00027              
 -0.7                 0.00051              
 -0.8                 0.00086              
 -0.9                 0.00085              
 -1.                  0.00084              
 -1.1                 0.00085              
 -1.2                 0.00075              
 -1.3                -0.00026              
 -1.4                -0.00189              
 -1.5                -0.00186              
 -1.6                -0.00009              
 -1.7                 0.00268              
 -1.8                 0.00627              
 -1.9                 0.00697              
 -2.                  0.00405              
 -2.1                 0.00127              
 -2.2                 0.00084              
 -2.3                 0.00085              
 -2.4                 0.00085              
 -2.5                 0.00085              
 -2.6                 0.00085              
 -2.7                 0.00085              
 -2.8                 0.00085              
 -2.9                 0.00085              
 -3.                  0.00084              
 -3.1                 0.00087              
 -3.2                 0.00079              
 -3.3                -0.00042              
 -3.4                -0.00144              
 -3.5                -0.00084              
 -3.6                 0.00037              
 -3.7                 0.00085              
 -3.8                 0.00084              
 -3.9                 0.00085              
 -4.                  0.00085              
 -4.1                 0.00085              
 -4.2                 0.00085              
 -4.3                 0.00084              
 -4.4                 0.00007              
 -4.5                -0.00155              
 -4.6                -0.00178              
 -4.7                -0.00003              
 -4.8                 0.00090              
 -4.9                 0.00083              
 -5.                  0.00085              
 -5.1                 0.00085              
 -5.2                 0.00085              
 -5.3                 0.00085              
 -5.4                 0.00085              
 -5.5                 0.00085              
 -5.6                 0.00083              
 -5.7                 0.00040              
 -5.8                -0.00120              
 -5.9                -0.00208              
 -6.                 -0.00004              
 -6.1                 0.00084              
 -6.2                -0.00009              
 -6.3                -0.00181              
 -6.4                -0.00271              
 -6.5                -0.00138              
 -6.6                 0.00017              
 -6.7                 0.00086              
 -6.8                 0.00085              
 -6.9                 0.00087              
 -7.                  0.00148              
 -7.1                 0.00409              
 -7.2                 0.00684              
 -7.3                 0.00797              
 -7.4                 0.00796              
 -7.5                 0.00795              
 -7.6                 0.00657              
 -7.7                 0.00352              
 -7.8                 0.00078              
 -7.9                -0.00062              
 -8.                 -0.00226              
 -8.1                -0.00273              
 -8.2                -0.00268              
 -8.3                -0.00221              
 -8.4                -0.00098              
 -8.5                 0.00036              
 -8.6                 0.00085              
 -8.7                 0.00084              
 -8.8                 0.00085              
 -8.9                 0.00085              
 -9.                  0.00085              
 -9.1                 0.00083              
 -9.2                 0.00102              
 -9.3                 0.00300              
 -9.4                 0.00628              
 -9.5                 0.00804              
 -9.6                 0.00795              
 -9.7                 0.00797              
 -9.8                 0.00796              
 -9.9                 0.00797              
 -10.                 0.00797              
 -10.1                0.00638              
 -10.2                0.00254              
 -10.3                0.00120              
 -10.4                0.00083              
 -10.5                0.00085              
 -10.6                0.00084              
 -10.7                0.00085              
 -10.8                0.00085              
 -10.9                0.00084              
 -11.                 0.00085              
 -11.1                0.00258              
 -11.2                0.00587              
 -11.3                0.00732              
 -11.4                0.00800              
 -11.5                0.00798              
 -11.6                0.00879              
 -11.7                0.01045              
 -11.8                0.01031              
 -11.9                0.00677              
 -12.                 0.00334              
 -12.1                0.00349              
 -12.2                0.00655              
 -12.3                0.00801              
 -12.4                0.00794              
 -12.5                0.00797              
 -12.6                0.00797              
 -12.7                0.00797              
 -12.8                0.00797              
 -12.9                0.00797              
 -13.                 0.00797              
 -13.1                0.00797              
 -13.2                0.00797              
 -13.3                0.00797              
 -13.4                0.00797              
 -13.5                0.00797              
 -13.6                0.00797              
 -13.7                0.00797              
 -13.8                0.00797              
 -13.9                0.00797              
 -14.                 0.00796              
 -14.1                0.00798              
 -14.2                0.00843              
 -14.3                0.01009              
 -14.4                0.01159              
 -14.5                0.01080              
 -14.6                0.00955              
 -14.7                0.00837              
 -14.8                0.00797              
 -14.9                0.00797              
 -15.                 0.00797              
 -15.1                0.00797              
 -15.2                0.00797              
 -15.3                0.00797              
 -15.4                0.00797              
 -15.5                0.00797              
 -15.6                0.00794              
 -15.7                0.00801              
 -15.8                0.00887              
 -15.9                0.01059              
 -16.                 0.01157              
 -16.1                0.01153              
 -16.2                0.01147              
 -16.3                0.01057              
 -16.4                0.00886              
 -16.5                0.00791              
 -16.6                0.00799              
 -16.7                0.00796              
 -16.8                0.00797              
 -16.9                0.00797              
 -17.                 0.00797              
 -17.1                0.00797              
 -17.2                0.00797              
 -17.3                0.00797              
 -17.4                0.00797              
 -17.5                0.00797              
 -17.6                0.00797              
 -17.7                0.00795              
 -17.8                0.00800              
 -17.9                0.00843              
 -18.                 0.00946              
 -18.1                0.01110              
 -18.2                0.01154              
 -18.3                0.01154              
 -18.4                0.01150              
 -18.5                0.01067              
 -18.6                0.00896              
 -18.7                0.00794              
 -18.8                0.00802              
 -18.9                0.00849              
 -19.                 0.00930              
 -19.1                0.00898              
 -19.2                0.00792              
 -19.3                0.00799              
 -19.4                0.00796              
 -19.5                0.00797              
 -19.6                0.00796              
 -19.7                0.00799              
 -19.8                0.00867              
 -19.9                0.01000              
 -20.                 0.01219              
 -20.1                0.01627              
 -20.2                0.01992              
 -20.3                0.01855              
 -20.4                0.01608              
 -20.5                0.01505              
 -20.6                0.01509              
 -20.7                0.01508              
 -20.8                0.01509              
 -20.9                0.01509              
 -21.                 0.01509              
 -21.1                0.01509              
 -21.2                0.01504              
 -21.3                0.01437              
 -21.4                0.01306              
 -21.5                0.01298              
 -21.6                0.01428              
 -21.7                0.01508              
 -21.8                0.01599              
 -21.9                0.01936              
 -22.                 0.02151              
 -22.1                0.02114              
 -22.2                0.01822              
 -22.3                0.01548              
 -22.4                0.01510              
 -22.5                0.01724              
 -22.6                0.02195              
 -22.7                0.02539              
 -22.8                0.02574              
 -22.9                0.02578              
 -23.                 0.02658              
 -23.1                0.02891              
 -23.2                0.03170              
 -23.3                0.03289              
 -23.4                0.03387              
 -23.5                0.03903              
 -23.6                0.04678              
 -23.7                0.05738              
 -23.8                0.07283              
 -23.9                0.08910              
 -24.                 0.11049              
 -24.1                0.13695              
 -24.2                0.16839              
 -24.3                0.20386              
 -24.4                0.23751              
 -24.5                0.27493              
 -24.6                0.31216              
 -24.7                0.34728              
 -24.8                0.37974              
 -24.9                0.41053              
 -25.                 0.43713              
 -25.1                0.46319              
 -25.2                0.48303              
 -25.3                0.50298              
 -25.4                0.52011              
 -25.5                0.53249              
 -25.6                0.54324              
 -25.7                0.54883              
 -25.8                0.55441              
 -25.9                0.56000              
 -26.                 0.56404              
 -26.1                0.56652              
 -26.2                0.56345              
 -26.3                0.55646              
 -26.4                0.54878              
 -26.5                0.54111              
 -26.6                0.53162              
 -26.7                0.52411              
 -26.8                0.51674              
 -26.9                0.51116              
 -27.                 0.51265              
 -27.1                0.51894              
 -27.2                0.52846              
 -27.3                0.54004              
 -27.4                0.55253              
 -27.5                0.56457              
 -27.6                0.57721              
 -27.7                0.58530              
 -27.8                0.5844               
 -27.9                0.57812              
 -28.                 0.56374              
 -28.1                0.54011              
 -28.2                0.51413              
 -28.3                0.48454              
 -28.4                0.45314              
 -28.5                0.42533              
 -28.6                0.40048              
 -28.7                0.38155              
 -28.8                0.36944              
 -28.9                0.36731              
 -29.                 0.37828              
 -29.1                0.40134              
 -29.2                0.42663              
 -29.3                0.46076              
 -29.4                0.50239              
 -29.5                0.54621              
 -29.6                0.59187              
 -29.7                0.63451              
 -29.8                0.67037              
 -29.9                0.70390              
 -30.                 0.72382              
 -30.1                0.73379              
 -30.2                0.73052              
 -30.3                0.71326              
 -30.4                0.68591              
 -30.5                0.64916              
 -30.6                0.60171              
 -30.7                0.55170              
 -30.8                0.48791              
 -30.9                0.42805              
 -31.                 0.37354              
 -31.1                0.30844              
 -31.2                0.26135              
 -31.3                0.21513              
 -31.4                0.17112              
 -31.5                0.13972              
 -31.6                0.10747              
 -31.7                0.08516              
 -31.8                0.06581              
 -31.9                0.05020              
 -32.                 0.03892              
 -32.1                0.03079              
 -32.2                0.02519              
 -32.3                0.02039              
 -32.4                0.01497              
 -32.5                0.01196              
 -32.6                0.01154              
 -32.7                0.01153              
 -32.8                0.01153              
 -32.9                0.01153              
 -33.                 0.01153              
 -33.1                0.01153              
 -33.2                0.01153              
 -33.3                0.01153              
 -33.4                0.01153              
 -33.5                0.01153              
 -33.6                0.01153              
 -33.7                0.01153              
 -33.8                0.01153              
 -33.9                0.01153              
 -34.                 0.01153              
 -34.1                0.01153              
 -34.2                0.01152              
 -34.3                0.01154              
 -34.4                0.01152              
 -34.5                0.00972              
 -34.6                0.00651              
 -34.7                0.00717              
 -34.8                0.00973              
 -34.9                0.01055              
 -35.                 0.00764              
 -35.1                0.00484              
 -35.2                0.00440              
 -35.3                0.00441              
 -35.4                0.00441              
 -35.5                0.00441              
 -35.6                0.00441              
 -35.7                0.00440              
 -35.8                0.00371              
 -35.9                0.00249              
 -36.                 0.00220              
 -36.1                0.00349              
 -36.2                0.00446              
 -36.3                0.00438              
 -36.4                0.00441              
 -36.5                0.00441              
 -36.6                0.00441              
 -36.7                0.00441              
 -36.8                0.00440              
 -36.9                0.00377              
 -37.                 0.00249              
 -37.1                0.00130              
 -37.2                0.00083              
 -37.3                0.00085              
 -37.4                0.00084              
 -37.5                0.00085              
 -37.6                0.00085              
 -37.7                0.00085              
 -37.8                0.00085              
 -37.9                0.00085              
 -38.                 0.00085              
 -38.1                0.00085              
 -38.2                0.00085              
 -38.3                0.00085              
 -38.4                0.00085              
 -38.5                0.00085              
 -38.6                0.00085              
 -38.7                0.00085              
 -38.8                0.00083              
 -38.9                0.00087              
 -39.                 0.00209              
 -39.1                0.00368              
 -39.2                0.00442              
 -39.3                0.00436              
 -39.4                0.00367              
 -39.5                0.00180              
 -39.6                0.00139              
 -39.7                0.00269              
 -39.8                0.00309              
 -39.9                0.00187              
 -40.                 0.00083              
 -40.1                0.00087              
 -40.2                0.00084              
 -40.3                0.00085              
 -40.4                0.00084              
 -40.5                0.00085              
 -40.6                0.00151              
 -40.7                0.00280              
 -40.8                0.00398              
 -40.9                0.00442              
 -41.                 0.00440              
 -41.1                0.00442              
 -41.2                0.00439              
 -41.3                0.00391              
 -41.4                0.00269              
 -41.5                0.00134              
 -41.6                0.00084              
 -41.7                0.00086              
 -41.8                0.00084              
 -41.9                0.00084              
 -42.                 0.00166              
 -42.1                0.00331              
 -42.2                0.00406              
 -42.3                0.00443              
 -42.4                0.00441              
 -42.5                0.00439              
 -42.6                0.00445              
 -42.7                0.00646              
 -42.8                0.00977              
 -42.9                0.01156              
 -43.                 0.01153              
 -43.1                0.01140              
 -43.2                0.00910              
 -43.3                0.00576              
 -43.4                0.00436              
 -43.5                0.00440              
 -43.6                0.00441              
 -43.7                0.00440              
 -43.8                0.00375              
 -43.9                0.00246              
 -44.                 0.00128              
 -44.1                0.00083              
 -44.2                0.00085              
 -44.3                0.00084              
 -44.4                0.00085              
 -44.5                0.00085              
 -44.6                0.00085              
 -44.7                0.00085              
 -44.8                0.00085              
 -44.9                0.00083              
 -45.                 0.00087              
 -45.1                0.00170              
 -45.2                0.00494              
 -45.3                0.00805              
 -45.4                0.00723              
 -45.5                0.00608              
 -45.6                0.00575              
 -45.7                0.00702              
 -45.8                0.00801              
 -45.9                0.00794              
 -46.                 0.00797              
 -46.1                0.00797              
 -46.2                0.00797              
 -46.3                0.00797              
 -46.4                0.00797              
 -46.5                0.00797              
 -46.6                0.00797              
 -46.7                0.00797              
 -46.8                0.00891              
 -46.9                0.01228              
 -47.                 0.01371              
 -47.1                0.01213              
 -47.2                0.00928              
 -47.3                0.00792              
 -47.4                0.00798              
 -47.5                0.00796              
 -47.6                0.00797              
 -47.7                0.00797              
 -47.8                0.00797              
 -47.9                0.00797              
 -48.                 0.00797              
 -48.1                0.00796              
 -48.2                0.00744              
 -48.3                0.00579              
 -48.4                0.00520              
 -48.5                0.00746              
 -48.6                0.00796              
 -48.7                0.00797              
 -48.8                0.00797              
 -48.9                0.00797              
 -49.                 0.00797              
 -49.1                0.00797              
 -49.2                0.00797              
 -49.3                0.00797              
 -49.4                0.00797              
 -49.5                0.00797              
 -49.6                0.00797              
 -49.7                0.00797              
 -49.8                0.00797              
 -49.9                0.00797              
 -50.                 0.00797              
##END=
