##TITLE=              31P MAS NMR spectrum of hydrated 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 S3c
##OWNER=              Digitized and processed by Brouwer Lab, Redeemer University
##LONG DATE=          2020/07/22 10:05:19
##SOURCE REFERENCE=   POR-31P-Seo-2018-rehydrated
##DATA PROCESSING=    Spectrum digitized with WebPlotDigitizer and deconvoluted with Mathematica notebook

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

$$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 S3c

$$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=    -29.6151   -29.1687   -28.0902   -26.2636   
##$PEAK AREAS=         1.         1.         1.         1.        
##$PEAK WIDTHS=        2.23034    2.23034    2.23034    2.23034   
##$PEAK SHAPES=        0.70708    0.70708    0.70708    0.70708   
##$NUMBERING REF=     
##$ASSIGN REF=        
##$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=             -0.2                  
##LASTX=              -49.8                 
##XFACTOR=            1
##YFACTOR=            1
##NPOINTS=            249
##FIRSTY=              0.00554              

$$Spectrum data
##XYDATA=             (X++(Y..Y))
 -0.2                 0.00554              
 -0.4                 0.00604              
 -0.6                 0.00423              
 -0.8                 0.00276              
 -1.                  0.00224              
 -1.2                 0.00255              
 -1.4                 0.00551              
 -1.6                 0.00706              
 -1.8                 0.00658              
 -2.                  0.00613              
 -2.2                 0.00570              
 -2.4                 0.00526              
 -2.6                 0.00484              
 -2.8                 0.00441              
 -3.                  0.00399              
 -3.2                 0.00357              
 -3.4                 0.00315              
 -3.6                 0.00274              
 -3.8                 0.00233              
 -4                   0.00193              
 -4.2                 0.00152              
 -4.4                 0.00112              
 -4.6                 0.00072              
 -4.8                 0.00033              
 -5.                 -0.00005              
 -5.2                -0.00044              
 -5.4                -0.00082              
 -5.6                -0.00121              
 -5.8                -0.00158              
 -6                  -0.00196              
 -6.2                -0.00233              
 -6.4                -0.00271              
 -6.6                -0.00304              
 -6.8                -0.00328              
 -7.                 -0.00111              
 -7.2                 0.00139              
 -7.4                 0.00160              
 -7.6                 0.00125              
 -7.8                 0.00090              
 -8.                  0.00056              
 -8.2                 0.00022              
 -8.4                -0.00011              
 -8.6                -0.00045              
 -8.8                -0.00078              
 -9.                 -0.00111              
 -9.2                -0.00144              
 -9.4                -0.00176              
 -9.6                -0.00209              
 -9.8                -0.00238              
 -10.                -0.00091              
 -10.2                0.00155              
 -10.4                0.00272              
 -10.6                0.00244              
 -10.8                0.00208              
 -11.                 0.00376              
 -11.2                0.00464              
 -11.4                0.00259              
 -11.6                0.00175              
 -11.8                0.00351              
 -12.                 0.00601              
 -12.2                0.00625              
 -12.4                0.00599              
 -12.6                0.00571              
 -12.8                0.00544              
 -13.                 0.00518              
 -13.2                0.00491              
 -13.4                0.00465              
 -13.6                0.00439              
 -13.8                0.00415              
 -14.                 0.00411              
 -14.2                0.00644              
 -14.4                0.00898              
 -14.6                0.00924              
 -14.8                0.00902              
 -15.                 0.00879              
 -15.2                0.00855              
 -15.4                0.00832              
 -15.6                0.00809              
 -15.8                0.00786              
 -16.                 0.00767              
 -16.2                0.00924              
 -16.4                0.01181              
 -16.6                0.01306              
 -16.8                0.01291              
 -17.                 0.01316              
 -17.2                0.01566              
 -17.4                0.01766              
 -17.6                0.01464              
 -17.8                0.01529              
 -18.                 0.01718              
 -18.2                0.01437              
 -18.4                0.01153              
 -18.6                0.01302              
 -18.8                0.01628              
 -19.                 0.01693              
 -19.2                0.01676              
 -19.4                0.01659              
 -19.6                0.01643              
 -19.8                0.01627              
 -20.                 0.01611              
 -20.2                0.01596              
 -20.4                0.01581              
 -20.6                0.01571              
 -20.8                0.01704              
 -21.                 0.01968              
 -21.2                0.02132              
 -21.4                0.02121              
 -21.6                0.02109              
 -21.8                0.02145              
 -22.                 0.02410              
 -22.2                0.02905              
 -22.4                0.03216              
 -22.6                0.03259              
 -22.8                0.03539              
 -23.                 0.03819              
 -23.2                0.04108              
 -23.4                0.04454              
 -23.6                0.04817              
 -23.8                0.05384              
 -24.                 0.06186              
 -24.2                0.07141              
 -24.4                0.08225              
 -24.6                0.10064              
 -24.8                0.12655              
 -25.                 0.16474              
 -25.2                0.21808              
 -25.4                0.27797              
 -25.6                0.33864              
 -25.8                0.38568              
 -26.                 0.41821              
 -26.2                0.42191              
 -26.4                0.414                
 -26.6                0.40796              
 -26.8                0.41841              
 -27.                 0.45544              
 -27.2                0.50770              
 -27.4                0.56747              
 -27.6                0.61740              
 -27.8                0.64940              
 -28.                 0.67255              
 -28.2                0.69288              
 -28.4                0.71837              
 -28.6                0.74835              
 -28.8                0.77862              
 -29.                 0.79886              
 -29.2                0.80249              
 -29.4                0.78497              
 -29.6                0.74866              
 -29.8                0.68981              
 -30.                 0.60797              
 -30.2                0.51773              
 -30.4                0.41493              
 -30.6                0.32731              
 -30.8                0.26480              
 -31.                 0.22153              
 -31.2                0.18786              
 -31.4                0.16350              
 -31.6                0.14549              
 -31.8                0.12882              
 -32.                 0.11563              
 -32.2                0.10373              
 -32.4                0.09370              
 -32.6                0.08499              
 -32.8                0.07593              
 -33.                 0.06804              
 -33.2                0.06049              
 -33.4                0.05392              
 -33.6                0.04848              
 -33.8                0.04508              
 -34.                 0.04226              
 -34.2                0.03931              
 -34.4                0.03516              
 -34.6                0.03213              
 -34.8                0.03062              
 -35.                 0.02762              
 -35.2                0.02365              
 -35.4                0.02088              
 -35.6                0.01943              
 -35.8                0.01941              
 -36.                 0.01948              
 -36.2                0.01780              
 -36.4                0.01510              
 -36.6                0.01372              
 -36.8                0.01376              
 -37.                 0.01384              
 -37.2                0.01395              
 -37.4                0.01256              
 -37.6                0.01236              
 -37.8                0.01095              
 -38.                 0.00849              
 -38.2                0.00845              
 -38.4                0.00854              
 -38.6                0.00868              
 -38.8                0.00880              
 -39.                 0.00893              
 -39.2                0.00826              
 -39.4                0.00535              
 -39.6                0.00323              
 -39.8                0.00339              
 -40.                 0.00354              
 -40.2                0.00370              
 -40.4                0.00385              
 -40.6                0.00401              
 -40.8                0.00417              
 -41.                 0.00434              
 -41.2                0.00450              
 -41.4                0.00468              
 -41.6                0.00487              
 -41.8                0.00508              
 -42.                 0.00323              
 -42.2                0.00080              
 -42.4                0.00309              
 -42.6                0.00234              
 -42.8               -0.00001              
 -43.                 0.00007              
 -43.2                0.00026              
 -43.4                0.00044              
 -43.6                0.00065              
 -43.8                0.00086              
 -44.                 0.00107              
 -44.2                0.00128              
 -44.4                0.00150              
 -44.6                0.00172              
 -44.8                0.00194              
 -45.                 0.00217              
 -45.2                0.00240              
 -45.4                0.00263              
 -45.6                0.00287              
 -45.8                0.00311              
 -46.                 0.00335              
 -46.2                0.00360              
 -46.4                0.00385              
 -46.6                0.00410              
 -46.8                0.00435              
 -47.                 0.00462              
 -47.2                0.00487              
 -47.4                0.00517              
 -47.6                0.00250              
 -47.8                0.00135              
 -48.                 0.00117              
 -48.2                0.00010              
 -48.4                0.00116              
 -48.6                0.00129              
 -48.8                0.00175              
 -49.                 0.00361              
 -49.2                0.00323              
 -49.4                0.00197              
 -49.6                0.00213              
 -49.8                0.00243              
##END=
