##TITLE= acetone
##JCAMP-DX= 5  $$Exported NUTS Data File
##$DATA TYPE= NMR SPECTRUM
##$DATA Class= XYDATA
##$ORIGIN= NUTS EXPORT
##$OWNER= 
##$SPECTROMETER/DATA SYSTEM= NUTS EXPORT
##$INSTRUMENTAL PARAMETERS= 1H
##.OBSERVE FREQUENCY= 299.961395
##.OBSERVE NUCLEUS= H1
##NPOINTS= 32768
##XUNITS= PPM
##$YUNITS= ARBITRARY UNITS
##FIRSTX= 9.9978   
##LASTX= -0.4985   
##XFACTOR= 1.0
##YFACTOR= 1.0
##FIRSTY= 3494.822  
##MAXY= 284000672.000
##MINY= -849014.000
##$ASSIGNMENT TYPE= CHIME
##$CHIME TARGET= PROPSTRUCT
##PEAK ASSIGNMENT= (XYWA)
(2.16, -1, 0.05, <select *; spacefill off; wireframe on; wireframe 40; color atoms cpk; select atomno=5 or atomno=6 or atomno=7 or atomno=8 or atomno=9 or atomno=10; spacefill 125; color atoms red>)
(6,-1,6,  <select *; spacefill off; wireframe on; wireframe 40; color atoms cpk>)
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##END= 
