Mon Jul 04 16:32:41.186 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:32:41.188 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H9_OS_Plate02_H9\1\pdata\1
Mon Jul 04 16:32:41.196 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:32:41.200 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:32:41.203 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:32:41.230 CEST 2022: No HSQC data available
Mon Jul 04 16:32:41.242 CEST 2022: No C13 data available
Mon Jul 04 16:32:41.253 CEST 2022: No HMBC data available
Mon Jul 04 16:32:41.260 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:32:41.278 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.01 s.
Mon Jul 04 16:32:41.375 CEST 2022: Structure is used: true
Mon Jul 04 16:32:41.378 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H9_OS_Plate02_H9/1/H9_OS_Plate02_H9-8ed196d9-4c3d-4581-8548-15c1aa193c67.mol
Mon Jul 04 16:32:41.381 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.10 s.
Mon Jul 04 16:32:41.387 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:32:41.390 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:32:41.393 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:32:41.395 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:32:41.398 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:32:41.400 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:32:41.402 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:32:41.407 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:32:41.409 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:32:41.413 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:32:41.415 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:32:41.418 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DMSO, protonShiftLimitAPpm=2.6, protonShiftLimitBPpm=2.54, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Mon Jul 04 16:32:41.420 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:32:41.423 CEST 2022: RMSD noise: 31358513.203 (-0.405/-0.905)
Mon Jul 04 16:32:41.425 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:32:41.428 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:32:41.432 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:32:41.456 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:32:41.536 CEST 2022: Number of Peaks: (58, 14)
Mon Jul 04 16:32:41.563 CEST 2022: Elapsed time for evaluation (PP Suite): 0.10 s.
Mon Jul 04 16:32:41.565 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:32:41.629 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.06 s.
Mon Jul 04 16:32:41.632 CEST 2022: Signal-to-Noise ratio: 1333.46 (7.598 ppm)
Mon Jul 04 16:32:41.635 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:32:41.638 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:32:41.640 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.26 s.
Mon Jul 04 16:32:41.654 CEST 2022: Number of Multiplets: 101
Mon Jul 04 16:32:41.657 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.01 s.
Mon Jul 04 16:32:41.729 CEST 2022: Number of Peak Cluster: 22
Mon Jul 04 16:32:41.735 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.08 s.
Mon Jul 04 16:32:41.754 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 16:32:41.869 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.11 s.
Mon Jul 04 16:32:41.873 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:32:41.878 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:32:41.882 CEST 2022: Number of consistent PNS: 3
Mon Jul 04 16:32:41.884 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:32:41.887 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:32:41.912 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Mon Jul 04 16:32:41.994 CEST 2022: Elapsed time for evaluation (IN Suite): 0.08 s.
Mon Jul 04 16:32:42.045 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:32:42.391 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.39 s.
Mon Jul 04 16:32:42.394 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:32:42.397 CEST 2022: CMC-q finished in 1.21 s.
