Mon Jul 04 19:37:51.142 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:37:51.145 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H5_EUOS_Plate08_H5\1\pdata\1
Mon Jul 04 19:37:51.153 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:37:51.157 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:37:51.160 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:37:58.223 CEST 2022: No HSQC data available
Mon Jul 04 19:37:58.239 CEST 2022: No C13 data available
Mon Jul 04 19:37:58.253 CEST 2022: No HMBC data available
Mon Jul 04 19:37:58.306 CEST 2022: Elapsed time for evaluation (XD Suite): 0.05 s.
Mon Jul 04 19:38:00.822 CEST 2022: Elapsed time for evaluation (SPD Suite): 2.51 s.
Mon Jul 04 19:38:00.929 CEST 2022: Structure is used: true
Mon Jul 04 19:38:00.946 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H5_EUOS_Plate08_H5/1/H5_EUOS_Plate08_H5-968dda22-41d8-4f1b-98ed-005cdf242b6c.mol
Mon Jul 04 19:38:00.948 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.12 s.
Mon Jul 04 19:38:00.956 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:38:00.959 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:38:00.978 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.02 s.
Mon Jul 04 19:38:00.981 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:38:00.984 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:38:00.986 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:38:00.988 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:38:00.993 CEST 2022: Suppression frequencies at: 4.769 
Mon Jul 04 19:38:00.995 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:38:00.999 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:38:01.002 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:38:01.004 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DMSO, protonShiftLimitAPpm=2.7, protonShiftLimitBPpm=2.66, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Mon Jul 04 19:38:01.006 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DSS, protonShiftLimitAPpm=-0.01, protonShiftLimitBPpm=0.01, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Mon Jul 04 19:38:01.009 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:38:01.012 CEST 2022: RMSD noise: 19875601.360 (8.830/8.330)
Mon Jul 04 19:38:01.014 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:38:01.017 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:38:01.022 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:38:01.046 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:38:01.268 CEST 2022: Number of Peaks: (219, 39)
Mon Jul 04 19:38:01.271 CEST 2022: Elapsed time for evaluation (PP Suite): 0.22 s.
Mon Jul 04 19:38:01.274 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:38:01.440 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.16 s.
Mon Jul 04 19:38:01.443 CEST 2022: Signal-to-Noise ratio: 21152.55 (1.304 ppm)
Mon Jul 04 19:38:01.447 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:38:01.449 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:38:01.452 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.50 s.
Mon Jul 04 19:38:01.752 CEST 2022: Number of Multiplets: 449
Mon Jul 04 19:38:01.766 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.31 s.
Mon Jul 04 19:38:01.875 CEST 2022: Number of Peak Cluster: 28
Mon Jul 04 19:38:01.883 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.12 s.
Mon Jul 04 19:38:01.957 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.07 s.
Mon Jul 04 19:38:02.273 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.31 s.
Mon Jul 04 19:38:02.286 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 19:38:02.291 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:38:02.296 CEST 2022: Number of consistent PNS: 2
Mon Jul 04 19:38:02.299 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 19:38:02.303 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:38:03.523 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 1.22 s.
Mon Jul 04 19:38:05.481 CEST 2022: Elapsed time for evaluation (IN Suite): 1.95 s.
Mon Jul 04 19:38:05.545 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 19:38:05.549 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:38:05.960 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.47 s.
Mon Jul 04 19:38:05.963 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:38:05.966 CEST 2022: CMC-q finished in 14.82 s.
