Mon Jul 04 19:37:37.149 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:37:37.152 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\F5_EUOS_Plate08_F5\1\pdata\1
Mon Jul 04 19:37:37.160 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:37:37.163 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:37:37.166 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:37:37.805 CEST 2022: No HSQC data available
Mon Jul 04 19:37:37.819 CEST 2022: No C13 data available
Mon Jul 04 19:37:37.834 CEST 2022: No HMBC data available
Mon Jul 04 19:37:37.843 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 19:37:37.864 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 19:37:37.968 CEST 2022: Structure is used: true
Mon Jul 04 19:37:37.972 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/F5_EUOS_Plate08_F5/1/F5_EUOS_Plate08_F5-70a1c6ca-8055-4db3-a826-bf88accf0c46.mol
Mon Jul 04 19:37:37.974 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.11 s.
Mon Jul 04 19:37:37.981 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:37:37.983 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:37:37.986 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:37:37.989 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:37:37.992 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:37:37.995 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:37:37.997 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:37:38.002 CEST 2022: Suppression frequencies at: 4.769 
Mon Jul 04 19:37:38.004 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:37:38.007 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:37:38.010 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:37:38.011 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 19:37:38.014 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 19:37:38.016 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:37:38.018 CEST 2022: RMSD noise: 19051286.420 (8.829/8.330)
Mon Jul 04 19:37:38.021 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:37:38.024 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:37:38.028 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:37:38.053 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:37:38.204 CEST 2022: Number of Peaks: (147, 10)
Mon Jul 04 19:37:38.207 CEST 2022: Elapsed time for evaluation (PP Suite): 0.15 s.
Mon Jul 04 19:37:38.210 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:37:38.260 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.05 s.
Mon Jul 04 19:37:38.262 CEST 2022: Signal-to-Noise ratio: 15879.56 (1.366 ppm)
Mon Jul 04 19:37:38.265 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:37:38.268 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:37:38.270 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.29 s.
Mon Jul 04 19:37:38.368 CEST 2022: Number of Multiplets: 285
Mon Jul 04 19:37:38.398 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.13 s.
Mon Jul 04 19:37:38.483 CEST 2022: Number of Peak Cluster: 29
Mon Jul 04 19:37:38.489 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.09 s.
Mon Jul 04 19:37:38.502 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 19:37:38.744 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.24 s.
Mon Jul 04 19:37:38.752 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 19:37:38.758 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:37:38.765 CEST 2022: Number of consistent PNS: 6
Mon Jul 04 19:37:38.767 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 19:37:38.771 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:37:38.859 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.09 s.
Mon Jul 04 19:37:38.961 CEST 2022: Elapsed time for evaluation (IN Suite): 0.10 s.
Mon Jul 04 19:37:39.019 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 19:37:39.022 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:37:39.384 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 19:37:39.394 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:37:39.396 CEST 2022: CMC-q finished in 2.25 s.
