Mon Jul 04 16:33:04.596 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:33:04.599 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H10_OS_Plate02_H10\1\pdata\1
Mon Jul 04 16:33:04.606 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:33:04.610 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:33:04.613 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:33:04.661 CEST 2022: No HSQC data available
Mon Jul 04 16:33:04.675 CEST 2022: No C13 data available
Mon Jul 04 16:33:04.688 CEST 2022: No HMBC data available
Mon Jul 04 16:33:04.696 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:33:04.715 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:33:04.851 CEST 2022: Structure is used: true
Mon Jul 04 16:33:04.872 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H10_OS_Plate02_H10/1/H10_OS_Plate02_H10-63f38188-bf7a-4a5a-bfda-a858113254b9.mol
Mon Jul 04 16:33:04.875 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.16 s.
Mon Jul 04 16:33:04.881 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:33:04.884 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:33:04.887 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:33:04.890 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:33:04.892 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:33:04.895 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:33:04.897 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:33:04.902 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:33:04.904 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:33:04.908 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:33:04.910 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:33:04.913 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 16:33:04.915 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:33:04.918 CEST 2022: RMSD noise: 29960342.018 (-0.405/-0.905)
Mon Jul 04 16:33:04.921 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:33:04.924 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:33:04.928 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:33:04.952 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:33:05.052 CEST 2022: Number of Peaks: (99, 6)
Mon Jul 04 16:33:05.056 CEST 2022: Elapsed time for evaluation (PP Suite): 0.10 s.
Mon Jul 04 16:33:05.059 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:33:05.111 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.05 s.
Mon Jul 04 16:33:05.115 CEST 2022: Signal-to-Noise ratio: 3524.00 (5.881 ppm)
Mon Jul 04 16:33:05.118 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:33:05.120 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:33:05.123 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.25 s.
Mon Jul 04 16:33:05.149 CEST 2022: Number of Multiplets: 156
Mon Jul 04 16:33:05.152 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 16:33:05.212 CEST 2022: Number of Peak Cluster: 34
Mon Jul 04 16:33:05.218 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Mon Jul 04 16:33:05.232 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:33:05.396 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.16 s.
Mon Jul 04 16:33:05.404 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:33:05.409 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:33:05.415 CEST 2022: Number of consistent PNS: 7
Mon Jul 04 16:33:05.418 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 16:33:05.421 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:33:05.467 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.04 s.
Mon Jul 04 16:33:05.763 CEST 2022: Elapsed time for evaluation (IN Suite): 0.28 s.
Mon Jul 04 16:33:05.825 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:33:06.191 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 16:33:06.194 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:33:06.197 CEST 2022: CMC-q finished in 1.60 s.
