Mon Jul 04 19:40:01.138 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:40:01.141 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\E9_EUOS_Plate08_E9\1\pdata\1
Mon Jul 04 19:40:01.148 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:40:01.152 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:40:01.155 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:40:01.198 CEST 2022: No HSQC data available
Mon Jul 04 19:40:01.211 CEST 2022: No C13 data available
Mon Jul 04 19:40:01.222 CEST 2022: No HMBC data available
Mon Jul 04 19:40:01.230 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 19:40:01.250 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 19:40:01.354 CEST 2022: Structure is used: true
Mon Jul 04 19:40:01.357 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/E9_EUOS_Plate08_E9/1/E9_EUOS_Plate08_E9-72ad9a74-4138-43db-9104-51ead1230848.mol
Mon Jul 04 19:40:01.360 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.11 s.
Mon Jul 04 19:40:01.367 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:40:01.369 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:40:01.372 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:40:01.374 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:40:01.377 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:40:01.379 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:40:01.381 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:40:01.386 CEST 2022: Suppression frequencies at: 4.769 
Mon Jul 04 19:40:01.388 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:40:01.392 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:40:01.394 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:40:01.396 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 19:40:01.399 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 19:40:01.401 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:40:01.403 CEST 2022: RMSD noise: 17258482.477 (-1.562/-2.062)
Mon Jul 04 19:40:01.405 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:40:01.409 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:40:01.413 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:40:01.438 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:40:01.708 CEST 2022: Number of Peaks: (265, 29)
Mon Jul 04 19:40:01.732 CEST 2022: Elapsed time for evaluation (PP Suite): 0.29 s.
Mon Jul 04 19:40:01.734 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:40:01.756 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.02 s.
Mon Jul 04 19:40:01.759 CEST 2022: Signal-to-Noise ratio: 22774.62 (2.898 ppm)
Mon Jul 04 19:40:01.762 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:40:01.764 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:40:01.766 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.40 s.
Mon Jul 04 19:40:01.933 CEST 2022: Number of Multiplets: 416
Mon Jul 04 19:40:01.936 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.17 s.
Mon Jul 04 19:40:02.053 CEST 2022: Number of Peak Cluster: 36
Mon Jul 04 19:40:02.058 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.12 s.
Mon Jul 04 19:40:02.083 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 19:40:02.417 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.33 s.
Mon Jul 04 19:40:02.440 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.02 s.
Mon Jul 04 19:40:02.448 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:40:02.453 CEST 2022: Number of consistent PNS: 1
Mon Jul 04 19:40:02.456 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 19:40:02.460 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:40:02.468 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.01 s.
Mon Jul 04 19:40:02.745 CEST 2022: Elapsed time for evaluation (IN Suite): 0.27 s.
Mon Jul 04 19:40:02.800 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 19:40:02.803 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:40:02.805 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:40:03.175 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.43 s.
Mon Jul 04 19:40:03.178 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:40:03.180 CEST 2022: CMC-q finished in 2.04 s.
