Mon Jul 04 19:36:28.258 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:36:28.261 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\C4_EUOS_Plate08_C4\1\pdata\1
Mon Jul 04 19:36:28.268 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:36:28.272 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:36:28.275 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:36:28.815 CEST 2022: No HSQC data available
Mon Jul 04 19:36:28.829 CEST 2022: No C13 data available
Mon Jul 04 19:36:28.840 CEST 2022: No HMBC data available
Mon Jul 04 19:36:28.849 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 19:36:28.867 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 19:36:28.972 CEST 2022: Structure is used: true
Mon Jul 04 19:36:28.999 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/C4_EUOS_Plate08_C4/1/C4_EUOS_Plate08_C4-63f1a9e6-c6af-42ab-b665-06b813c3cf2c.mol
Mon Jul 04 19:36:29.002 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.13 s.
Mon Jul 04 19:36:29.009 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:36:29.011 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:36:29.015 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:36:29.017 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:36:29.019 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:36:29.022 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:36:29.025 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:36:29.029 CEST 2022: Suppression frequencies at: 4.770 
Mon Jul 04 19:36:29.032 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:36:29.035 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:36:29.038 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:36:29.040 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 19:36:29.043 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 19:36:29.045 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:36:29.048 CEST 2022: RMSD noise: 17848758.297 (-1.562/-2.062)
Mon Jul 04 19:36:29.050 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:36:29.053 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:36:29.057 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:36:29.082 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:36:29.240 CEST 2022: Number of Peaks: (154, 26)
Mon Jul 04 19:36:29.243 CEST 2022: Elapsed time for evaluation (PP Suite): 0.16 s.
Mon Jul 04 19:36:29.246 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:36:29.284 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.03 s.
Mon Jul 04 19:36:29.287 CEST 2022: Signal-to-Noise ratio: 26796.99 (7.140 ppm)
Mon Jul 04 19:36:29.291 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:36:29.293 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:36:29.296 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.29 s.
Mon Jul 04 19:36:29.350 CEST 2022: Number of Multiplets: 238
Mon Jul 04 19:36:29.354 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.06 s.
Mon Jul 04 19:36:29.458 CEST 2022: Number of Peak Cluster: 44
Mon Jul 04 19:36:29.465 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.11 s.
Mon Jul 04 19:36:29.493 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.03 s.
Mon Jul 04 19:36:29.702 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.21 s.
Mon Jul 04 19:36:29.730 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 19:36:29.738 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:36:29.742 CEST 2022: Number of consistent PNS: 0
Mon Jul 04 19:36:29.745 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 19:36:29.757 CEST 2022: Number of consistent PNS: 15
Mon Jul 04 19:36:29.760 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 19:36:29.766 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:36:29.769 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:36:31.324 CEST 2022: Elapsed time for evaluation (BU Suite): 1.58 s.
Mon Jul 04 19:36:31.382 CEST 2022: CMC-assist project state: AutoInconsistent
Mon Jul 04 19:36:31.385 CEST 2022: INCONSISTENT: No or only invalid ProtonNumberSolutions.
Mon Jul 04 19:36:31.747 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 19:36:31.750 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:36:31.752 CEST 2022: CMC-q finished in 3.50 s.
