Tue Jul 05 12:10:34.857 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Tue Jul 05 12:10:34.860 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H8_EUOS_Plate07_H8\1\pdata\1
Tue Jul 05 12:10:34.867 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Tue Jul 05 12:10:34.871 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Tue Jul 05 12:10:34.873 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Tue Jul 05 12:10:34.895 CEST 2022: No HSQC data available
Tue Jul 05 12:10:34.906 CEST 2022: No C13 data available
Tue Jul 05 12:10:34.917 CEST 2022: No HMBC data available
Tue Jul 05 12:10:34.924 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Tue Jul 05 12:10:34.945 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Tue Jul 05 12:10:35.038 CEST 2022: Structure is used: true
Tue Jul 05 12:10:35.070 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H8_EUOS_Plate07_H8/1/H8_EUOS_Plate07_H8-ef6cbd39-38d2-4aa3-b145-081d223252cf.mol
Tue Jul 05 12:10:35.073 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.12 s.
Tue Jul 05 12:10:35.085 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Tue Jul 05 12:10:35.087 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Tue Jul 05 12:10:35.090 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Tue Jul 05 12:10:35.092 CEST 2022: Spectrum is not 13C decoupled.
Tue Jul 05 12:10:35.095 CEST 2022: Spectrum does not contain ERETIC signal.
Tue Jul 05 12:10:35.097 CEST 2022: Spectrum is suppressed.
Tue Jul 05 12:10:35.099 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Tue Jul 05 12:10:35.103 CEST 2022: Suppression frequencies at: 4.661 
Tue Jul 05 12:10:35.105 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Tue Jul 05 12:10:35.108 CEST 2022: Expected impurity: TMS
Tue Jul 05 12:10:35.111 CEST 2022: Expected impurity: DMSO_D5
Tue Jul 05 12:10:35.113 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]
Tue Jul 05 12:10:35.116 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DSS, protonShiftLimitAPpm=-0.5, protonShiftLimitBPpm=0.1, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Tue Jul 05 12:10:35.118 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Tue Jul 05 12:10:35.120 CEST 2022: RMSD noise: 18327909.317 (-1.670/-2.170)
Tue Jul 05 12:10:35.123 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Tue Jul 05 12:10:35.126 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Tue Jul 05 12:10:35.130 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Tue Jul 05 12:10:35.155 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Tue Jul 05 12:10:35.240 CEST 2022: Number of Peaks: (74, 5)
Tue Jul 05 12:10:35.243 CEST 2022: Elapsed time for evaluation (PP Suite): 0.09 s.
Tue Jul 05 12:10:35.246 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Tue Jul 05 12:10:35.274 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.03 s.
Tue Jul 05 12:10:35.277 CEST 2022: Signal-to-Noise ratio: 4842.92 (1.935 ppm)
Tue Jul 05 12:10:35.280 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Tue Jul 05 12:10:35.283 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:10:35.286 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.21 s.
Tue Jul 05 12:10:35.307 CEST 2022: Number of Multiplets: 123
Tue Jul 05 12:10:35.310 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Tue Jul 05 12:10:35.355 CEST 2022: Number of Peak Cluster: 26
Tue Jul 05 12:10:35.361 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.05 s.
Tue Jul 05 12:10:35.398 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.03 s.
Tue Jul 05 12:10:35.544 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.14 s.
Tue Jul 05 12:10:35.549 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Tue Jul 05 12:10:35.554 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Tue Jul 05 12:10:35.558 CEST 2022: Number of consistent PNS: 0
Tue Jul 05 12:10:35.560 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Tue Jul 05 12:10:35.564 CEST 2022: Number of consistent PNS: 15
Tue Jul 05 12:10:35.566 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Tue Jul 05 12:10:35.571 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Tue Jul 05 12:10:35.573 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:10:36.313 CEST 2022: Elapsed time for evaluation (BU Suite): 0.75 s.
Tue Jul 05 12:10:36.365 CEST 2022: CMC-assist project state: AutoInconsistent
Tue Jul 05 12:10:36.368 CEST 2022: INCONSISTENT: No or only invalid ProtonNumberSolutions.
Tue Jul 05 12:10:36.738 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Tue Jul 05 12:10:36.742 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:10:36.744 CEST 2022: CMC-q finished in 1.89 s.
