Tue Jul 05 12:07:24.325 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Tue Jul 05 12:07:24.328 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H1_EUOS_Plate07_H1\1\pdata\1
Tue Jul 05 12:07:24.336 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Tue Jul 05 12:07:24.339 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Tue Jul 05 12:07:24.342 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Tue Jul 05 12:07:24.831 CEST 2022: No HSQC data available
Tue Jul 05 12:07:24.843 CEST 2022: No C13 data available
Tue Jul 05 12:07:24.855 CEST 2022: No HMBC data available
Tue Jul 05 12:07:24.901 CEST 2022: Elapsed time for evaluation (XD Suite): 0.04 s.
Tue Jul 05 12:07:24.923 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Tue Jul 05 12:07:25.062 CEST 2022: Structure is used: true
Tue Jul 05 12:07:25.065 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H1_EUOS_Plate07_H1/1/H1_EUOS_Plate07_H1-989265d0-b5a1-470e-8f3e-26712996c55c.mol
Tue Jul 05 12:07:25.068 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.14 s.
Tue Jul 05 12:07:25.080 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Tue Jul 05 12:07:25.082 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Tue Jul 05 12:07:25.086 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Tue Jul 05 12:07:25.089 CEST 2022: Spectrum is not 13C decoupled.
Tue Jul 05 12:07:25.091 CEST 2022: Spectrum does not contain ERETIC signal.
Tue Jul 05 12:07:25.093 CEST 2022: Spectrum is suppressed.
Tue Jul 05 12:07:25.096 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Tue Jul 05 12:07:25.100 CEST 2022: Suppression frequencies at: 4.661 
Tue Jul 05 12:07:25.103 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Tue Jul 05 12:07:25.106 CEST 2022: Expected impurity: TMS
Tue Jul 05 12:07:25.108 CEST 2022: Expected impurity: DMSO_D5
Tue Jul 05 12:07:25.110 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 12:07:25.113 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 12:07:25.114 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Tue Jul 05 12:07:25.117 CEST 2022: RMSD noise: 18654741.265 (10.107/9.608)
Tue Jul 05 12:07:25.120 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Tue Jul 05 12:07:25.123 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Tue Jul 05 12:07:25.127 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Tue Jul 05 12:07:25.150 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Tue Jul 05 12:07:25.283 CEST 2022: Number of Peaks: (127, 7)
Tue Jul 05 12:07:25.309 CEST 2022: Elapsed time for evaluation (PP Suite): 0.16 s.
Tue Jul 05 12:07:25.312 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Tue Jul 05 12:07:25.325 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Tue Jul 05 12:07:25.327 CEST 2022: Signal-to-Noise ratio: 6023.20 (1.619 ppm)
Tue Jul 05 12:07:25.330 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Tue Jul 05 12:07:25.333 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:07:25.336 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.27 s.
Tue Jul 05 12:07:25.367 CEST 2022: Number of Multiplets: 201
Tue Jul 05 12:07:25.369 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Tue Jul 05 12:07:25.458 CEST 2022: Number of Peak Cluster: 47
Tue Jul 05 12:07:25.464 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.09 s.
Tue Jul 05 12:07:25.487 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Tue Jul 05 12:07:25.665 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.17 s.
Tue Jul 05 12:07:25.684 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.02 s.
Tue Jul 05 12:07:25.691 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Tue Jul 05 12:07:25.696 CEST 2022: Number of consistent PNS: 6
Tue Jul 05 12:07:25.699 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Tue Jul 05 12:07:25.702 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Tue Jul 05 12:07:25.737 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.03 s.
Tue Jul 05 12:07:25.924 CEST 2022: Elapsed time for evaluation (IN Suite): 0.18 s.
Tue Jul 05 12:07:26.010 CEST 2022: CMC-assist project state: AutoConsistent
Tue Jul 05 12:07:26.014 CEST 2022: Impurity 13C satellite filter active!
Tue Jul 05 12:07:26.427 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.50 s.
Tue Jul 05 12:07:26.440 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:07:26.442 CEST 2022: CMC-q finished in 2.12 s.
