Tue Jul 05 12:15:32.855 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Tue Jul 05 12:15:32.858 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G8_EUOS_Plate10_G8\1\pdata\1
Tue Jul 05 12:15:32.865 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Tue Jul 05 12:15:32.869 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Tue Jul 05 12:15:32.872 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Tue Jul 05 12:15:32.920 CEST 2022: No HSQC data available
Tue Jul 05 12:15:32.933 CEST 2022: No C13 data available
Tue Jul 05 12:15:32.944 CEST 2022: No HMBC data available
Tue Jul 05 12:15:32.952 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Tue Jul 05 12:15:32.974 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Tue Jul 05 12:15:33.067 CEST 2022: Structure is used: true
Tue Jul 05 12:15:33.070 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G8_EUOS_Plate10_G8/1/G8_EUOS_Plate10_G8-07733139-0b1a-4068-94ec-d0be23e6d64c.mol
Tue Jul 05 12:15:33.073 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.10 s.
Tue Jul 05 12:15:33.085 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Tue Jul 05 12:15:33.088 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Tue Jul 05 12:15:33.091 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Tue Jul 05 12:15:33.094 CEST 2022: Spectrum is not 13C decoupled.
Tue Jul 05 12:15:33.096 CEST 2022: Spectrum does not contain ERETIC signal.
Tue Jul 05 12:15:33.098 CEST 2022: Spectrum is suppressed.
Tue Jul 05 12:15:33.101 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Tue Jul 05 12:15:33.105 CEST 2022: Suppression frequencies at: 4.661 
Tue Jul 05 12:15:33.107 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Tue Jul 05 12:15:33.110 CEST 2022: Expected impurity: TMS
Tue Jul 05 12:15:33.113 CEST 2022: Expected impurity: DMSO_D5
Tue Jul 05 12:15:33.116 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 12:15:33.118 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 12:15:33.120 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Tue Jul 05 12:15:33.123 CEST 2022: RMSD noise: 18738586.028 (-0.977/-1.477)
Tue Jul 05 12:15:33.125 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Tue Jul 05 12:15:33.128 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Tue Jul 05 12:15:33.136 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Tue Jul 05 12:15:33.181 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Tue Jul 05 12:15:33.282 CEST 2022: Number of Peaks: (106, 10)
Tue Jul 05 12:15:33.286 CEST 2022: Elapsed time for evaluation (PP Suite): 0.10 s.
Tue Jul 05 12:15:33.287 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Tue Jul 05 12:15:33.301 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Tue Jul 05 12:15:33.303 CEST 2022: Signal-to-Noise ratio: 2254.13 (3.778 ppm)
Tue Jul 05 12:15:33.307 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Tue Jul 05 12:15:33.309 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:15:33.312 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.24 s.
Tue Jul 05 12:15:33.345 CEST 2022: Number of Multiplets: 206
Tue Jul 05 12:15:33.347 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Tue Jul 05 12:15:33.405 CEST 2022: Number of Peak Cluster: 29
Tue Jul 05 12:15:33.410 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Tue Jul 05 12:15:33.441 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.03 s.
Tue Jul 05 12:15:33.593 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.15 s.
Tue Jul 05 12:15:33.609 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Tue Jul 05 12:15:33.614 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Tue Jul 05 12:15:33.618 CEST 2022: Number of consistent PNS: 3
Tue Jul 05 12:15:33.621 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Tue Jul 05 12:15:33.624 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Tue Jul 05 12:15:33.638 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.01 s.
Tue Jul 05 12:15:33.761 CEST 2022: Elapsed time for evaluation (IN Suite): 0.12 s.
Tue Jul 05 12:15:33.827 CEST 2022: CMC-assist project state: AutoConsistent
Tue Jul 05 12:15:33.830 CEST 2022: Impurity 13C satellite filter active!
Tue Jul 05 12:15:34.199 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.44 s.
Tue Jul 05 12:15:34.202 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:15:34.205 CEST 2022: CMC-q finished in 1.35 s.
