Tue Jul 05 12:11:58.640 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Tue Jul 05 12:11:58.642 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G1_EUOS_Plate10_G1\1\pdata\1
Tue Jul 05 12:11:58.651 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Tue Jul 05 12:11:58.655 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Tue Jul 05 12:11:58.658 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Tue Jul 05 12:11:58.698 CEST 2022: No HSQC data available
Tue Jul 05 12:11:58.711 CEST 2022: No C13 data available
Tue Jul 05 12:11:58.723 CEST 2022: No HMBC data available
Tue Jul 05 12:11:58.731 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Tue Jul 05 12:11:58.752 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Tue Jul 05 12:11:58.948 CEST 2022: Structure is used: true
Tue Jul 05 12:11:58.981 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G1_EUOS_Plate10_G1/1/G1_EUOS_Plate10_G1-0f8a5b66-42ee-4caf-89f4-6466ff160dc1.mol
Tue Jul 05 12:11:58.984 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.23 s.
Tue Jul 05 12:11:58.995 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Tue Jul 05 12:11:58.997 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Tue Jul 05 12:11:59.000 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Tue Jul 05 12:11:59.002 CEST 2022: Spectrum is not 13C decoupled.
Tue Jul 05 12:11:59.006 CEST 2022: Spectrum does not contain ERETIC signal.
Tue Jul 05 12:11:59.008 CEST 2022: Spectrum is suppressed.
Tue Jul 05 12:11:59.011 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Tue Jul 05 12:11:59.015 CEST 2022: Suppression frequencies at: 4.661 
Tue Jul 05 12:11:59.018 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Tue Jul 05 12:11:59.021 CEST 2022: Expected impurity: TMS
Tue Jul 05 12:11:59.023 CEST 2022: Expected impurity: DMSO_D5
Tue Jul 05 12:11:59.026 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 12:11:59.028 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 12:11:59.031 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Tue Jul 05 12:11:59.033 CEST 2022: RMSD noise: 20151642.441 (10.800/10.300)
Tue Jul 05 12:11:59.035 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Tue Jul 05 12:11:59.038 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Tue Jul 05 12:11:59.042 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Tue Jul 05 12:11:59.067 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Tue Jul 05 12:11:59.157 CEST 2022: Number of Peaks: (78, 13)
Tue Jul 05 12:11:59.159 CEST 2022: Elapsed time for evaluation (PP Suite): 0.09 s.
Tue Jul 05 12:11:59.162 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Tue Jul 05 12:11:59.212 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.05 s.
Tue Jul 05 12:11:59.215 CEST 2022: Signal-to-Noise ratio: 837.08 (2.283 ppm)
Tue Jul 05 12:11:59.218 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Tue Jul 05 12:11:59.221 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:11:59.224 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.24 s.
Tue Jul 05 12:11:59.251 CEST 2022: Number of Multiplets: 165
Tue Jul 05 12:11:59.254 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Tue Jul 05 12:11:59.307 CEST 2022: Number of Peak Cluster: 25
Tue Jul 05 12:11:59.314 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Tue Jul 05 12:11:59.361 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.04 s.
Tue Jul 05 12:11:59.502 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.14 s.
Tue Jul 05 12:11:59.508 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Tue Jul 05 12:11:59.513 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Tue Jul 05 12:11:59.516 CEST 2022: Number of consistent PNS: 1
Tue Jul 05 12:11:59.519 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Tue Jul 05 12:11:59.524 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Tue Jul 05 12:11:59.586 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.06 s.
Tue Jul 05 12:11:59.741 CEST 2022: Elapsed time for evaluation (IN Suite): 0.14 s.
Tue Jul 05 12:11:59.796 CEST 2022: CMC-assist project state: AutoConsistent
Tue Jul 05 12:11:59.799 CEST 2022: Impurity 13C satellite filter active!
Tue Jul 05 12:12:00.177 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.43 s.
Tue Jul 05 12:12:00.180 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:12:00.182 CEST 2022: CMC-q finished in 1.54 s.
