Mon Jul 04 16:53:31.416 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:53:31.419 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H10_OS_Plate06_H10\1\pdata\1
Mon Jul 04 16:53:31.427 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:53:31.430 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:53:31.433 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:53:31.467 CEST 2022: No HSQC data available
Mon Jul 04 16:53:31.482 CEST 2022: No C13 data available
Mon Jul 04 16:53:31.496 CEST 2022: No HMBC data available
Mon Jul 04 16:53:31.512 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:53:31.530 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.01 s.
Mon Jul 04 16:53:31.632 CEST 2022: Structure is used: true
Mon Jul 04 16:53:31.656 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H10_OS_Plate06_H10/1/H10_OS_Plate06_H10-a340a86e-4021-4493-a848-612d38b21f14.mol
Mon Jul 04 16:53:31.659 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.13 s.
Mon Jul 04 16:53:31.676 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:53:31.679 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.02 s.
Mon Jul 04 16:53:31.857 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.18 s.
Mon Jul 04 16:53:31.860 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:53:31.862 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:53:31.865 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:53:31.867 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:53:31.871 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:53:31.874 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:53:31.876 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:53:31.879 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:53:31.881 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]
Mon Jul 04 16:53:31.884 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:53:31.886 CEST 2022: RMSD noise: 29500201.159 (-2.040/-2.539)
Mon Jul 04 16:53:31.889 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:53:31.891 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:53:31.895 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:53:31.919 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:53:32.033 CEST 2022: Number of Peaks: (126, 12)
Mon Jul 04 16:53:32.036 CEST 2022: Elapsed time for evaluation (PP Suite): 0.11 s.
Mon Jul 04 16:53:32.039 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:53:32.207 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.17 s.
Mon Jul 04 16:53:32.211 CEST 2022: Signal-to-Noise ratio: 34044.14 (1.063 ppm)
Mon Jul 04 16:53:32.214 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:53:32.216 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:53:32.219 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.56 s.
Mon Jul 04 16:53:32.245 CEST 2022: Number of Multiplets: 148
Mon Jul 04 16:53:32.247 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 16:53:32.640 CEST 2022: Number of Peak Cluster: 24
Mon Jul 04 16:53:32.651 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.40 s.
Mon Jul 04 16:53:32.672 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:53:32.847 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.17 s.
Mon Jul 04 16:53:32.864 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 16:53:32.869 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:53:32.873 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 16:53:32.875 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:53:32.878 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:53:33.006 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.13 s.
Mon Jul 04 16:53:33.155 CEST 2022: Elapsed time for evaluation (IN Suite): 0.14 s.
Mon Jul 04 16:53:33.202 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:53:33.536 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.38 s.
Mon Jul 04 16:53:33.539 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:53:33.542 CEST 2022: CMC-q finished in 2.13 s.
