Mon Jul 04 16:23:23.265 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:23:23.268 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\D10_OS_Plate011_D10\1\pdata\1
Mon Jul 04 16:23:23.275 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:23:23.279 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:23:23.282 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:23:23.314 CEST 2022: No HSQC data available
Mon Jul 04 16:23:23.327 CEST 2022: No C13 data available
Mon Jul 04 16:23:23.340 CEST 2022: No HMBC data available
Mon Jul 04 16:23:23.559 CEST 2022: Elapsed time for evaluation (XD Suite): 0.22 s.
Mon Jul 04 16:23:23.586 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:23:23.727 CEST 2022: Structure is used: true
Mon Jul 04 16:23:23.730 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/D10_OS_Plate011_D10/1/D10_OS_Plate11_D10-56637690-8759-4d25-b7e1-6f6b8667206a.mol
Mon Jul 04 16:23:23.733 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.14 s.
Mon Jul 04 16:23:23.744 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:23:23.746 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:23:23.749 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:23:23.751 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:23:23.754 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:23:23.756 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:23:23.758 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:23:23.763 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:23:23.765 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:23:23.768 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:23:23.770 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:23:23.772 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 16:23:23.775 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:23:23.777 CEST 2022: RMSD noise: 30238321.863 (6.132/5.632)
Mon Jul 04 16:23:23.780 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:23:23.783 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:23:23.787 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:23:23.810 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:23:23.908 CEST 2022: Number of Peaks: (83, 23)
Mon Jul 04 16:23:23.934 CEST 2022: Elapsed time for evaluation (PP Suite): 0.12 s.
Mon Jul 04 16:23:23.937 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:23:23.982 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.04 s.
Mon Jul 04 16:23:23.984 CEST 2022: Signal-to-Noise ratio: 3265.08 (3.777 ppm)
Mon Jul 04 16:23:23.987 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:23:23.990 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:23:23.992 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.26 s.
Mon Jul 04 16:23:24.010 CEST 2022: Number of Multiplets: 130
Mon Jul 04 16:23:24.012 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:23:24.059 CEST 2022: Number of Peak Cluster: 25
Mon Jul 04 16:23:24.065 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.05 s.
Mon Jul 04 16:23:24.071 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:23:24.230 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.16 s.
Mon Jul 04 16:23:24.237 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:23:24.242 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:23:24.247 CEST 2022: Number of consistent PNS: 7
Mon Jul 04 16:23:24.250 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 16:23:24.253 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:23:24.392 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.14 s.
Mon Jul 04 16:23:25.490 CEST 2022: Elapsed time for evaluation (IN Suite): 1.09 s.
Mon Jul 04 16:23:25.545 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:23:25.920 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 16:23:25.923 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:23:25.926 CEST 2022: CMC-q finished in 2.66 s.
