Mon Jul 04 16:23:30.687 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:23:30.690 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H10_OS_Plate011_H10\1\pdata\1
Mon Jul 04 16:23:30.697 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:23:30.701 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:23:30.704 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:23:30.809 CEST 2022: No HSQC data available
Mon Jul 04 16:23:30.822 CEST 2022: No C13 data available
Mon Jul 04 16:23:30.834 CEST 2022: No HMBC data available
Mon Jul 04 16:23:30.841 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:23:30.858 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.01 s.
Mon Jul 04 16:23:30.944 CEST 2022: Structure is used: true
Mon Jul 04 16:23:30.980 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H10_OS_Plate011_H10/1/H10_OS_Plate11_H10-560298ee-0b9f-406f-afb8-e8f89abe00b4.mol
Mon Jul 04 16:23:30.982 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.12 s.
Mon Jul 04 16:23:30.988 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:23:30.990 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:23:30.993 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:23:30.996 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:23:30.998 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:23:31.000 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:23:31.002 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:23:31.007 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:23:31.009 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:23:31.012 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:23:31.014 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:23:31.017 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 16:23:31.019 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:23:31.021 CEST 2022: RMSD noise: 29969964.179 (-2.860/-3.359)
Mon Jul 04 16:23:31.024 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:23:31.027 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:23:31.031 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:23:31.054 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:23:31.136 CEST 2022: Number of Peaks: (70, 11)
Mon Jul 04 16:23:31.139 CEST 2022: Elapsed time for evaluation (PP Suite): 0.08 s.
Mon Jul 04 16:23:31.142 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:23:31.468 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.32 s.
Mon Jul 04 16:23:31.471 CEST 2022: Signal-to-Noise ratio: 2800.57 (1.093 ppm)
Mon Jul 04 16:23:31.474 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:23:31.477 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:23:31.479 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.49 s.
Mon Jul 04 16:23:31.496 CEST 2022: Number of Multiplets: 96
Mon Jul 04 16:23:31.499 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:23:31.554 CEST 2022: Number of Peak Cluster: 23
Mon Jul 04 16:23:31.560 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Mon Jul 04 16:23:31.576 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:23:31.708 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.13 s.
Mon Jul 04 16:23:31.713 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:23:31.717 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:23:31.721 CEST 2022: Number of consistent PNS: 3
Mon Jul 04 16:23:31.724 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:23:31.727 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:23:31.736 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.01 s.
Mon Jul 04 16:23:31.869 CEST 2022: Elapsed time for evaluation (IN Suite): 0.13 s.
Mon Jul 04 16:23:31.918 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:23:32.324 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.45 s.
Mon Jul 04 16:23:32.347 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:23:32.350 CEST 2022: CMC-q finished in 1.66 s.
