Mon Jul 04 16:23:13.431 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:23:13.434 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\A10_OS_Plate011_A10\1\pdata\1
Mon Jul 04 16:23:13.441 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:23:13.445 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:23:13.448 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:23:13.478 CEST 2022: No HSQC data available
Mon Jul 04 16:23:13.492 CEST 2022: No C13 data available
Mon Jul 04 16:23:13.505 CEST 2022: No HMBC data available
Mon Jul 04 16:23:13.513 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:23:13.538 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:23:13.713 CEST 2022: Structure is used: true
Mon Jul 04 16:23:13.716 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/A10_OS_Plate011_A10/1/A10_OS_Plate11_A10-0807782b-705b-4970-89e6-7ed1745c2fe7.mol
Mon Jul 04 16:23:13.719 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.15 s.
Mon Jul 04 16:23:13.731 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:23:13.733 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:23:13.736 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:23:13.739 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:23:13.741 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:23:13.743 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:23:13.746 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:23:13.750 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:23:13.752 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:23:13.756 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:23:13.758 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:23:13.760 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 16:23:13.763 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:23:13.765 CEST 2022: RMSD noise: 31158120.370 (11.034/10.534)
Mon Jul 04 16:23:13.767 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:23:13.770 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:23:13.774 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:23:13.798 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:23:13.894 CEST 2022: Number of Peaks: (91, 16)
Mon Jul 04 16:23:13.897 CEST 2022: Elapsed time for evaluation (PP Suite): 0.10 s.
Mon Jul 04 16:23:13.899 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:23:14.221 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.32 s.
Mon Jul 04 16:23:14.224 CEST 2022: Signal-to-Noise ratio: 5105.32 (2.184 ppm)
Mon Jul 04 16:23:14.227 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:23:14.233 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:23:14.235 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.51 s.
Mon Jul 04 16:23:14.255 CEST 2022: Number of Multiplets: 114
Mon Jul 04 16:23:14.258 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:23:14.301 CEST 2022: Number of Peak Cluster: 23
Mon Jul 04 16:23:14.307 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.05 s.
Mon Jul 04 16:23:14.313 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:23:14.491 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.18 s.
Mon Jul 04 16:23:14.512 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:23:14.516 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:23:14.520 CEST 2022: Number of consistent PNS: 2
Mon Jul 04 16:23:14.522 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:23:14.525 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:23:14.550 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Mon Jul 04 16:23:14.863 CEST 2022: Elapsed time for evaluation (IN Suite): 0.31 s.
Mon Jul 04 16:23:14.916 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:23:15.297 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.43 s.
Mon Jul 04 16:23:15.300 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:23:15.302 CEST 2022: CMC-q finished in 1.87 s.
