Mon Jul 04 19:41:48.363 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:41:48.365 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\D11_EUOS_Plate08_D11\1\pdata\1
Mon Jul 04 19:41:48.372 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:41:48.376 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:41:48.378 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:41:48.414 CEST 2022: No HSQC data available
Mon Jul 04 19:41:48.426 CEST 2022: No C13 data available
Mon Jul 04 19:41:48.437 CEST 2022: No HMBC data available
Mon Jul 04 19:41:48.445 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 19:41:48.463 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 19:41:48.539 CEST 2022: Structure is used: true
Mon Jul 04 19:41:48.542 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/D11_EUOS_Plate08_D11/1/D11_EUOS_Plate08_D11-5d79c9ee-0d16-4ebe-8fe7-745b4f56532d.mol
Mon Jul 04 19:41:48.545 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.08 s.
Mon Jul 04 19:41:48.551 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:41:48.554 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:41:48.557 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:41:48.559 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:41:48.561 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:41:48.564 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:41:48.566 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:41:48.571 CEST 2022: Suppression frequencies at: 4.770 
Mon Jul 04 19:41:48.573 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:41:48.577 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:41:48.580 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:41:48.582 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DMSO, protonShiftLimitAPpm=2.7, protonShiftLimitBPpm=2.66, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Mon Jul 04 19:41:48.584 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DSS, protonShiftLimitAPpm=-0.01, protonShiftLimitBPpm=0.01, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Mon Jul 04 19:41:48.587 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:41:48.589 CEST 2022: RMSD noise: 19022521.370 (-0.176/-0.676)
Mon Jul 04 19:41:48.592 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:41:48.595 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:41:48.599 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:41:48.624 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:41:48.738 CEST 2022: Number of Peaks: (105, 3)
Mon Jul 04 19:41:48.765 CEST 2022: Elapsed time for evaluation (PP Suite): 0.14 s.
Mon Jul 04 19:41:48.768 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:41:48.826 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.06 s.
Mon Jul 04 19:41:48.829 CEST 2022: Signal-to-Noise ratio: 7749.15 (4.099 ppm)
Mon Jul 04 19:41:48.832 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:41:48.835 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:41:48.837 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.29 s.
Mon Jul 04 19:41:48.865 CEST 2022: Number of Multiplets: 177
Mon Jul 04 19:41:48.868 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 19:41:48.941 CEST 2022: Number of Peak Cluster: 35
Mon Jul 04 19:41:48.947 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.08 s.
Mon Jul 04 19:41:48.965 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 19:41:49.126 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.16 s.
Mon Jul 04 19:41:49.142 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 19:41:49.148 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:41:49.151 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 19:41:49.154 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 19:41:49.157 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:41:49.183 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Mon Jul 04 19:41:49.192 CEST 2022: Elapsed time for evaluation (IN Suite): 0.01 s.
Mon Jul 04 19:41:49.247 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 19:41:49.250 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:41:49.616 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 19:41:49.620 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:41:49.622 CEST 2022: CMC-q finished in 1.26 s.
