Mon Jul 04 19:37:23.785 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:37:23.788 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\C5_EUOS_Plate08_C5\1\pdata\1
Mon Jul 04 19:37:23.795 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:37:23.800 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:37:23.803 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:37:23.964 CEST 2022: No HSQC data available
Mon Jul 04 19:37:23.978 CEST 2022: No C13 data available
Mon Jul 04 19:37:23.996 CEST 2022: No HMBC data available
Mon Jul 04 19:37:24.308 CEST 2022: Elapsed time for evaluation (XD Suite): 0.31 s.
Mon Jul 04 19:37:24.359 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.05 s.
Mon Jul 04 19:37:24.485 CEST 2022: Structure is used: true
Mon Jul 04 19:37:24.509 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/C5_EUOS_Plate08_C5/1/C5_EUOS_Plate08_C5-d5a228a7-9706-409f-b5b8-b343ee3270ec.mol
Mon Jul 04 19:37:24.512 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.15 s.
Mon Jul 04 19:37:24.519 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:37:24.521 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:37:24.524 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:37:24.527 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:37:24.529 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:37:24.532 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:37:24.535 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:37:24.540 CEST 2022: Suppression frequencies at: 4.769 
Mon Jul 04 19:37:24.544 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.01 s.
Mon Jul 04 19:37:24.547 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:37:24.551 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:37:24.553 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 19:37:24.556 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 19:37:24.559 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:37:24.562 CEST 2022: RMSD noise: 17937938.772 (9.523/9.023)
Mon Jul 04 19:37:24.564 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:37:24.568 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:37:24.573 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:37:24.598 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:37:24.794 CEST 2022: Number of Peaks: (193, 10)
Mon Jul 04 19:37:24.797 CEST 2022: Elapsed time for evaluation (PP Suite): 0.20 s.
Mon Jul 04 19:37:24.801 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:37:24.810 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Mon Jul 04 19:37:24.814 CEST 2022: Signal-to-Noise ratio: 6323.57 (0.809 ppm)
Mon Jul 04 19:37:24.818 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:37:24.822 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:37:24.825 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.31 s.
Mon Jul 04 19:37:24.908 CEST 2022: Number of Multiplets: 305
Mon Jul 04 19:37:24.912 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.08 s.
Mon Jul 04 19:37:25.035 CEST 2022: Number of Peak Cluster: 45
Mon Jul 04 19:37:25.043 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.13 s.
Mon Jul 04 19:37:25.053 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 19:37:25.303 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.25 s.
Mon Jul 04 19:37:25.340 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.02 s.
Mon Jul 04 19:37:25.347 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:37:25.352 CEST 2022: Number of consistent PNS: 0
Mon Jul 04 19:37:25.355 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 19:37:25.361 CEST 2022: Number of consistent PNS: 15
Mon Jul 04 19:37:25.364 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 19:37:25.372 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:37:25.375 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:37:27.933 CEST 2022: Elapsed time for evaluation (BU Suite): 2.58 s.
Mon Jul 04 19:37:27.993 CEST 2022: CMC-assist project state: AutoInconsistent
Mon Jul 04 19:37:27.996 CEST 2022: INCONSISTENT: No or only invalid ProtonNumberSolutions.
Mon Jul 04 19:37:28.342 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.41 s.
Mon Jul 04 19:37:28.346 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:37:28.349 CEST 2022: CMC-q finished in 4.57 s.
