Mon Jul 04 19:39:31.509 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:39:31.513 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\F8_EUOS_Plate08_F8\1\pdata\1
Mon Jul 04 19:39:31.520 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:39:31.523 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:39:31.526 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:39:32.485 CEST 2022: No HSQC data available
Mon Jul 04 19:39:32.500 CEST 2022: No C13 data available
Mon Jul 04 19:39:32.513 CEST 2022: No HMBC data available
Mon Jul 04 19:39:32.520 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 19:39:36.674 CEST 2022: Elapsed time for evaluation (SPD Suite): 4.15 s.
Mon Jul 04 19:39:36.795 CEST 2022: Structure is used: true
Mon Jul 04 19:39:36.798 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/F8_EUOS_Plate08_F8/1/F8_EUOS_Plate08_F8-a93ff06c-66e9-40bc-ae32-9f9ed540908e.mol
Mon Jul 04 19:39:36.801 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.12 s.
Mon Jul 04 19:39:36.808 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:39:36.810 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:39:36.813 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:39:36.816 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:39:36.818 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:39:36.821 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:39:36.824 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:39:36.828 CEST 2022: Suppression frequencies at: 4.769 
Mon Jul 04 19:39:36.831 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:39:36.834 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:39:36.836 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:39:36.838 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 19:39:36.841 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 19:39:36.843 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:39:36.846 CEST 2022: RMSD noise: 19853111.659 (-0.177/-0.677)
Mon Jul 04 19:39:36.848 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:39:36.852 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:39:36.856 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:39:36.881 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:39:37.117 CEST 2022: Number of Peaks: (217, 34)
Mon Jul 04 19:39:37.136 CEST 2022: Elapsed time for evaluation (PP Suite): 0.25 s.
Mon Jul 04 19:39:37.139 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:39:37.177 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.04 s.
Mon Jul 04 19:39:37.180 CEST 2022: Signal-to-Noise ratio: 44566.89 (0.982 ppm)
Mon Jul 04 19:39:37.183 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:39:37.186 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:39:37.188 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.38 s.
Mon Jul 04 19:39:37.324 CEST 2022: Number of Multiplets: 376
Mon Jul 04 19:39:37.328 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.14 s.
Mon Jul 04 19:39:37.448 CEST 2022: Number of Peak Cluster: 40
Mon Jul 04 19:39:37.455 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.12 s.
Mon Jul 04 19:39:37.478 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 19:39:37.792 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.31 s.
Mon Jul 04 19:39:37.816 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.02 s.
Mon Jul 04 19:39:37.823 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:39:37.829 CEST 2022: Number of consistent PNS: 3
Mon Jul 04 19:39:37.832 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 19:39:37.849 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.01 s.
Mon Jul 04 19:39:37.897 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.04 s.
Mon Jul 04 19:39:39.072 CEST 2022: Elapsed time for evaluation (IN Suite): 1.17 s.
Mon Jul 04 19:39:39.129 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 19:39:39.133 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:39:39.507 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.43 s.
Mon Jul 04 19:39:39.510 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:39:39.513 CEST 2022: CMC-q finished in 8.00 s.
