Mon Jul 04 16:51:19.687 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:51:19.689 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G4_OS_Plate06_G4\1\pdata\1
Mon Jul 04 16:51:19.697 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:51:19.700 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:51:19.703 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:51:19.745 CEST 2022: No HSQC data available
Mon Jul 04 16:51:19.756 CEST 2022: No C13 data available
Mon Jul 04 16:51:19.767 CEST 2022: No HMBC data available
Mon Jul 04 16:51:19.774 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:51:19.791 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.01 s.
Mon Jul 04 16:51:19.884 CEST 2022: Structure is used: true
Mon Jul 04 16:51:19.887 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G4_OS_Plate06_G4/1/G4_OS_Plate06_G4-5f35de3a-a240-48c2-b0ef-38e4fe74c7cf.mol
Mon Jul 04 16:51:19.889 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.10 s.
Mon Jul 04 16:51:19.915 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:51:19.917 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.03 s.
Mon Jul 04 16:51:19.920 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:51:19.922 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:51:19.925 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:51:19.927 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:51:19.929 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:51:19.933 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:51:19.936 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:51:19.939 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:51:19.941 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:51:19.944 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 16:51:19.946 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:51:19.948 CEST 2022: RMSD noise: 32414355.738 (12.669/12.169)
Mon Jul 04 16:51:19.951 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:51:19.954 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:51:19.958 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:51:19.981 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:51:20.205 CEST 2022: Number of Peaks: (198, 24)
Mon Jul 04 16:51:20.230 CEST 2022: Elapsed time for evaluation (PP Suite): 0.25 s.
Mon Jul 04 16:51:20.233 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:51:20.273 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.04 s.
Mon Jul 04 16:51:20.276 CEST 2022: Signal-to-Noise ratio: 2640.75 (2.961 ppm)
Mon Jul 04 16:51:20.279 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:51:20.281 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:51:20.284 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.39 s.
Mon Jul 04 16:51:20.419 CEST 2022: Number of Multiplets: 369
Mon Jul 04 16:51:20.422 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.14 s.
Mon Jul 04 16:51:20.779 CEST 2022: Number of Peak Cluster: 34
Mon Jul 04 16:51:20.786 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.36 s.
Mon Jul 04 16:51:20.793 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:51:21.151 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.36 s.
Mon Jul 04 16:51:21.173 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.02 s.
Mon Jul 04 16:51:21.178 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:51:21.183 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 16:51:21.185 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:51:21.188 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:51:23.558 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 2.37 s.
Mon Jul 04 16:51:26.309 CEST 2022: Elapsed time for evaluation (IN Suite): 2.75 s.
Mon Jul 04 16:51:26.359 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:51:26.362 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 16:51:26.741 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.43 s.
Mon Jul 04 16:51:26.744 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:51:26.747 CEST 2022: CMC-q finished in 7.06 s.
