Mon Jul 04 16:28:23.584 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:28:23.586 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\D10_OS_Plate012_D10\1\pdata\1
Mon Jul 04 16:28:23.593 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:28:23.597 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:28:23.600 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:28:23.628 CEST 2022: No HSQC data available
Mon Jul 04 16:28:23.639 CEST 2022: No C13 data available
Mon Jul 04 16:28:23.651 CEST 2022: No HMBC data available
Mon Jul 04 16:28:23.658 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:28:23.679 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:28:23.802 CEST 2022: Structure is used: true
Mon Jul 04 16:28:23.805 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/D10_OS_Plate012_D10/1/D10_OS_Plate12_D10-d8184f1f-e111-4a85-9fd7-1f7f23a5ca25.mol
Mon Jul 04 16:28:23.807 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.13 s.
Mon Jul 04 16:28:23.819 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:28:23.821 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:28:23.824 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:28:23.826 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:28:23.829 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:28:23.831 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:28:23.833 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:28:23.838 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:28:23.840 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:28:23.843 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:28:23.845 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:28:23.848 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 16:28:23.850 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:28:23.853 CEST 2022: RMSD noise: 29926334.665 (-2.040/-2.539)
Mon Jul 04 16:28:23.855 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:28:23.858 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:28:23.862 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:28:23.885 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:28:23.986 CEST 2022: Number of Peaks: (90, 16)
Mon Jul 04 16:28:23.989 CEST 2022: Elapsed time for evaluation (PP Suite): 0.10 s.
Mon Jul 04 16:28:23.991 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:28:24.083 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.09 s.
Mon Jul 04 16:28:24.086 CEST 2022: Signal-to-Noise ratio: 827.61 (7.609 ppm)
Mon Jul 04 16:28:24.088 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:28:24.091 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:28:24.093 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.28 s.
Mon Jul 04 16:28:24.122 CEST 2022: Number of Multiplets: 156
Mon Jul 04 16:28:24.125 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 16:28:24.163 CEST 2022: Number of Peak Cluster: 16
Mon Jul 04 16:28:24.184 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Mon Jul 04 16:28:24.188 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:28:24.312 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.12 s.
Mon Jul 04 16:28:24.324 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 16:28:24.328 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:28:24.332 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 16:28:24.334 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:28:24.337 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:28:24.414 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.07 s.
Mon Jul 04 16:28:24.641 CEST 2022: Elapsed time for evaluation (IN Suite): 0.22 s.
Mon Jul 04 16:28:24.691 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:28:25.039 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.40 s.
Mon Jul 04 16:28:25.042 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:28:25.045 CEST 2022: CMC-q finished in 1.46 s.
