Mon Jul 04 16:13:08.479 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:13:08.485 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\C9_OS_Plate01_C9\1\pdata\1
Mon Jul 04 16:13:08.493 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:13:08.496 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:13:08.499 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:13:08.574 CEST 2022: No HSQC data available
Mon Jul 04 16:13:08.584 CEST 2022: No C13 data available
Mon Jul 04 16:13:08.594 CEST 2022: No HMBC data available
Mon Jul 04 16:13:08.601 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:13:08.623 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:13:08.703 CEST 2022: Structure is used: true
Mon Jul 04 16:13:08.706 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/C9_OS_Plate01_C9/1/C9_OS_Plate1_C9-934782cc-8a69-457f-875f-3b73fcae7580.mol
Mon Jul 04 16:13:08.708 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.08 s.
Mon Jul 04 16:13:08.719 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:13:08.722 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:13:08.725 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:13:08.727 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:13:08.729 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:13:08.732 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:13:08.734 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:13:08.738 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:13:08.741 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:13:08.744 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:13:08.746 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:13:08.748 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 16:13:08.751 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:13:08.753 CEST 2022: RMSD noise: 31589993.356 (6.132/5.632)
Mon Jul 04 16:13:08.755 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:13:08.758 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:13:08.762 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:13:08.786 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:13:08.864 CEST 2022: Number of Peaks: (66, 2)
Mon Jul 04 16:13:08.867 CEST 2022: Elapsed time for evaluation (PP Suite): 0.08 s.
Mon Jul 04 16:13:08.870 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:13:08.916 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.04 s.
Mon Jul 04 16:13:08.919 CEST 2022: Signal-to-Noise ratio: 5274.43 (3.300 ppm)
Mon Jul 04 16:13:08.922 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:13:08.924 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:13:08.926 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.22 s.
Mon Jul 04 16:13:08.945 CEST 2022: Number of Multiplets: 105
Mon Jul 04 16:13:08.948 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:13:08.989 CEST 2022: Number of Peak Cluster: 26
Mon Jul 04 16:13:08.995 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.05 s.
Mon Jul 04 16:13:09.009 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:13:09.143 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.13 s.
Mon Jul 04 16:13:09.151 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:13:09.156 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:13:09.159 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 16:13:09.161 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:13:09.164 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:13:09.244 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.08 s.
Mon Jul 04 16:13:09.279 CEST 2022: Elapsed time for evaluation (IN Suite): 0.00 s.
Mon Jul 04 16:13:09.329 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:13:09.668 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.39 s.
Mon Jul 04 16:13:09.671 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:13:09.673 CEST 2022: CMC-q finished in 1.19 s.
