Mon Jul 04 16:11:41.934 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:11:41.937 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\F5_OS_Plate01_F5\1\pdata\1
Mon Jul 04 16:11:41.944 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:11:41.948 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:11:41.951 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:11:42.015 CEST 2022: No HSQC data available
Mon Jul 04 16:11:42.027 CEST 2022: No C13 data available
Mon Jul 04 16:11:42.039 CEST 2022: No HMBC data available
Mon Jul 04 16:11:42.052 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:11:42.070 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.01 s.
Mon Jul 04 16:11:42.184 CEST 2022: Structure is used: true
Mon Jul 04 16:11:42.187 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/F5_OS_Plate01_F5/1/F5_OS_Plate1_F5-487e7d55-8647-4dcd-b9d8-a63862ba928b.mol
Mon Jul 04 16:11:42.190 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.12 s.
Mon Jul 04 16:11:42.196 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:11:42.199 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:11:42.202 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:11:42.205 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:11:42.207 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:11:42.210 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:11:42.212 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:11:42.216 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:11:42.219 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:11:42.222 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:11:42.224 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:11:42.226 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 16:11:42.229 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:11:42.231 CEST 2022: RMSD noise: 30831366.845 (12.669/12.169)
Mon Jul 04 16:11:42.234 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:11:42.236 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:11:42.240 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:11:42.264 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:11:42.351 CEST 2022: Number of Peaks: (76, 9)
Mon Jul 04 16:11:42.354 CEST 2022: Elapsed time for evaluation (PP Suite): 0.09 s.
Mon Jul 04 16:11:42.357 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:11:42.424 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.06 s.
Mon Jul 04 16:11:42.427 CEST 2022: Signal-to-Noise ratio: 5913.59 (2.053 ppm)
Mon Jul 04 16:11:42.430 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:11:42.432 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:11:42.435 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.24 s.
Mon Jul 04 16:11:42.448 CEST 2022: Number of Multiplets: 101
Mon Jul 04 16:11:42.451 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.01 s.
Mon Jul 04 16:11:42.523 CEST 2022: Number of Peak Cluster: 44
Mon Jul 04 16:11:42.551 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.10 s.
Mon Jul 04 16:11:42.562 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:11:42.695 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.13 s.
Mon Jul 04 16:11:42.701 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:11:42.706 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:11:42.710 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 16:11:42.713 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:11:42.715 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:11:42.736 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Mon Jul 04 16:11:42.788 CEST 2022: Elapsed time for evaluation (IN Suite): 0.05 s.
Mon Jul 04 16:11:42.839 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:11:43.198 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.41 s.
Mon Jul 04 16:11:43.201 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:11:43.204 CEST 2022: CMC-q finished in 1.27 s.
