Mon Jul 04 16:33:02.595 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:33:02.598 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G10_OS_Plate02_G10\1\pdata\1
Mon Jul 04 16:33:02.605 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:33:02.609 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:33:02.612 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:33:02.635 CEST 2022: No HSQC data available
Mon Jul 04 16:33:02.647 CEST 2022: No C13 data available
Mon Jul 04 16:33:02.659 CEST 2022: No HMBC data available
Mon Jul 04 16:33:02.670 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:33:02.703 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:33:02.818 CEST 2022: Structure is used: true
Mon Jul 04 16:33:02.821 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G10_OS_Plate02_G10/1/G10_OS_Plate02_G10-147bd12b-c4e2-4147-9c41-57ba40404d95.mol
Mon Jul 04 16:33:02.824 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.12 s.
Mon Jul 04 16:33:02.831 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:33:02.833 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:33:02.837 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:33:02.839 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:33:02.842 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:33:02.844 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:33:02.847 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:33:02.852 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:33:02.854 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:33:02.857 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:33:02.860 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:33:02.862 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 16:33:02.865 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:33:02.867 CEST 2022: RMSD noise: 31383025.811 (11.851/11.352)
Mon Jul 04 16:33:02.870 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:33:02.873 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:33:02.877 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:33:02.901 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:33:02.994 CEST 2022: Number of Peaks: (60, 31)
Mon Jul 04 16:33:02.997 CEST 2022: Elapsed time for evaluation (PP Suite): 0.09 s.
Mon Jul 04 16:33:03.000 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:33:03.016 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Mon Jul 04 16:33:03.019 CEST 2022: Signal-to-Noise ratio: 2326.64 (2.343 ppm)
Mon Jul 04 16:33:03.022 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:33:03.025 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:33:03.027 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.20 s.
Mon Jul 04 16:33:03.046 CEST 2022: Number of Multiplets: 118
Mon Jul 04 16:33:03.049 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:33:03.083 CEST 2022: Number of Peak Cluster: 16
Mon Jul 04 16:33:03.089 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.04 s.
Mon Jul 04 16:33:03.110 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 16:33:03.231 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.12 s.
Mon Jul 04 16:33:03.254 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:33:03.258 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:33:03.261 CEST 2022: Number of consistent PNS: 1
Mon Jul 04 16:33:03.264 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:33:03.269 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:33:03.295 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Mon Jul 04 16:33:03.811 CEST 2022: Elapsed time for evaluation (IN Suite): 0.51 s.
Mon Jul 04 16:33:03.861 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:33:04.230 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 16:33:04.233 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:33:04.236 CEST 2022: CMC-q finished in 1.64 s.
