Mon Jul 04 16:52:21.565 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:52:21.568 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\C7_OS_Plate06_C7\1\pdata\1
Mon Jul 04 16:52:21.575 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:52:21.579 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:52:21.581 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:52:21.745 CEST 2022: No HSQC data available
Mon Jul 04 16:52:21.756 CEST 2022: No C13 data available
Mon Jul 04 16:52:21.766 CEST 2022: No HMBC data available
Mon Jul 04 16:52:21.782 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:52:22.438 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.65 s.
Mon Jul 04 16:52:22.520 CEST 2022: Structure is used: true
Mon Jul 04 16:52:22.545 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/C7_OS_Plate06_C7/1/C7_OS_Plate06_C7-3a30f7ba-e640-4195-9d41-799be2402be6.mol
Mon Jul 04 16:52:22.547 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.11 s.
Mon Jul 04 16:52:23.207 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:52:23.210 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.66 s.
Mon Jul 04 16:52:23.213 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:52:23.215 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:52:23.218 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:52:23.220 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:52:23.223 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:52:23.227 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:52:23.229 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:52:23.232 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:52:23.235 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:52:23.237 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 16:52:23.239 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:52:23.241 CEST 2022: RMSD noise: 31062694.803 (6.132/5.632)
Mon Jul 04 16:52:23.243 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:52:23.246 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:52:23.249 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:52:23.274 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:52:23.351 CEST 2022: Number of Peaks: (66, 10)
Mon Jul 04 16:52:23.354 CEST 2022: Elapsed time for evaluation (PP Suite): 0.08 s.
Mon Jul 04 16:52:23.357 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:52:23.384 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.03 s.
Mon Jul 04 16:52:23.387 CEST 2022: Signal-to-Noise ratio: 422.41 (7.527 ppm)
Mon Jul 04 16:52:23.390 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:52:23.392 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:52:23.394 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.84 s.
Mon Jul 04 16:52:23.408 CEST 2022: Number of Multiplets: 87
Mon Jul 04 16:52:23.411 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.01 s.
Mon Jul 04 16:52:23.591 CEST 2022: Number of Peak Cluster: 32
Mon Jul 04 16:52:23.596 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.18 s.
Mon Jul 04 16:52:23.608 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:52:23.743 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.13 s.
Mon Jul 04 16:52:23.760 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:52:23.764 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:52:23.768 CEST 2022: Number of consistent PNS: 2
Mon Jul 04 16:52:23.770 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:52:23.772 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:52:23.791 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Mon Jul 04 16:52:23.854 CEST 2022: Elapsed time for evaluation (IN Suite): 0.06 s.
Mon Jul 04 16:52:23.904 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:52:24.249 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.39 s.
Mon Jul 04 16:52:24.252 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:52:24.255 CEST 2022: CMC-q finished in 2.69 s.
