Mon Jul 04 16:18:03.356 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:18:03.358 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\E8_OS_Plate09_E8\1\pdata\1
Mon Jul 04 16:18:03.365 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:18:03.369 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:18:03.372 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:18:03.428 CEST 2022: No HSQC data available
Mon Jul 04 16:18:03.440 CEST 2022: No C13 data available
Mon Jul 04 16:18:03.454 CEST 2022: No HMBC data available
Mon Jul 04 16:18:03.489 CEST 2022: Elapsed time for evaluation (XD Suite): 0.03 s.
Mon Jul 04 16:18:03.506 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.01 s.
Mon Jul 04 16:18:03.681 CEST 2022: Structure is used: true
Mon Jul 04 16:18:03.718 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/E8_OS_Plate09_E8/1/E8_OS_Plate9_E8-4fbc9bf0-beb9-4e77-a4f0-7d3cac687325.mol
Mon Jul 04 16:18:03.720 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.21 s.
Mon Jul 04 16:18:03.729 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:18:03.731 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:18:03.734 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:18:03.737 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:18:03.740 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:18:03.742 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:18:03.745 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:18:03.750 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:18:03.752 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:18:03.756 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:18:03.758 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:18:03.761 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 16:18:03.763 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:18:03.765 CEST 2022: RMSD noise: 28489087.382 (-2.860/-3.359)
Mon Jul 04 16:18:03.768 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:18:03.771 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:18:03.775 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:18:03.799 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:18:03.890 CEST 2022: Number of Peaks: (84, 18)
Mon Jul 04 16:18:03.893 CEST 2022: Elapsed time for evaluation (PP Suite): 0.09 s.
Mon Jul 04 16:18:03.896 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:18:03.904 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Mon Jul 04 16:18:03.906 CEST 2022: Signal-to-Noise ratio: 4511.65 (2.891 ppm)
Mon Jul 04 16:18:03.909 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:18:03.911 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:18:03.914 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.19 s.
Mon Jul 04 16:18:03.929 CEST 2022: Number of Multiplets: 107
Mon Jul 04 16:18:03.932 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:18:03.985 CEST 2022: Number of Peak Cluster: 35
Mon Jul 04 16:18:03.991 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Mon Jul 04 16:18:03.997 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:18:04.153 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.15 s.
Mon Jul 04 16:18:04.181 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 16:18:04.186 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:18:04.191 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 16:18:04.193 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:18:04.196 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:18:04.246 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.05 s.
Mon Jul 04 16:18:04.446 CEST 2022: Elapsed time for evaluation (IN Suite): 0.20 s.
Mon Jul 04 16:18:04.742 CEST 2022: Elapsed time for evaluation (BU Suite): 0.29 s.
Mon Jul 04 16:18:04.838 CEST 2022: CMC-assist project state: AutoInconsistent
Mon Jul 04 16:18:04.841 CEST 2022: INCONSISTENT: Only invalid AssignmentSolutions.
Mon Jul 04 16:18:05.191 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.45 s.
Mon Jul 04 16:18:05.194 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:18:05.196 CEST 2022: CMC-q finished in 1.84 s.
