Mon Jul 04 16:16:37.446 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:16:37.449 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\C5_OS_Plate09_C5\1\pdata\1
Mon Jul 04 16:16:37.456 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:16:37.460 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:16:37.462 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:16:37.525 CEST 2022: No HSQC data available
Mon Jul 04 16:16:37.536 CEST 2022: No C13 data available
Mon Jul 04 16:16:37.547 CEST 2022: No HMBC data available
Mon Jul 04 16:16:37.554 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:16:37.577 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:16:37.702 CEST 2022: Structure is used: true
Mon Jul 04 16:16:37.705 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/C5_OS_Plate09_C5/1/C5_OS_Plate9_C5-23a61c07-9784-4915-abde-0b9db0dac0d1.mol
Mon Jul 04 16:16:37.707 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.13 s.
Mon Jul 04 16:16:37.718 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:16:37.721 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:16:37.724 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:16:37.726 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:16:37.728 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:16:37.731 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:16:37.733 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:16:37.738 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:16:37.740 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:16:37.743 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:16:37.745 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:16:37.748 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 16:16:37.750 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:16:37.752 CEST 2022: RMSD noise: 30158811.659 (7.766/7.266)
Mon Jul 04 16:16:37.755 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:16:37.758 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:16:37.762 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:16:37.785 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:16:37.888 CEST 2022: Number of Peaks: (84, 15)
Mon Jul 04 16:16:37.913 CEST 2022: Elapsed time for evaluation (PP Suite): 0.12 s.
Mon Jul 04 16:16:37.915 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:16:37.969 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.05 s.
Mon Jul 04 16:16:37.973 CEST 2022: Signal-to-Noise ratio: 1159.79 (1.605 ppm)
Mon Jul 04 16:16:37.976 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:16:37.979 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:16:37.981 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.27 s.
Mon Jul 04 16:16:38.005 CEST 2022: Number of Multiplets: 123
Mon Jul 04 16:16:38.007 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:16:38.060 CEST 2022: Number of Peak Cluster: 27
Mon Jul 04 16:16:38.066 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Mon Jul 04 16:16:38.083 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:16:38.226 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.14 s.
Mon Jul 04 16:16:38.231 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:16:38.236 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:16:38.240 CEST 2022: Number of consistent PNS: 2
Mon Jul 04 16:16:38.242 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:16:38.248 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:16:38.286 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.04 s.
Mon Jul 04 16:16:38.744 CEST 2022: Elapsed time for evaluation (IN Suite): 0.46 s.
Mon Jul 04 16:16:38.799 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:16:39.144 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.40 s.
Mon Jul 04 16:16:39.147 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:16:39.149 CEST 2022: CMC-q finished in 1.70 s.
