Mon Jul 04 16:49:17.608 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:49:17.611 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\C10_OS_Plate05_C10\1\pdata\1
Mon Jul 04 16:49:17.619 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:49:17.623 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:49:17.626 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:49:17.650 CEST 2022: No HSQC data available
Mon Jul 04 16:49:17.663 CEST 2022: No C13 data available
Mon Jul 04 16:49:17.676 CEST 2022: No HMBC data available
Mon Jul 04 16:49:17.685 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:49:17.710 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:49:17.881 CEST 2022: Structure is used: true
Mon Jul 04 16:49:17.913 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/C10_OS_Plate05_C10/1/10_OS_Plate05_C10.mol
Mon Jul 04 16:49:17.916 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.20 s.
Mon Jul 04 16:49:17.927 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:49:17.930 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:49:17.933 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:49:17.935 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:49:17.938 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:49:17.940 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:49:17.943 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:49:17.947 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:49:17.949 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:49:17.953 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:49:17.955 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:49:17.957 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 16:49:17.960 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:49:17.962 CEST 2022: RMSD noise: 31726202.048 (-0.405/-0.905)
Mon Jul 04 16:49:17.965 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:49:17.968 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:49:17.972 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:49:17.996 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:49:18.096 CEST 2022: Number of Peaks: (90, 25)
Mon Jul 04 16:49:18.099 CEST 2022: Elapsed time for evaluation (PP Suite): 0.10 s.
Mon Jul 04 16:49:18.101 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:49:18.124 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.02 s.
Mon Jul 04 16:49:18.127 CEST 2022: Signal-to-Noise ratio: 4248.57 (1.015 ppm)
Mon Jul 04 16:49:18.130 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:49:18.132 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:49:18.135 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.22 s.
Mon Jul 04 16:49:18.154 CEST 2022: Number of Multiplets: 114
Mon Jul 04 16:49:18.157 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:49:18.219 CEST 2022: Number of Peak Cluster: 37
Mon Jul 04 16:49:18.225 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.07 s.
Mon Jul 04 16:49:18.232 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:49:18.397 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.16 s.
Mon Jul 04 16:49:18.411 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 16:49:18.417 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:49:18.422 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 16:49:18.424 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:49:18.427 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:49:18.476 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.03 s.
Mon Jul 04 16:49:18.651 CEST 2022: Elapsed time for evaluation (IN Suite): 0.17 s.
Mon Jul 04 16:49:18.704 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:49:19.073 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 16:49:19.076 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:49:19.079 CEST 2022: CMC-q finished in 1.47 s.
