Mon Jul 04 16:49:19.335 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:49:19.337 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\D10_OS_Plate05_D10\1\pdata\1
Mon Jul 04 16:49:19.345 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:49:19.349 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:49:19.352 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:49:19.391 CEST 2022: No HSQC data available
Mon Jul 04 16:49:19.407 CEST 2022: No C13 data available
Mon Jul 04 16:49:19.418 CEST 2022: No HMBC data available
Mon Jul 04 16:49:19.426 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:49:19.448 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:49:19.571 CEST 2022: Structure is used: true
Mon Jul 04 16:49:19.575 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/D10_OS_Plate05_D10/1/10_OS_Plate05_D10.mol
Mon Jul 04 16:49:19.577 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.13 s.
Mon Jul 04 16:49:19.589 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:49:19.591 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:49:19.594 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:49:19.597 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:49:19.599 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:49:19.601 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:49:19.604 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:49:19.608 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:49:19.610 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:49:19.613 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:49:19.616 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:49:19.618 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 16:49:19.620 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:49:19.622 CEST 2022: RMSD noise: 27193403.241 (12.668/12.168)
Mon Jul 04 16:49:19.625 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:49:19.628 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:49:19.631 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:49:19.655 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:49:19.747 CEST 2022: Number of Peaks: (73, 14)
Mon Jul 04 16:49:19.772 CEST 2022: Elapsed time for evaluation (PP Suite): 0.11 s.
Mon Jul 04 16:49:19.775 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:49:19.788 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Mon Jul 04 16:49:19.791 CEST 2022: Signal-to-Noise ratio: 7190.09 (7.314 ppm)
Mon Jul 04 16:49:19.794 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:49:19.796 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:49:19.799 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.22 s.
Mon Jul 04 16:49:19.813 CEST 2022: Number of Multiplets: 96
Mon Jul 04 16:49:19.816 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:49:20.018 CEST 2022: Number of Peak Cluster: 24
Mon Jul 04 16:49:20.025 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.21 s.
Mon Jul 04 16:49:20.032 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:49:20.174 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.14 s.
Mon Jul 04 16:49:20.181 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:49:20.186 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:49:20.189 CEST 2022: Number of consistent PNS: 1
Mon Jul 04 16:49:20.191 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:49:20.194 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:49:20.285 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.09 s.
Mon Jul 04 16:49:20.348 CEST 2022: Elapsed time for evaluation (IN Suite): 0.06 s.
Mon Jul 04 16:49:20.399 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:49:20.758 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.41 s.
Mon Jul 04 16:49:20.761 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:49:20.764 CEST 2022: CMC-q finished in 1.43 s.
