Mon Jul 04 16:13:50.320 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:13:50.323 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\F10_OS_Plate01_F10\1\pdata\1
Mon Jul 04 16:13:50.330 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:13:50.334 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:13:50.337 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:13:50.375 CEST 2022: No HSQC data available
Mon Jul 04 16:13:50.387 CEST 2022: No C13 data available
Mon Jul 04 16:13:50.397 CEST 2022: No HMBC data available
Mon Jul 04 16:13:50.404 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:13:50.422 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:13:50.525 CEST 2022: Structure is used: true
Mon Jul 04 16:13:50.544 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/F10_OS_Plate01_F10/1/F10_OS_Plate1_F10-39db9e06-6fc4-4469-a290-13e1c93c093d.mol
Mon Jul 04 16:13:50.546 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.12 s.
Mon Jul 04 16:13:50.552 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:13:50.555 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:13:50.558 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:13:50.561 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:13:50.563 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:13:50.565 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:13:50.568 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:13:50.572 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:13:50.575 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:13:50.578 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:13:50.580 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:13:50.582 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 16:13:50.585 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:13:50.587 CEST 2022: RMSD noise: 30845311.945 (11.851/11.352)
Mon Jul 04 16:13:50.589 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:13:50.592 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:13:50.596 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:13:50.619 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:13:50.699 CEST 2022: Number of Peaks: (67, 7)
Mon Jul 04 16:13:50.703 CEST 2022: Elapsed time for evaluation (PP Suite): 0.08 s.
Mon Jul 04 16:13:50.705 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:13:50.758 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.05 s.
Mon Jul 04 16:13:50.761 CEST 2022: Signal-to-Noise ratio: 3972.19 (7.314 ppm)
Mon Jul 04 16:13:50.764 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:13:50.767 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:13:50.769 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.22 s.
Mon Jul 04 16:13:50.783 CEST 2022: Number of Multiplets: 105
Mon Jul 04 16:13:50.785 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.01 s.
Mon Jul 04 16:13:50.836 CEST 2022: Number of Peak Cluster: 33
Mon Jul 04 16:13:50.842 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.05 s.
Mon Jul 04 16:13:50.855 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:13:50.979 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.12 s.
Mon Jul 04 16:13:50.984 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:13:50.989 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:13:50.992 CEST 2022: Number of consistent PNS: 2
Mon Jul 04 16:13:50.995 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:13:50.997 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:13:51.082 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.08 s.
Mon Jul 04 16:13:51.163 CEST 2022: Elapsed time for evaluation (IN Suite): 0.08 s.
Mon Jul 04 16:13:51.212 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:13:51.591 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Mon Jul 04 16:13:51.594 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:13:51.597 CEST 2022: CMC-q finished in 1.28 s.
