Mon Jul 04 16:40:04.388 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:40:04.391 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\D1_OS_Plate04_D1\1\pdata\1
Mon Jul 04 16:40:04.398 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:40:04.402 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:40:04.405 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:40:04.432 CEST 2022: No HSQC data available
Mon Jul 04 16:40:04.442 CEST 2022: No C13 data available
Mon Jul 04 16:40:04.452 CEST 2022: No HMBC data available
Mon Jul 04 16:40:04.459 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:40:04.480 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:40:04.560 CEST 2022: Structure is used: true
Mon Jul 04 16:40:04.563 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/D1_OS_Plate04_D1/1/D1_OS_Plate04_D1-6d847b04-bb05-4631-8ba2-0922bb15bd14.mol
Mon Jul 04 16:40:04.566 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.08 s.
Mon Jul 04 16:40:04.577 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:40:04.579 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:40:04.582 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:40:04.585 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:40:04.587 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:40:04.589 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:40:04.591 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:40:04.596 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:40:04.598 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:40:04.601 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:40:04.604 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:40:04.607 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 16:40:04.610 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:40:04.612 CEST 2022: RMSD noise: 28826587.193 (12.669/12.169)
Mon Jul 04 16:40:04.614 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:40:04.617 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:40:04.621 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:40:04.646 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:40:04.735 CEST 2022: Number of Peaks: (72, 9)
Mon Jul 04 16:40:04.738 CEST 2022: Elapsed time for evaluation (PP Suite): 0.09 s.
Mon Jul 04 16:40:04.741 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:40:04.754 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Mon Jul 04 16:40:04.757 CEST 2022: Signal-to-Noise ratio: 792.36 (6.860 ppm)
Mon Jul 04 16:40:04.759 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:40:04.762 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:40:04.764 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.20 s.
Mon Jul 04 16:40:04.779 CEST 2022: Number of Multiplets: 92
Mon Jul 04 16:40:04.782 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.01 s.
Mon Jul 04 16:40:04.842 CEST 2022: Number of Peak Cluster: 36
Mon Jul 04 16:40:04.867 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.08 s.
Mon Jul 04 16:40:04.876 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:40:05.014 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.13 s.
Mon Jul 04 16:40:05.019 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:40:05.024 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:40:05.029 CEST 2022: Number of consistent PNS: 5
Mon Jul 04 16:40:05.031 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:40:05.033 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:40:05.075 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.04 s.
Mon Jul 04 16:40:05.130 CEST 2022: Elapsed time for evaluation (IN Suite): 0.05 s.
Mon Jul 04 16:40:05.181 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:40:05.530 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.40 s.
Mon Jul 04 16:40:05.533 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:40:05.536 CEST 2022: CMC-q finished in 1.15 s.
