Mon Jul 04 16:31:50.291 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:31:50.293 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\A7_OS_Plate02_A7\1\pdata\1
Mon Jul 04 16:31:50.300 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:31:50.303 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:31:50.306 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:31:50.322 CEST 2022: No HSQC data available
Mon Jul 04 16:31:50.333 CEST 2022: No C13 data available
Mon Jul 04 16:31:50.344 CEST 2022: No HMBC data available
Mon Jul 04 16:31:50.352 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:31:50.372 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:31:50.465 CEST 2022: Structure is used: true
Mon Jul 04 16:31:50.484 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/A7_OS_Plate02_A7/1/A7_OS_Plate02_A7-2f04c086-cb60-4233-b15e-69fb6c6a05e3.mol
Mon Jul 04 16:31:50.486 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.11 s.
Mon Jul 04 16:31:50.499 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:31:50.502 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:31:50.505 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:31:50.507 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:31:50.509 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:31:50.512 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:31:50.514 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:31:50.518 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:31:50.521 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:31:50.524 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:31:50.526 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:31:50.528 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 16:31:50.530 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:31:50.533 CEST 2022: RMSD noise: 29864017.108 (12.669/12.169)
Mon Jul 04 16:31:50.535 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:31:50.538 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:31:50.542 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:31:50.566 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:31:50.666 CEST 2022: Number of Peaks: (98, 9)
Mon Jul 04 16:31:50.669 CEST 2022: Elapsed time for evaluation (PP Suite): 0.10 s.
Mon Jul 04 16:31:50.672 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:31:50.685 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Mon Jul 04 16:31:50.688 CEST 2022: Signal-to-Noise ratio: 2006.37 (6.671 ppm)
Mon Jul 04 16:31:50.691 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:31:50.693 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:31:50.696 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.21 s.
Mon Jul 04 16:31:50.722 CEST 2022: Number of Multiplets: 161
Mon Jul 04 16:31:50.724 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 16:31:50.781 CEST 2022: Number of Peak Cluster: 33
Mon Jul 04 16:31:50.787 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Mon Jul 04 16:31:50.806 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 16:31:50.953 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.14 s.
Mon Jul 04 16:31:50.973 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:31:50.977 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:31:50.981 CEST 2022: Number of consistent PNS: 6
Mon Jul 04 16:31:50.984 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:31:50.987 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:31:51.171 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.18 s.
Mon Jul 04 16:31:51.237 CEST 2022: Elapsed time for evaluation (IN Suite): 0.06 s.
Mon Jul 04 16:31:51.283 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:31:51.286 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 16:31:51.636 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.40 s.
Mon Jul 04 16:31:51.639 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:31:51.641 CEST 2022: CMC-q finished in 1.35 s.
