Mon Jul 04 16:22:34.844 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:22:34.846 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G7_OS_Plate011_G7\1\pdata\1
Mon Jul 04 16:22:34.854 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:22:34.857 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:22:34.860 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:22:35.016 CEST 2022: No HSQC data available
Mon Jul 04 16:22:35.027 CEST 2022: No C13 data available
Mon Jul 04 16:22:35.038 CEST 2022: No HMBC data available
Mon Jul 04 16:22:35.076 CEST 2022: Elapsed time for evaluation (XD Suite): 0.04 s.
Mon Jul 04 16:22:35.307 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.23 s.
Mon Jul 04 16:22:35.388 CEST 2022: Structure is used: true
Mon Jul 04 16:22:35.391 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G7_OS_Plate011_G7/1/G7_OS_Plate11_G7-7750428a-2ab8-46ad-8832-4b8efcbda9dc.mol
Mon Jul 04 16:22:35.393 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.08 s.
Mon Jul 04 16:22:35.399 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:22:35.402 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:22:35.404 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:22:35.407 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:22:35.409 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:22:35.411 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:22:35.413 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:22:35.418 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:22:35.420 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:22:35.423 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:22:35.425 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:22:35.428 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 16:22:35.430 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:22:35.433 CEST 2022: RMSD noise: 30911266.470 (10.217/9.717)
Mon Jul 04 16:22:35.435 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:22:35.438 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:22:35.442 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:22:35.466 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:22:35.586 CEST 2022: Number of Peaks: (110, 10)
Mon Jul 04 16:22:35.610 CEST 2022: Elapsed time for evaluation (PP Suite): 0.14 s.
Mon Jul 04 16:22:35.613 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:22:35.653 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.04 s.
Mon Jul 04 16:22:35.655 CEST 2022: Signal-to-Noise ratio: 6230.01 (2.111 ppm)
Mon Jul 04 16:22:35.658 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:22:35.661 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:22:35.663 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.27 s.
Mon Jul 04 16:22:35.691 CEST 2022: Number of Multiplets: 156
Mon Jul 04 16:22:35.694 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 16:22:35.755 CEST 2022: Number of Peak Cluster: 34
Mon Jul 04 16:22:35.761 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.06 s.
Mon Jul 04 16:22:35.775 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:22:35.949 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.17 s.
Mon Jul 04 16:22:35.959 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 16:22:35.965 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:22:35.968 CEST 2022: Number of consistent PNS: 0
Mon Jul 04 16:22:35.971 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:22:35.975 CEST 2022: Number of consistent PNS: 25
Mon Jul 04 16:22:35.977 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:22:35.982 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:22:35.985 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:22:36.673 CEST 2022: Elapsed time for evaluation (BU Suite): 0.70 s.
Mon Jul 04 16:22:36.720 CEST 2022: CMC-assist project state: AutoInconsistent
Mon Jul 04 16:22:36.722 CEST 2022: INCONSISTENT: No or only invalid ProtonNumberSolutions.
Mon Jul 04 16:22:37.052 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.38 s.
Mon Jul 04 16:22:37.055 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:22:37.057 CEST 2022: CMC-q finished in 2.21 s.
