Mon Jul 04 16:28:39.584 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:28:39.586 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\A11_OS_Plate012_A11\1\pdata\1
Mon Jul 04 16:28:39.593 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:28:39.597 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:28:39.600 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:28:39.995 CEST 2022: No HSQC data available
Mon Jul 04 16:28:40.008 CEST 2022: No C13 data available
Mon Jul 04 16:28:40.021 CEST 2022: No HMBC data available
Mon Jul 04 16:28:40.028 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:28:40.054 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:28:40.185 CEST 2022: Structure is used: true
Mon Jul 04 16:28:40.220 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/A11_OS_Plate012_A11/1/A11_OS_Plate12_A11-23e93831-1e19-4ccd-9a05-fc366e0cc0f8.mol
Mon Jul 04 16:28:40.222 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.17 s.
Mon Jul 04 16:28:40.233 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:28:40.235 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:28:40.238 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:28:40.240 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:28:40.243 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:28:40.245 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:28:40.247 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:28:40.251 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:28:40.254 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:28:40.256 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:28:40.259 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:28:40.261 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 16:28:40.263 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:28:40.266 CEST 2022: RMSD noise: 31338033.705 (8.583/8.083)
Mon Jul 04 16:28:40.268 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:28:40.271 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:28:40.275 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:28:40.298 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:28:40.380 CEST 2022: Number of Peaks: (64, 22)
Mon Jul 04 16:28:40.383 CEST 2022: Elapsed time for evaluation (PP Suite): 0.08 s.
Mon Jul 04 16:28:40.385 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:28:40.427 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.04 s.
Mon Jul 04 16:28:40.430 CEST 2022: Signal-to-Noise ratio: 5885.07 (0.847 ppm)
Mon Jul 04 16:28:40.433 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:28:40.435 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:28:40.437 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.21 s.
Mon Jul 04 16:28:40.457 CEST 2022: Number of Multiplets: 136
Mon Jul 04 16:28:40.459 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:28:40.494 CEST 2022: Number of Peak Cluster: 18
Mon Jul 04 16:28:40.500 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.04 s.
Mon Jul 04 16:28:40.505 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.00 s.
Mon Jul 04 16:28:40.619 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.11 s.
Mon Jul 04 16:28:40.623 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:28:40.627 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:28:40.631 CEST 2022: Number of consistent PNS: 3
Mon Jul 04 16:28:40.633 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:28:40.636 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:28:40.722 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.08 s.
Mon Jul 04 16:28:41.163 CEST 2022: Elapsed time for evaluation (IN Suite): 0.42 s.
Mon Jul 04 16:28:41.525 CEST 2022: Elapsed time for evaluation (BU Suite): 0.36 s.
Mon Jul 04 16:28:41.574 CEST 2022: CMC-assist project state: AutoInconsistent
Mon Jul 04 16:28:41.576 CEST 2022: INCONSISTENT: Only invalid AssignmentSolutions.
Mon Jul 04 16:28:41.925 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.40 s.
Mon Jul 04 16:28:41.928 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:28:41.930 CEST 2022: CMC-q finished in 2.35 s.
