Mon Jul 04 19:35:31.706 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:35:31.709 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\H1_EUOS_Plate08_H1\1\pdata\1
Mon Jul 04 19:35:31.717 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:35:31.721 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:35:31.724 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:35:31.737 CEST 2022: No HSQC data available
Mon Jul 04 19:35:31.748 CEST 2022: No C13 data available
Mon Jul 04 19:35:31.760 CEST 2022: No HMBC data available
Mon Jul 04 19:35:31.769 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 19:35:32.024 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.25 s.
Mon Jul 04 19:35:32.130 CEST 2022: Structure is used: true
Mon Jul 04 19:35:32.134 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/H1_EUOS_Plate08_H1/1/H1_EUOS_Plate08_H1-dba3bd3c-4994-4464-a92d-57f9574dd1ed.mol
Mon Jul 04 19:35:32.137 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.11 s.
Mon Jul 04 19:35:32.143 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:35:32.146 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:35:32.149 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:35:32.152 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:35:32.155 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:35:32.157 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:35:32.160 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:35:32.164 CEST 2022: Suppression frequencies at: 4.769 
Mon Jul 04 19:35:32.167 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:35:32.170 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:35:32.173 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:35:32.175 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DMSO, protonShiftLimitAPpm=2.7, protonShiftLimitBPpm=2.66, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Mon Jul 04 19:35:32.178 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DSS, protonShiftLimitAPpm=-0.01, protonShiftLimitBPpm=0.01, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Mon Jul 04 19:35:32.180 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:35:32.183 CEST 2022: RMSD noise: 17944349.500 (9.522/9.022)
Mon Jul 04 19:35:32.185 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:35:32.188 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:35:32.192 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:35:32.217 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:35:32.329 CEST 2022: Number of Peaks: (110, 15)
Mon Jul 04 19:35:32.351 CEST 2022: Elapsed time for evaluation (PP Suite): 0.13 s.
Mon Jul 04 19:35:32.353 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:35:32.383 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.03 s.
Mon Jul 04 19:35:32.386 CEST 2022: Signal-to-Noise ratio: 7603.67 (6.914 ppm)
Mon Jul 04 19:35:32.389 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:35:32.392 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:35:32.395 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.25 s.
Mon Jul 04 19:35:32.426 CEST 2022: Number of Multiplets: 202
Mon Jul 04 19:35:32.429 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 19:35:32.496 CEST 2022: Number of Peak Cluster: 35
Mon Jul 04 19:35:32.504 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.07 s.
Mon Jul 04 19:35:32.520 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 19:35:32.699 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.18 s.
Mon Jul 04 19:35:32.709 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 19:35:32.716 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:35:32.721 CEST 2022: Number of consistent PNS: 2
Mon Jul 04 19:35:32.725 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 19:35:32.729 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:35:32.736 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.00 s.
Mon Jul 04 19:35:32.873 CEST 2022: Elapsed time for evaluation (IN Suite): 0.13 s.
Mon Jul 04 19:35:32.931 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 19:35:32.934 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:35:33.317 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.44 s.
Mon Jul 04 19:35:33.320 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:35:33.322 CEST 2022: CMC-q finished in 1.62 s.
