Mon Jul 04 19:38:46.023 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 19:38:46.026 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\B7_EUOS_Plate08_B7\1\pdata\1
Mon Jul 04 19:38:46.034 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 19:38:46.038 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Mon Jul 04 19:38:46.041 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Mon Jul 04 19:38:47.080 CEST 2022: No HSQC data available
Mon Jul 04 19:38:47.092 CEST 2022: No C13 data available
Mon Jul 04 19:38:47.104 CEST 2022: No HMBC data available
Mon Jul 04 19:38:47.111 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 19:38:47.130 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 19:38:47.234 CEST 2022: Structure is used: true
Mon Jul 04 19:38:47.267 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/B7_EUOS_Plate08_B7/1/B7_EUOS_Plate08_B7-5f0bc96d-225a-464b-9e4c-cb7040a89364.mol
Mon Jul 04 19:38:47.270 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.14 s.
Mon Jul 04 19:38:47.276 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 19:38:47.279 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 19:38:47.283 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 19:38:47.285 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 19:38:47.288 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 19:38:47.290 CEST 2022: Spectrum is suppressed.
Mon Jul 04 19:38:47.292 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 19:38:47.297 CEST 2022: Suppression frequencies at: 4.769 
Mon Jul 04 19:38:47.299 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 19:38:47.302 CEST 2022: Expected impurity: TMS
Mon Jul 04 19:38:47.304 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 19:38:47.307 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 19:38:47.310 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 19:38:47.312 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 19:38:47.314 CEST 2022: RMSD noise: 17642603.756 (-1.562/-2.062)
Mon Jul 04 19:38:47.317 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 19:38:47.320 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 19:38:47.325 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 19:38:47.351 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 19:38:47.551 CEST 2022: Number of Peaks: (190, 19)
Mon Jul 04 19:38:47.554 CEST 2022: Elapsed time for evaluation (PP Suite): 0.20 s.
Mon Jul 04 19:38:47.557 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 19:38:47.612 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.05 s.
Mon Jul 04 19:38:47.616 CEST 2022: Signal-to-Noise ratio: 17522.40 (1.398 ppm)
Mon Jul 04 19:38:47.619 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 19:38:47.622 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:38:47.624 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.35 s.
Mon Jul 04 19:38:47.713 CEST 2022: Number of Multiplets: 331
Mon Jul 04 19:38:47.716 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.09 s.
Mon Jul 04 19:38:47.870 CEST 2022: Number of Peak Cluster: 54
Mon Jul 04 19:38:47.881 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.16 s.
Mon Jul 04 19:38:47.900 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 19:38:48.161 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.26 s.
Mon Jul 04 19:38:48.171 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 19:38:48.179 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 19:38:48.184 CEST 2022: Number of consistent PNS: 4
Mon Jul 04 19:38:48.186 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 19:38:48.190 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 19:38:48.211 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Mon Jul 04 19:38:48.262 CEST 2022: Elapsed time for evaluation (IN Suite): 0.05 s.
Mon Jul 04 19:38:48.320 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 19:38:48.324 CEST 2022: Impurity 13C satellite filter active!
Mon Jul 04 19:38:48.676 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.41 s.
Mon Jul 04 19:38:48.682 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 19:38:48.685 CEST 2022: CMC-q finished in 2.66 s.
