Wed May 08 11:57:25.841 CEST 2019: Starting CMC-q package (b:143) with command cmcq assistant analysis
Wed May 08 11:57:25.857 CEST 2019: Analysing data set: C:\data\iNEXT-G2\nmr\P6_32\1\pdata\1
Wed May 08 11:57:25.872 CEST 2019: Solvent of PROTON: H2O
Wed May 08 11:57:25.888 CEST 2019: TD: 32768 SI: 65536 SW: 12.016
Wed May 08 11:57:25.888 CEST 2019: PT/PPM: 5454.0825 PT/Hz: 9.0876
Wed May 08 11:57:25.936 CEST 2019: No HSQC data available
Wed May 08 11:57:25.983 CEST 2019: No C13 data available
Wed May 08 11:57:26.038 CEST 2019: No HMBC data available
Wed May 08 11:57:26.038 CEST 2019: Elapsed time for evaluation (XD Suite): 0.00 s.
Wed May 08 11:57:26.132 CEST 2019: Elapsed time for evaluation (SPD Suite): 0.08 s.
Wed May 08 11:57:26.618 CEST 2019: Structure is used: true
Wed May 08 11:57:26.619 CEST 2019: MOL-File C:/data/iNEXT-G2/nmr/P6_32/1/C08.mol
Wed May 08 11:57:26.635 CEST 2019: Elapsed time for evaluation (STD Suite - BCH): 0.49 s.
Wed May 08 11:57:26.673 CEST 2019: Elapsed time for evaluation (ICH Suite): 0.03 s.
Wed May 08 11:57:26.688 CEST 2019: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Wed May 08 11:57:26.688 CEST 2019: Spectrum is not 13C decoupled.
Wed May 08 11:57:26.704 CEST 2019: Spectrum does not contain ERETIC signal.
Wed May 08 11:57:26.720 CEST 2019: Spectrum is suppressed.
Wed May 08 11:57:26.720 CEST 2019: Elapsed time for evaluation (SPT Suite): 0.03 s.
Wed May 08 11:57:26.735 CEST 2019: Suppression frequencies at: 4.650 
Wed May 08 11:57:26.751 CEST 2019: Elapsed time for evaluation (SFF Suite): 0.01 s.
Wed May 08 11:57:26.766 CEST 2019: Expected impurity: TSP
Wed May 08 11:57:26.766 CEST 2019: Expected impurity: DMSO_D5
Wed May 08 11:57:26.782 CEST 2019: Expected impurity: CustomImpurity [isActive=true, identifier=Imp1, protonShiftLimitAPpm=2.4, protonShiftLimitBPpm=2.5, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Wed May 08 11:57:26.798 CEST 2019: Expected impurity: CustomImpurity [isActive=true, identifier=Imp2, protonShiftLimitAPpm=2.7, protonShiftLimitBPpm=2.76, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Wed May 08 11:57:26.798 CEST 2019: Elapsed time for evaluation (IMR Suite): 0.05 s.
Wed May 08 11:57:26.813 CEST 2019: RMSD noise: 638.854 (5.856/5.357)
Wed May 08 11:57:26.813 CEST 2019: Elapsed time for evaluation (ND Suite): 0.01 s.
Wed May 08 11:57:26.829 CEST 2019: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Wed May 08 11:57:26.846 CEST 2019: Elapsed time for evaluation (SAR Suite): 0.00 s.
Wed May 08 11:57:26.893 CEST 2019: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.03 s.
Wed May 08 11:57:27.377 CEST 2019: Number of Peaks: (128, 23)
Wed May 08 11:57:27.393 CEST 2019: Elapsed time for evaluation (PP Suite): 0.49 s.
Wed May 08 11:57:27.393 CEST 2019: Elapsed time for evaluation (EPF Suite): 0.00 s.
Wed May 08 11:57:27.408 CEST 2019: Elapsed time for evaluation (SAR Suite): 0.00 s.
Wed May 08 11:57:27.424 CEST 2019: Signal-to-Noise ratio: 1672.86 (1.270 ppm)
Wed May 08 11:57:27.424 CEST 2019: Elapsed time for evaluation (SND Suite): 0.01 s.
Wed May 08 11:57:27.439 CEST 2019: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Wed May 08 11:57:27.455 CEST 2019: Elapsed time for evaluation (PRE Suite): 0.81 s.
Wed May 08 11:57:27.861 CEST 2019: Number of Multiplets: 278
Wed May 08 11:57:27.892 CEST 2019: Elapsed time for evaluation (MMG Suite): 0.42 s.
Wed May 08 11:57:28.144 CEST 2019: Number of Peak Cluster: 28
Wed May 08 11:57:28.144 CEST 2019: Elapsed time for evaluation (PCG Suite): 0.26 s.
Wed May 08 11:57:28.347 CEST 2019: Elapsed time for evaluation (IMSO Suite): 0.19 s.
Wed May 08 11:57:29.128 CEST 2019: Elapsed time for evaluation (SMOOTH Suite): 0.78 s.
Wed May 08 11:57:29.190 CEST 2019: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.05 s.
Wed May 08 11:57:29.221 CEST 2019: Elapsed time for evaluation (PE Suite): 0.01 s.
Wed May 08 11:57:29.237 CEST 2019: Number of consistent PNS: 1
Wed May 08 11:57:29.252 CEST 2019: Elapsed time for evaluation (PNS Suite): 0.03 s.
Wed May 08 11:57:29.283 CEST 2019: Elapsed time for evaluation (PS Suite - MP): 0.01 s.
Wed May 08 11:57:32.738 CEST 2019: Number of ASL: 201
Wed May 08 11:57:32.754 CEST 2019: Elapsed time for evaluation (ASSIGN Suite): 3.46 s.
Wed May 08 11:57:35.531 CEST 2019: Elapsed time for evaluation (IN Suite): 2.77 s.
Wed May 08 11:57:35.573 CEST 2019: CMC-assist project state: AutoConsistent
Wed May 08 11:57:36.304 CEST 2019: Elapsed time for evaluation (FIN Suite): 0.77 s.
Wed May 08 11:57:36.320 CEST 2019: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Wed May 08 11:57:36.336 CEST 2019: CMC-q finished in 10.49 s.
