Tue Jul 05 12:12:33.830 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Tue Jul 05 12:12:33.833 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G2_EUOS_Plate10_G2\1\pdata\1
Tue Jul 05 12:12:33.840 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Tue Jul 05 12:12:33.844 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Tue Jul 05 12:12:33.847 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Tue Jul 05 12:12:33.895 CEST 2022: No HSQC data available
Tue Jul 05 12:12:33.921 CEST 2022: No C13 data available
Tue Jul 05 12:12:33.934 CEST 2022: No HMBC data available
Tue Jul 05 12:12:33.942 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Tue Jul 05 12:12:33.963 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Tue Jul 05 12:12:34.097 CEST 2022: Structure is used: true
Tue Jul 05 12:12:34.100 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G2_EUOS_Plate10_G2/1/G2_EUOS_Plate10_G2-f8e62e0b-63af-4d83-b791-49ee9abf25de.mol
Tue Jul 05 12:12:34.103 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.14 s.
Tue Jul 05 12:12:34.114 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Tue Jul 05 12:12:34.117 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Tue Jul 05 12:12:34.120 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Tue Jul 05 12:12:34.122 CEST 2022: Spectrum is not 13C decoupled.
Tue Jul 05 12:12:34.124 CEST 2022: Spectrum does not contain ERETIC signal.
Tue Jul 05 12:12:34.127 CEST 2022: Spectrum is suppressed.
Tue Jul 05 12:12:34.129 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Tue Jul 05 12:12:34.133 CEST 2022: Suppression frequencies at: 4.661 
Tue Jul 05 12:12:34.136 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Tue Jul 05 12:12:34.139 CEST 2022: Expected impurity: TMS
Tue Jul 05 12:12:34.141 CEST 2022: Expected impurity: DMSO_D5
Tue Jul 05 12:12:34.144 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]
Tue Jul 05 12:12:34.146 CEST 2022: Expected impurity: CustomImpurity [isActive=true, identifier=DSS, protonShiftLimitAPpm=-0.5, protonShiftLimitBPpm=0.1, protonMultiplicity=other, protonCouplingHz=[], protonNumber=0, carbonShiftLimitAPpm=-100.0, carbonShiftLimitBPpm=-100.0, carbonNumber=0]
Tue Jul 05 12:12:34.148 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Tue Jul 05 12:12:34.151 CEST 2022: RMSD noise: 19279774.254 (10.107/9.608)
Tue Jul 05 12:12:34.153 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Tue Jul 05 12:12:34.157 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Tue Jul 05 12:12:34.161 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Tue Jul 05 12:12:34.185 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Tue Jul 05 12:12:34.293 CEST 2022: Number of Peaks: (106, 2)
Tue Jul 05 12:12:34.296 CEST 2022: Elapsed time for evaluation (PP Suite): 0.11 s.
Tue Jul 05 12:12:34.299 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Tue Jul 05 12:12:34.348 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.05 s.
Tue Jul 05 12:12:34.351 CEST 2022: Signal-to-Noise ratio: 714.57 (3.330 ppm)
Tue Jul 05 12:12:34.355 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Tue Jul 05 12:12:34.357 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:12:34.359 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.25 s.
Tue Jul 05 12:12:34.405 CEST 2022: Number of Multiplets: 234
Tue Jul 05 12:12:34.408 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.05 s.
Tue Jul 05 12:12:34.471 CEST 2022: Number of Peak Cluster: 25
Tue Jul 05 12:12:34.476 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.07 s.
Tue Jul 05 12:12:34.504 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Tue Jul 05 12:12:34.663 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.16 s.
Tue Jul 05 12:12:34.690 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Tue Jul 05 12:12:34.694 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Tue Jul 05 12:12:34.698 CEST 2022: Number of consistent PNS: 0
Tue Jul 05 12:12:34.700 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Tue Jul 05 12:12:34.706 CEST 2022: Number of consistent PNS: 30
Tue Jul 05 12:12:34.709 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Tue Jul 05 12:12:34.721 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.01 s.
Tue Jul 05 12:12:34.724 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:12:35.852 CEST 2022: Elapsed time for evaluation (BU Suite): 1.15 s.
Tue Jul 05 12:12:35.902 CEST 2022: CMC-assist project state: AutoInconsistent
Tue Jul 05 12:12:35.904 CEST 2022: INCONSISTENT: No or only invalid ProtonNumberSolutions.
Tue Jul 05 12:12:36.270 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.41 s.
Tue Jul 05 12:12:36.273 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:12:36.275 CEST 2022: CMC-q finished in 2.45 s.
