Tue Jul 05 12:11:06.789 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Tue Jul 05 12:11:06.791 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G9_EUOS_Plate07_G9\1\pdata\1
Tue Jul 05 12:11:06.800 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Tue Jul 05 12:11:06.803 CEST 2022: TD: 32768 SI: 65536 SW: 13.663
Tue Jul 05 12:11:06.806 CEST 2022: PT/PPM: 4796.3850 PT/Hz: 7.9953
Tue Jul 05 12:11:06.897 CEST 2022: No HSQC data available
Tue Jul 05 12:11:06.910 CEST 2022: No C13 data available
Tue Jul 05 12:11:06.923 CEST 2022: No HMBC data available
Tue Jul 05 12:11:06.933 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Tue Jul 05 12:11:06.954 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Tue Jul 05 12:11:07.064 CEST 2022: Structure is used: true
Tue Jul 05 12:11:07.081 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G9_EUOS_Plate07_G9/1/G9_EUOS_Plate07_G9-29a55274-bf65-402f-856b-2e193aef0015.mol
Tue Jul 05 12:11:07.083 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.13 s.
Tue Jul 05 12:11:07.092 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Tue Jul 05 12:11:07.096 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Tue Jul 05 12:11:07.099 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Tue Jul 05 12:11:07.101 CEST 2022: Spectrum is not 13C decoupled.
Tue Jul 05 12:11:07.104 CEST 2022: Spectrum does not contain ERETIC signal.
Tue Jul 05 12:11:07.106 CEST 2022: Spectrum is suppressed.
Tue Jul 05 12:11:07.109 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Tue Jul 05 12:11:07.113 CEST 2022: Suppression frequencies at: 4.661 
Tue Jul 05 12:11:07.115 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Tue Jul 05 12:11:07.118 CEST 2022: Expected impurity: TMS
Tue Jul 05 12:11:07.121 CEST 2022: Expected impurity: DMSO_D5
Tue Jul 05 12:11:07.123 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 12:11:07.125 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 12:11:07.128 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Tue Jul 05 12:11:07.130 CEST 2022: RMSD noise: 17703351.083 (-1.670/-2.170)
Tue Jul 05 12:11:07.132 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Tue Jul 05 12:11:07.135 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Tue Jul 05 12:11:07.139 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Tue Jul 05 12:11:07.163 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Tue Jul 05 12:11:07.277 CEST 2022: Number of Peaks: (115, 12)
Tue Jul 05 12:11:07.280 CEST 2022: Elapsed time for evaluation (PP Suite): 0.11 s.
Tue Jul 05 12:11:07.283 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Tue Jul 05 12:11:07.295 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.01 s.
Tue Jul 05 12:11:07.298 CEST 2022: Signal-to-Noise ratio: 2460.04 (5.926 ppm)
Tue Jul 05 12:11:07.300 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Tue Jul 05 12:11:07.303 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:11:07.306 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.22 s.
Tue Jul 05 12:11:07.334 CEST 2022: Number of Multiplets: 206
Tue Jul 05 12:11:07.337 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Tue Jul 05 12:11:07.405 CEST 2022: Number of Peak Cluster: 38
Tue Jul 05 12:11:07.411 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.07 s.
Tue Jul 05 12:11:07.428 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Tue Jul 05 12:11:07.601 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.17 s.
Tue Jul 05 12:11:07.611 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Tue Jul 05 12:11:07.616 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Tue Jul 05 12:11:07.620 CEST 2022: Number of consistent PNS: 2
Tue Jul 05 12:11:07.624 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Tue Jul 05 12:11:07.628 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Tue Jul 05 12:11:07.649 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.02 s.
Tue Jul 05 12:11:07.831 CEST 2022: Elapsed time for evaluation (IN Suite): 0.18 s.
Tue Jul 05 12:11:07.882 CEST 2022: CMC-assist project state: AutoConsistent
Tue Jul 05 12:11:07.885 CEST 2022: Impurity 13C satellite filter active!
Tue Jul 05 12:11:08.248 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.42 s.
Tue Jul 05 12:11:08.251 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Tue Jul 05 12:11:08.254 CEST 2022: CMC-q finished in 1.47 s.
