Mon Jul 04 16:40:09.819 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:40:09.821 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\G1_OS_Plate04_G1\1\pdata\1
Mon Jul 04 16:40:09.828 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:40:09.832 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:40:09.835 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:40:09.924 CEST 2022: No HSQC data available
Mon Jul 04 16:40:09.934 CEST 2022: No C13 data available
Mon Jul 04 16:40:09.943 CEST 2022: No HMBC data available
Mon Jul 04 16:40:09.951 CEST 2022: Elapsed time for evaluation (XD Suite): 0.00 s.
Mon Jul 04 16:40:09.973 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:40:10.054 CEST 2022: Structure is used: true
Mon Jul 04 16:40:10.071 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/G1_OS_Plate04_G1/1/G1_OS_Plate04_G1-30534776-3eb2-4fce-b58f-5ed37ab6602a.mol
Mon Jul 04 16:40:10.073 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.10 s.
Mon Jul 04 16:40:10.079 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:40:10.082 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:40:10.085 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:40:10.087 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:40:10.089 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:40:10.092 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:40:10.094 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:40:10.098 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:40:10.101 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:40:10.103 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:40:10.105 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:40:10.108 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]
Mon Jul 04 16:40:10.110 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:40:10.112 CEST 2022: RMSD noise: 29603845.073 (-2.860/-3.359)
Mon Jul 04 16:40:10.115 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:40:10.117 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:40:10.121 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:40:10.145 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:40:10.213 CEST 2022: Number of Peaks: (51, 7)
Mon Jul 04 16:40:10.216 CEST 2022: Elapsed time for evaluation (PP Suite): 0.07 s.
Mon Jul 04 16:40:10.219 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:40:10.291 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.07 s.
Mon Jul 04 16:40:10.294 CEST 2022: Signal-to-Noise ratio: 1382.62 (5.853 ppm)
Mon Jul 04 16:40:10.297 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:40:10.299 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:40:10.301 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.23 s.
Mon Jul 04 16:40:10.315 CEST 2022: Number of Multiplets: 98
Mon Jul 04 16:40:10.318 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.01 s.
Mon Jul 04 16:40:10.355 CEST 2022: Number of Peak Cluster: 22
Mon Jul 04 16:40:10.361 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.04 s.
Mon Jul 04 16:40:10.375 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:40:10.484 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.11 s.
Mon Jul 04 16:40:10.493 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.01 s.
Mon Jul 04 16:40:10.497 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:40:10.501 CEST 2022: Number of consistent PNS: 3
Mon Jul 04 16:40:10.503 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:40:10.506 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:40:10.511 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.00 s.
Mon Jul 04 16:40:10.559 CEST 2022: Elapsed time for evaluation (IN Suite): 0.05 s.
Mon Jul 04 16:40:10.606 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:40:10.970 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.41 s.
Mon Jul 04 16:40:10.989 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:40:10.992 CEST 2022: CMC-q finished in 1.17 s.
