Mon Jul 04 16:44:50.710 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:44:50.713 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\E10_OS_Plate04_E10\1\pdata\1
Mon Jul 04 16:44:50.721 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:44:50.725 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:44:50.728 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:44:51.202 CEST 2022: No HSQC data available
Mon Jul 04 16:44:51.215 CEST 2022: No C13 data available
Mon Jul 04 16:44:51.228 CEST 2022: No HMBC data available
Mon Jul 04 16:44:51.236 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:44:51.257 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:44:51.419 CEST 2022: Structure is used: true
Mon Jul 04 16:44:51.437 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/E10_OS_Plate04_E10/1/E10_OS_Plate04_E10-670f79b2-59c5-411f-aa73-73d2aee7d041.mol
Mon Jul 04 16:44:51.439 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.18 s.
Mon Jul 04 16:44:51.450 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:44:51.453 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:44:51.456 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:44:51.459 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:44:51.461 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:44:51.463 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:44:51.466 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:44:51.470 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:44:51.473 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:44:51.476 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:44:51.478 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:44:51.480 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 16:44:51.483 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:44:51.485 CEST 2022: RMSD noise: 29839823.801 (12.669/12.169)
Mon Jul 04 16:44:51.487 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:44:51.490 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:44:51.494 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:44:51.518 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:44:51.601 CEST 2022: Number of Peaks: (77, 13)
Mon Jul 04 16:44:51.604 CEST 2022: Elapsed time for evaluation (PP Suite): 0.08 s.
Mon Jul 04 16:44:51.607 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:44:51.666 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.06 s.
Mon Jul 04 16:44:51.669 CEST 2022: Signal-to-Noise ratio: 11916.02 (1.304 ppm)
Mon Jul 04 16:44:51.672 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:44:51.675 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:44:51.677 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.24 s.
Mon Jul 04 16:44:51.692 CEST 2022: Number of Multiplets: 88
Mon Jul 04 16:44:51.695 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.02 s.
Mon Jul 04 16:44:51.734 CEST 2022: Number of Peak Cluster: 23
Mon Jul 04 16:44:51.740 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.04 s.
Mon Jul 04 16:44:51.748 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.01 s.
Mon Jul 04 16:44:51.869 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.12 s.
Mon Jul 04 16:44:51.884 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:44:51.888 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:44:51.892 CEST 2022: Number of consistent PNS: 5
Mon Jul 04 16:44:51.895 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.00 s.
Mon Jul 04 16:44:51.897 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:44:51.933 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.03 s.
Mon Jul 04 16:44:52.036 CEST 2022: Elapsed time for evaluation (IN Suite): 0.10 s.
Mon Jul 04 16:44:52.087 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:44:52.437 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.40 s.
Mon Jul 04 16:44:52.441 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:44:52.443 CEST 2022: CMC-q finished in 1.73 s.
