Mon Jul 04 16:22:21.135 CEST 2022: Starting CMC-q package (b:17) with command cmcq assistant analysis
Mon Jul 04 16:22:21.138 CEST 2022: Analysing data set: E:\TopSpin4.0.8\data\EU_Openscreen\CMCq\CMCq\nmr\Consistent\B7_OS_Plate011_B7\1\pdata\1
Mon Jul 04 16:22:21.145 CEST 2022: Solvent of PROTON is unknown - set to: POLYSOLV
Mon Jul 04 16:22:21.149 CEST 2022: TD: 32768 SI: 65536 SW: 16.028
Mon Jul 04 16:22:21.151 CEST 2022: PT/PPM: 4088.7212 PT/Hz: 6.8157
Mon Jul 04 16:22:21.193 CEST 2022: No HSQC data available
Mon Jul 04 16:22:21.205 CEST 2022: No C13 data available
Mon Jul 04 16:22:21.217 CEST 2022: No HMBC data available
Mon Jul 04 16:22:21.232 CEST 2022: Elapsed time for evaluation (XD Suite): 0.01 s.
Mon Jul 04 16:22:21.254 CEST 2022: Elapsed time for evaluation (SPD Suite): 0.02 s.
Mon Jul 04 16:22:21.397 CEST 2022: Structure is used: true
Mon Jul 04 16:22:21.428 CEST 2022: MOL-File E:/TopSpin4.0.8/data/EU_Openscreen/CMCq/CMCq/nmr/Consistent/B7_OS_Plate011_B7/1/B7_OS_Plate11_B7-48ec458e-919a-47f1-a38c-7a2b5c09acbe.mol
Mon Jul 04 16:22:21.430 CEST 2022: Elapsed time for evaluation (STD Suite - BCH): 0.17 s.
Mon Jul 04 16:22:21.441 CEST 2022: Initial check warning: SR is not equal to zero; this might not be intended!
Mon Jul 04 16:22:21.443 CEST 2022: Elapsed time for evaluation (ICH Suite): 0.01 s.
Mon Jul 04 16:22:21.446 CEST 2022: Elapsed time for evaluation (EFCH Suite): 0.00 s.
Mon Jul 04 16:22:21.449 CEST 2022: Spectrum is not 13C decoupled.
Mon Jul 04 16:22:21.451 CEST 2022: Spectrum does not contain ERETIC signal.
Mon Jul 04 16:22:21.453 CEST 2022: Spectrum is suppressed.
Mon Jul 04 16:22:21.455 CEST 2022: Elapsed time for evaluation (SPT Suite): 0.01 s.
Mon Jul 04 16:22:21.460 CEST 2022: Suppression frequencies at: 4.654 
Mon Jul 04 16:22:21.463 CEST 2022: Elapsed time for evaluation (SFF Suite): 0.00 s.
Mon Jul 04 16:22:21.466 CEST 2022: Expected impurity: TMS
Mon Jul 04 16:22:21.468 CEST 2022: Expected impurity: DMSO_D5
Mon Jul 04 16:22:21.470 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 16:22:21.473 CEST 2022: Elapsed time for evaluation (IMR Suite): 0.01 s.
Mon Jul 04 16:22:21.475 CEST 2022: RMSD noise: 31456443.286 (-0.405/-0.905)
Mon Jul 04 16:22:21.478 CEST 2022: Elapsed time for evaluation (ND Suite): 0.00 s.
Mon Jul 04 16:22:21.481 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_CORR_STANDARD): 0.00 s.
Mon Jul 04 16:22:21.487 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.00 s.
Mon Jul 04 16:22:21.511 CEST 2022: Elapsed time for evaluation (BASL Suite - BASL_POINTS_GOL): 0.02 s.
Mon Jul 04 16:22:21.634 CEST 2022: Number of Peaks: (130, 3)
Mon Jul 04 16:22:21.637 CEST 2022: Elapsed time for evaluation (PP Suite): 0.12 s.
Mon Jul 04 16:22:21.640 CEST 2022: Elapsed time for evaluation (EPF Suite): 0.00 s.
Mon Jul 04 16:22:21.662 CEST 2022: Elapsed time for evaluation (SAR Suite): 0.02 s.
Mon Jul 04 16:22:21.665 CEST 2022: Signal-to-Noise ratio: 14063.00 (3.026 ppm)
Mon Jul 04 16:22:21.668 CEST 2022: Elapsed time for evaluation (SND Suite): 0.00 s.
Mon Jul 04 16:22:21.670 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:22:21.673 CEST 2022: Elapsed time for evaluation (PRE Suite): 0.24 s.
Mon Jul 04 16:22:21.704 CEST 2022: Number of Multiplets: 196
Mon Jul 04 16:22:21.707 CEST 2022: Elapsed time for evaluation (MMG Suite): 0.03 s.
Mon Jul 04 16:22:21.793 CEST 2022: Number of Peak Cluster: 46
Mon Jul 04 16:22:21.799 CEST 2022: Elapsed time for evaluation (PCG Suite): 0.09 s.
Mon Jul 04 16:22:21.820 CEST 2022: Elapsed time for evaluation (IMSO Suite): 0.02 s.
Mon Jul 04 16:22:21.984 CEST 2022: Elapsed time for evaluation (SMOOTH Suite): 0.16 s.
Mon Jul 04 16:22:21.990 CEST 2022: Elapsed time for evaluation (PS Suite - BLOCK_5): 0.00 s.
Mon Jul 04 16:22:21.996 CEST 2022: Elapsed time for evaluation (PE Suite): 0.00 s.
Mon Jul 04 16:22:22.001 CEST 2022: Number of consistent PNS: 7
Mon Jul 04 16:22:22.003 CEST 2022: Elapsed time for evaluation (PNS Suite): 0.01 s.
Mon Jul 04 16:22:22.006 CEST 2022: Elapsed time for evaluation (PS Suite - MP): 0.00 s.
Mon Jul 04 16:22:22.045 CEST 2022: Elapsed time for evaluation (ASSIGN Suite): 0.04 s.
Mon Jul 04 16:22:22.132 CEST 2022: Elapsed time for evaluation (IN Suite): 0.07 s.
Mon Jul 04 16:22:22.182 CEST 2022: CMC-assist project state: AutoConsistent
Mon Jul 04 16:22:22.526 CEST 2022: Elapsed time for evaluation (FIN Suite): 0.39 s.
Mon Jul 04 16:22:22.529 CEST 2022: Elapsed time for evaluation (EXIT Suite): 0.00 s.
Mon Jul 04 16:22:22.532 CEST 2022: CMC-q finished in 1.40 s.
