ASFIT version 4.IV.2002 _______________________________________________________________________________ Camphor, 13C10 _______________________________________________________________________________ Fit of Watson's Hamiltonian --> reduction-A, representation-I.r : A = 1427.7086011467663411167 +- 0.0048418241846025041 B = 1179.4454992632636276539 +- 0.0003668397915688556 C = 1087.8586112326970578579 +- 0.0001699735426499414 DJ = 0.0000334914679952345 DJK = 0.0000836263097831215 DK = -0.0000656076906905046 dJ = 0.0000028691560645696 dK = 0.0000249019216237808 Deviation of fit = 0.001490 Weighted deviation of fit = 0.744929 ------------------------------------------------------------------------------- TRANSITION Observed Obs-Calc Error ------------------------------------------------------------------------------- ! 1. 4 1 4 3 1 3 8851.7065 0.0008 0.0020 2. 4 0 4 3 0 3 8903.6811 -0.0014 0.0020 3. 4 1 3 3 1 2 9200.0693 -0.0013 0.0020 4. 5 1 5 4 1 4 11041.5724 0.0003 0.0020 5. 5 0 5 4 0 4 11071.0013 -0.0002 0.0020 6. 5 1 4 4 1 3 11441.5918 0.0015 0.0020 ------------------------------------------------------------------------------- Sigma = 0.001490 6 Transitions in fit Sigma.w = 0.744929 3 Degrees of freedom A /MHz 1427.7086(48) LJK /mHz 0.0 B /MHz 1179.44549(36) LKKJ/mHz 0.0 C /MHz 1087.85861(16) LK /mHz 0.0 DJ /kHz 0.0334914679952345 lJ /mHz 0.0 DJK /kHz 0.0836263097831216 lJK /mHz 0.0 DK /kHz -0.0656076906905046 lKJ /mHz 0.0 dJ /kHz 0.0028691560645696 lK /mHz 0.0 dK /kHz 0.0249019216237808 PJ /microHz 0.0 HJ / Hz 0.0 PJJK /microHz 0.0 HJK / Hz 0.0 PJK /microHz 0.0 HKJ / Hz 0.0 PKJ /microHz 0.0 HK / Hz 0.0 PKKJ /microHz 0.0 hJ / Hz 0.0 PK /microHz 0.0 hJK / Hz 0.0 pJ /microHz 0.0 hK / Hz 0.0 pJJK /microHz 0.0 LJ /mHz 0.0 pJK /microHz 0.0 LJJK/mHz 0.0 pKKJ /microHz 0.0 pK /microHz 0.0 CORRELATION COEFFICIENTS, C.ij: A B C A 1.0000 B -0.6399 1.0000 C -0.7469 0.1638 1.0000 Mean value of |C.ij|, i.ne.j = 0.5169 Mean value of C.ij, i.ne.j = -0.4077 _______________________________________________________________________________ MOST INFLUENTIAL TRANSITIONS: Observed Obs-Calc hjj >0.500 3. 4 1 3 3 1 2 9200.0693 -0.0013 0.6794 6. 5 1 4 4 1 3 11441.5918 0.0015 0.6533 mean of all values = 0.5000 WORST FITTING LINES (line number=(o-c)/error): 6= 0.7 2= -0.7 3= -0.7 1= 0.4 4= 0.2 5= -0.1 _______________________________________________________________________________