tertiary butyl 79.bromide (Legon constants) ----------------------------------------- Fit frequencies(1) or differences(2) = 1 spin of nucleus 1 (units of 1/2) = 3 spin of nucleus 2 (units of 1/2) = 0 Number of iterations = 2 Excess in F and J over value in data = 1 Dump options (0,1,2) = 0 Freq. contributions options (0,1,2) = 0 Number of transitions =100 ----------------------------------------- A = 0 4519. B = 0 2044.23969 C = 0 0.0 DJ = 0 .0002952 DJK = 0 .0008933 DK = 0 0.0 dJ = 0 .000000000000 dK = 0 .000000000000 HJ = 0 .0000000 HJK = 0 .000000000000 HKJ = 0 .000000000000 HK = 0 .000000000000 hJ = 0 .000000000000 hJK = 0 .000000000000 hK = 0 .000000000000 LKKJ = 0 .000000000000 I1: X.aa = 1 511.980 I1: Xbb-Xcc = 0 0.000000000000 I1: Xab = 0 0.000000000000 I1: XJ.a = 0 0.000000000000 I1: XK.a = 0 0.000000000000 I1: XJbc = 0 .000000000000 I1: Ma = 0 .00 I1: Mb-c = 0 .000000000000 I1: Tr = 1 -.0107 = 0 .000000000000 = 0 .000000000000 = 0 .000000000000 = 0 .000000000000 = 0 .000000000000 = 0 .000000000000 mu.a = 0 2.257 mu.b = 0 .0 mu.c = 0 .0 d = 0 26.96 k 0 .0 2 0 2 1 0 1 5 1 3 1 8165.9887 0. 1 2 0 2 1 0 1 7 1 5 1 8166.2300 0. 1 2 0 2 1 0 1 3 1 3 1 8076.1688 0. 1 2 0 2 1 0 1 1 1 1 1 8176.9377 0. 1 2 0 2 1 0 1 5 1 5 1 8294.4481 0. 1 2 0 2 1 0 1 3 1 1 1 8306.2781 0. 1 2 1 1 1 1 0 7 1 5 1 8146.3624 0. 1 2 1 1 1 1 0 1 1 1 1 8051.9909 0. 1 2 1 1 1 1 0 3 1 1 1 8115.1163 0. 1 2 1 1 1 1 0 5 1 5 1 8211.3853 0. 1 2 1 1 1 1 0 3 1 3 1 8230.1570 0. 1 2 1 1 1 1 0 5 1 3 1 8275.5574 0. 1 3 0 3 2 0 2 3 1 3 1 12161.9502 0. 1 3 0 3 2 0 2 5 1 5 1 12200.6145 0. 1 3 0 3 2 0 2 9 1 7 1 12259.4491 0. 1 3 0 3 2 0 2 7 1 5 1 12259.3507 0. 1 3 0 3 2 0 2 5 1 3 1 12290.4349 0. 1 3 0 3 2 0 2 3 1 1 1 12291.2890 0. 1 3 0 3 2 0 2 7 1 7 1 12387.5671 0. 1 3 1 2 2 1 1 9 1 7 1 12251.9249 0. 1 3 1 2 2 1 1 3 1 1 1 12251.8046 0. 1 3 1 2 2 1 1 3 1 3 1 12188.6752 0. 1 3 1 2 2 1 1 5 1 5 1 12238.9903 0. 1 3 1 2 2 1 1 5 1 3 1 12284.3861 0. 1 3 1 2 2 1 1 7 1 7 1 12348.4202 0. 1 3 2 1 2 2 0 7 1 5 1 12357.7564 0. 1 3 2 1 2 2 0 3 1 1 1 12138.7136 0. 1 3 2 1 2 2 0 9 1 7 1 12229.0749 0. 1 3 2 1 2 2 0 7 1 7 1 12230.1994 0. 1 3 2 1 2 2 0 5 1 3 1 12266.3731 0. 1 3 2 1 2 2 0 3 1 3 1 12268.0399 0. 1 3 2 1 2 2 0 5 1 5 1 12356.9483 0. 1 end