3, 6, 0.001 !isigma, idelm, spin 10, 9, 0, !ktronc, nvt, ispecRHO 251, 30000, 50, 12, !numpar, numlines, numcategories, order of terms 0.1E-04, 20.d0 !stopping criteria; o-c maximum for fitted lines ---------------------------------------------------------------------------------------------------------- H=Sum{1/2(J**2k*Jz**n*Jx**p*Jy**q*palfa**r*cos(3s*alfa)*sin(3*t*alfa)+ +sin(3*t*alfa)*cos(3s*alfa)*palfa**r*Jy**q*Jx**p*Jz**n*J**2k)} ---------------------------------------------------------------------------------------------------------- Name k, n, p, q, r, s, t, value[cm-1], stage, float(Y=1/N=0) ---------------------------------------------------------------------------------------------------------- muz , 0, 1, 0, 0, 0, 0, 0, 0.37500000000000000E+00 , 0, 0, chi_aa , 0, 2, 0, 0, 0, 0, 0, 0.00000000000000000E-00 , -1, 0, chi_aa , 0, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , -1, -1, chi_bb , 0, 0, 2, 0, 0, 0, 0, 0.00000000000000000E-00 , -1, 0, chi_bb , 0, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , -1, -1, F , 0, 0, 0, 0, 2, 0, 0, 0.54669559256922371E+01 , 1, 1, -2*RHO*F , 0, 1, 0, 0, 1, 0, 0, -0.37976551061658992E+00 , 1, 1, A-0.5(B+C) , 0, 2, 0, 0, 0, 0, 0, 0.11996110827918570E+00 , 2, 1, 0.5(B+C) , 1, 0, 0, 0, 0, 0, 0, 0.71155569872345753E-01 , 2, 1, 0.5(B-C) , 0, 0, 2, 0, 0, 0, 0, 0.12818373263691092E-01 , 2, 1, 0.5(B-C) , 0, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , 2, -1, 0.5*V6 , 0, 0, 0, 0, 0, 0, 0, 0.24189180874980099E+01 , 1, 1, 0.5*V6 , 0, 0, 0, 0, 0, 2, 0, 0.10000000000000000E+01 , 1, -1, RHOm , 0, 1, 0, 0, 3, 0, 0, 0.72376788246234357E-04 , 1, 1, RHO3c , 0, 0, 0, 1, 1, 0, 1, -0.85536154961407540E-02 , 2, 1, FJ , 1, 0, 0, 0, 2, 0, 0, -0.36765673069131763E-06 , 2, 1, FK , 0, 2, 0, 0, 2, 0, 0, -0.35922872106083025E-05 , 2, 1, D3ab , 0, 1, 1, 0, 0, 1, 0, 0.20475955231328541E-03 , 2, 1, RHOJ , 1, 1, 0, 0, 1, 0, 0, 0.11249708485973429E-06 , 2, 1, RHOK , 0, 3, 0, 0, 1, 0, 0, 0.12788198693861360E-06 , 2, 1, RHObc , 0, 1, 2, 0, 1, 0, 0, 0.51244681659514855E-07 , 2, 1, RHObc , 0, 1, 0, 2, 1, 0, 0, -0.10000000000000000E+01 , 2, -1, -DJ , 2, 0, 0, 0, 0, 0, 0, -0.41956612542907227E-08 , 2, 1, -DJK , 1, 2, 0, 0, 0, 0, 0, -0.12096216604594054E-07 , 2, 1, -DK , 0, 4, 0, 0, 0, 0, 0, -0.26469903842770360E-07 , 2, 1, -2*dj , 1, 0, 2, 0, 0, 0, 0, -0.26901102042687929E-08 , 2, 1, -2*dj , 1, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , 2, -1, -2*dk , 0, 2, 2, 0, 0, 0, 0, -0.29942468837773131E-07 , 2, 1, -2*dk , 0, 2, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , 2, -1, RHOmm , 0, 1, 0, 0, 5, 0, 0, 0.22684463656155936E-05 , 2, 1, FmK , 0, 2, 0, 0, 4, 0, 0, -0.18482241411381347E-06 , 2, 1, FmJ , 1, 0, 0, 0, 4, 0, 0, 0.19821776548242004E-08 , 2, 1, V6J , 1, 0, 0, 0, 0, 2, 0, -0.55186002627101790E-05 , 2, 1, D6bc , 0, 0, 1, 1, 0, 0, 2, 0.86516975013276737E-05 , 2, 1, RHOmK , 0, 3, 0, 0, 3, 0, 0, 0.32967722809749374E-07 , 2, 1, FKK , 0, 4, 0, 0, 2, 0, 0, -0.10364559838050991E-08 , 2, 1, FJK , 1, 2, 0, 0, 2, 0, 0, 0.12439392391978285E-09 , 2, 1, RHOmmK , 0, 3, 0, 0, 5, 0, 0, -0.19671451125943781E-08 , 2, 1, &&&END,,,,,,,,,,,,,,,,,,,,,,,,, 30 ! Jmax 5 ! Number of iterations 300.d0, 0.001, 1.E-3, ! Temperature, linestrength cutoff, "intensity" cutoff 5, 3, 3, 5, ! V6 mode: stat.weights for A1/A2, B1/B2, E1, E2 species; V3 mode - ignored 2000.d0, 30000.d0, 0, ! lower and upper frequency limits; 0/1 - prediction in MHz or in cm-1 1, 30, 0, 2, ! Jlow, Jup, vtlow, vtup -1, 1, !+/-1 prediction; 0 no prediction; +1 only dvt=0; -1 dvt=/=0 also; / - 0/1 calculate expectation values or not --------------------------------------------------------------------------------- meas.freq mut Fu Ju Kau Kcu mlt Fl Jl Kal Kcl ifit weight comments --------------------------------------------------------------------------------- 9262.3282 1 -1.0 3 2 2 1 -1.0 3 0 3 1 0.0100 !! Transitions reported in Table 6 of J.Mol.Spectrosc. 259 (2010) 26-38. !! m=1 ! 10933.4502 1 -1.0 4 2 3 1 -1.0 4 0 4 1 0.0050 13585.9639 1 -1.0 5 2 4 1 -1.0 5 0 5 1 0.0050 16888.9835 1 -1.0 6 2 5 1 -1.0 6 0 6 1 0.0050 20452.0941 1 -1.0 7 2 6 1 -1.0 7 0 7 1 0.0050 24054.7970 1 -1.0 8 2 7 1 -1.0 8 0 8 1 0.0050 8480.8605 1 -1.0 2 1 2 1 -1.0 1 0 1 1 0.0020 12399.1203 1 -1.0 3 0 3 1 -1.0 2 0 2 1 0.0020 16004.8103 1 -1.0 4 0 4 1 -1.0 3 0 3 1 0.0020 19453.4022 1 -1.0 5 0 5 1 -1.0 4 0 4 1 0.0050 22877.8998 1 -1.0 6 0 6 1 -1.0 5 0 5 1 0.0050 26323.3065 1 -1.0 7 0 7 1 -1.0 6 0 6 1 0.0050 8955.1421 1 -1.0 4 1 3 1 -1.0 4 1 4 1 0.0100 11995.8529 1 -1.0 5 1 4 1 -1.0 5 1 5 1 0.0050 15669.3021 1 -1.0 6 1 5 1 -1.0 6 1 6 1 0.0050 19596.7464 1 -1.0 7 1 6 1 -1.0 7 1 7 1 0.0050 23516.9640 1 -1.0 8 1 7 1 -1.0 8 1 8 1 0.0050 12292.1155 1 -1.0 3 1 3 1 -1.0 2 1 2 1 0.0020 15834.1902 1 -1.0 4 1 4 1 -1.0 3 1 3 1 0.0020 19301.7052 1 -1.0 5 1 5 1 -1.0 4 1 4 1 0.0050 22779.2947 1 -1.0 6 1 6 1 -1.0 5 1 5 1 0.0050 26268.4603 1 -1.0 7 1 7 1 -1.0 6 1 6 1 0.0050 17879.7694 1 -1.0 4 1 3 1 -1.0 3 1 2 1 0.0020 22342.4015 1 -1.0 5 1 4 1 -1.0 4 1 3 1 0.0050 26452.7376 1 -1.0 6 1 5 1 -1.0 5 1 4 1 0.0050 8584.3803 1 -1.0 2 2 1 1 -1.0 1 1 0 1 0.0020 13103.3936 1 -1.0 3 2 2 1 -1.0 2 1 1 1 0.0020 8613.5419 1 -1.0 2 1 1 1 -1.0 1 1 1 1 0.0020 12930.5248 1 -1.0 3 2 1 1 -1.0 2 2 1 1 0.0020 17675.9299 1 -1.0 4 2 3 1 -1.0 3 2 2 1 0.0040 22105.9273 1 -1.0 5 2 4 1 -1.0 4 2 3 1 0.0050 26180.9212 1 -1.0 6 2 5 1 -1.0 5 2 4 1 0.0050 21957.8667 1 -1.0 5 2 3 1 -1.0 4 2 2 1 0.0050 26695.9192 1 -1.0 6 2 4 1 -1.0 5 2 3 1 0.0050 12894.2410 1 -1.0 3 3 1 1 -1.0 2 2 0 1 0.0020 17344.1273 1 -1.0 4 3 2 1 -1.0 3 2 1 1 0.0040 11606.8165 1 -1.0 6 2 4 1 -1.0 6 2 5 1 0.0200 13239.1058 1 -1.0 7 2 5 1 -1.0 7 2 6 1 0.0100 16044.7996 1 -1.0 8 2 6 1 -1.0 8 2 7 1 0.0500 19712.6112 1 -1.0 9 2 7 1 -1.0 9 2 8 1 0.0200 23809.9313 1 -1.0 10 2 8 1 -1.0 10 2 9 1 0.0200 15946.2065 1 -1.0 9 3 6 1 -1.0 9 3 7 1 0.0200 17105.9352 1 -1.0 10 3 7 1 -1.0 10 3 8 1 0.0100 19578.7349 1 -1.0 11 3 8 1 -1.0 11 3 9 1 0.0100 17240.7550 1 -1.0 4 3 1 1 -1.0 3 3 1 1 0.0040 17202.7294 1 -1.0 4 4 1 1 -1.0 3 3 0 1 0.0040 21629.4650 1 -1.0 5 4 2 1 -1.0 4 3 1 1 0.0050 21855.9046 1 -1.0 5 3 3 1 -1.0 4 3 2 1 0.0050 26489.6701 1 -1.0 6 3 4 1 -1.0 5 3 3 1 0.0050 26118.7716 1 -1.0 6 3 3 1 -1.0 5 3 2 1 0.0050 21510.7065 1 -1.0 5 5 1 1 -1.0 4 4 0 1 0.0050 25927.3926 1 -1.0 6 5 2 1 -1.0 5 4 1 1 0.0050 26073.3138 1 -1.0 6 4 3 1 -1.0 5 4 2 1 0.0050 22877.6780 1 -1.0 14 4 10 1 -1.0 14 4 11 1 0.0500 21549.5355 1 -1.0 5 4 1 1 -1.0 4 4 1 1 0.0050 25818.4078 1 -1.0 6 6 1 1 -1.0 5 5 0 1 0.0050 24628.6842 1 -1.0 15 5 10 1 -1.0 15 5 11 1 0.0200 25857.7234 1 -1.0 6 5 1 1 -1.0 5 5 1 1 0.0050 16650.3153 2 -1.0 4 0 4 2 -1.0 3 0 3 1 0.0050 !! m=2 ! 20024.7641 2 -1.0 5 0 5 2 -1.0 4 0 4 1 0.0050 23276.7219 2 -1.0 6 0 6 2 -1.0 5 0 5 1 0.0050 8506.5453 2 -1.0 2 1 2 2 -1.0 1 0 1 1 0.0050 12685.1587 2 -1.0 3 1 3 2 -1.0 2 0 2 1 0.0050 8546.1911 2 -1.0 2 1 1 2 -1.0 1 1 1 1 0.0050 12843.5234 2 -1.0 3 1 2 2 -1.0 2 1 2 1 0.0050 18067.7461 2 -1.0 4 1 3 2 -1.0 3 1 3 1 0.0050 8558.4457 2 -1.0 2 2 1 2 -1.0 1 1 0 1 0.0050 12853.1851 2 -1.0 3 2 2 2 -1.0 2 1 1 1 0.0050 17272.4147 2 -1.0 4 2 3 2 -1.0 3 1 2 1 0.0050 22807.7538 2 -1.0 5 1 4 2 -1.0 4 1 3 1 0.0050 7980.2960 2 -1.0 5 1 4 2 -1.0 5 1 5 1 0.0050 12196.5462 2 -1.0 6 1 5 2 -1.0 6 1 6 1 0.0100 12856.4233 2 -1.0 3 2 1 2 -1.0 2 2 1 1 0.0050 17200.4659 2 -1.0 4 2 2 2 -1.0 3 2 2 1 0.0050 21888.3302 2 -1.0 5 2 3 2 -1.0 4 2 3 1 0.0050 12857.8606 2 -1.0 3 3 1 2 -1.0 2 2 0 1 0.0050 17176.8127 2 -1.0 4 3 2 2 -1.0 3 2 1 1 0.0050 21602.0872 2 -1.0 5 3 3 2 -1.0 4 2 2 1 0.0050 8201.6323 2 -1.0 7 2 5 2 -1.0 7 2 6 1 0.0100 11720.0595 2 -1.0 8 2 6 2 -1.0 8 2 7 1 0.0100 16043.6560 2 -1.0 9 2 7 2 -1.0 9 2 8 1 0.0200 26835.8920 2 -1.0 6 2 4 2 -1.0 5 2 3 1 0.0050 8393.5233 2 -1.0 9 3 6 2 -1.0 9 3 7 1 0.0100 10678.2165 2 -1.0 10 3 7 2 -1.0 10 3 8 1 0.0100 17160.2968 2 -1.0 4 4 1 2 -1.0 3 3 0 1 0.0050 21493.4136 2 -1.0 5 4 2 2 -1.0 4 3 1 1 0.0050 25915.0748 2 -1.0 6 4 3 2 -1.0 5 3 2 1 0.0050 17166.1039 2 -1.0 4 3 1 2 -1.0 3 3 1 1 0.0050 21527.0910 2 -1.0 5 3 2 2 -1.0 4 3 2 1 0.0050 26076.8963 2 -1.0 6 3 3 2 -1.0 5 3 3 1 0.0050 21464.2653 2 -1.0 5 5 1 2 -1.0 4 4 0 1 0.0050 25806.7500 2 -1.0 6 5 2 2 -1.0 5 4 1 1 0.0050 9653.7309 2 -1.0 11 4 7 2 -1.0 11 4 8 1 0.0100 10446.0553 2 -1.0 12 4 8 2 -1.0 12 4 9 1 0.0100 12575.8724 2 -1.0 13 4 9 2 -1.0 13 4 10 1 0.0100 21475.2409 2 -1.0 5 4 1 2 -1.0 4 4 1 1 0.0050 25844.6009 2 -1.0 6 4 2 2 -1.0 5 4 2 1 0.0050 25783.9441 2 -1.0 6 5 1 2 -1.0 5 5 1 1 0.0050 25769.0899 2 -1.0 6 6 1 2 -1.0 5 5 0 1 0.0050 11738.9981 2 -1.0 14 5 9 2 -1.0 14 5 10 1 0.0100 12316.9362 2 -1.0 15 5 10 2 -1.0 15 5 11 1 0.0100 14168.9632 2 -1.0 16 5 11 2 -1.0 16 5 12 1 0.0100 8566.7622 3 -1.0 20 1 19 3 -1.0 20 0 20 1 0.0050 !! m=3! 9427.5950 3 -1.0 21 1 20 3 -1.0 21 0 21 1 0.0100 10289.4040 3 -1.0 22 1 21 3 -1.0 22 0 22 1 0.0100 11149.3240 3 -1.0 23 1 22 3 -1.0 23 0 23 1 0.0100 12004.9952 3 -1.0 24 1 23 3 -1.0 24 0 24 1 0.0100 12854.3920 3 -1.0 25 1 24 3 -1.0 25 0 25 1 0.0050 15350.1059 3 -1.0 28 1 27 3 -1.0 28 0 28 1 0.0100 7967.0542 3 -1.0 2 1 1 3 -1.0 1 0 1 1 0.0050 #giant doublet 12604.6570 3 -1.0 3 1 2 3 -1.0 2 0 2 1 0.0050 9095.6028 3 -1.0 5 3 3 3 -1.0 5 0 5 1 0.0100 8577.8119 3 -1.0 2 2 0 3 -1.0 1 1 0 1 0.0050 12013.2625 3 -1.0 3 2 1 3 -1.0 2 1 1 1 0.0050 #giant doublet 16787.3770 3 -1.0 4 2 2 3 -1.0 3 1 2 1 0.0050 21558.8323 3 -1.0 5 2 3 3 -1.0 4 1 3 1 0.0050 8566.7622 3 -1.0 20 2 19 3 -1.0 20 1 20 1 0.0050 9427.5950 3 -1.0 21 2 20 3 -1.0 21 1 21 1 0.0100 10289.4040 3 -1.0 22 2 21 3 -1.0 22 1 22 1 0.0100 11149.3240 3 -1.0 23 2 22 3 -1.0 23 1 23 1 0.0100 12004.9952 3 -1.0 24 2 23 3 -1.0 24 1 24 1 0.0100 9086.8284 3 -1.0 2 2 1 3 -1.0 1 1 1 1 0.0050 #giant doublet 12779.7250 3 -1.0 3 2 2 3 -1.0 2 1 2 1 0.0050 20787.3809 3 -1.0 5 2 4 3 -1.0 4 1 4 1 0.0050 14726.7553 3 -1.0 7 3 4 3 -1.0 7 1 6 1 0.0100 8907.1705 3 -1.0 5 2 3 3 -1.0 5 1 5 1 0.0100 #weak 12641.8804 3 -1.0 5 0 5 3 -1.0 4 1 3 1 0.0100 11348.4271 3 -1.0 6 3 3 3 -1.0 6 1 6 1 0.0200 #noisy 17230.2461 3 -1.0 17 3 14 3 -1.0 17 2 15 1 0.0100 8283.8315 3 -1.0 12 4 9 3 -1.0 12 2 10 1 0.0100 10116.9392 3 -1.0 13 4 10 3 -1.0 13 2 11 1 0.0100 11955.2468 3 -1.0 14 4 11 3 -1.0 14 2 12 1 0.0100 13768.4827 3 -1.0 15 4 12 3 -1.0 15 2 13 1 0.0100 15534.8515 3 -1.0 16 4 13 3 -1.0 16 2 14 1 0.0100 13685.1489 3 -1.0 3 3 1 3 -1.0 2 2 1 1 0.0050 #giant doublet 17212.9680 3 -1.0 4 3 2 3 -1.0 3 2 2 1 0.0050 21689.4823 3 -1.0 5 3 3 3 -1.0 4 2 3 1 0.0050 9191.5159 3 -1.0 6 2 4 3 -1.0 6 2 5 1 0.0100 13508.8314 3 -1.0 7 2 5 3 -1.0 7 2 6 1 0.0100 12978.1748 3 -1.0 3 3 0 3 -1.0 2 2 0 1 0.0050 20975.8900 3 -1.0 5 3 2 3 -1.0 4 2 2 1 0.0050 8075.5276 3 -1.0 12 3 9 3 -1.0 12 3 10 1 0.0100 10002.1513 3 -1.0 13 3 10 3 -1.0 13 3 11 1 0.0100 11894.2178 3 -1.0 14 3 11 3 -1.0 14 3 12 1 0.0100 13736.9888 3 -1.0 15 3 12 3 -1.0 15 3 13 1 0.0100 15519.0073 3 -1.0 16 3 13 3 -1.0 16 3 14 1 0.0100 17504.6262 3 -1.0 4 4 0 3 -1.0 3 3 0 1 0.0050 20404.0019 3 -1.0 5 4 1 3 -1.0 4 3 1 1 0.0050 #giant doublet 25251.3970 3 -1.0 6 4 2 3 -1.0 5 3 2 1 0.0050 18339.0350 3 -1.0 4 4 1 3 -1.0 3 3 1 1 0.0050 #giant doublet 21778.2628 3 -1.0 5 4 2 3 -1.0 4 3 2 1 0.0050 11540.1694 3 -1.0 8 4 4 3 -1.0 8 3 5 1 0.0100 12847.4094 3 -1.0 9 4 5 3 -1.0 9 3 6 1 0.0100 15103.1536 3 -1.0 10 4 6 3 -1.0 10 3 7 1 0.0100 17238.0231 3 -1.0 17 4 14 3 -1.0 17 3 15 1 0.0100 20405.6316 3 -1.0 19 4 16 3 -1.0 19 3 17 1 0.0200 11707.2490 3 -1.0 7 5 2 3 -1.0 7 3 5 1 0.0100 11707.2409 3 -1.0 7 5 2 3 -1.0 7 3 5 1 0.0200 13393.5743 3 -1.0 8 5 3 3 -1.0 8 3 6 1 0.0100 9495.9485 3 -1.0 10 6 5 3 -1.0 10 4 6 1 0.0100 11119.4047 3 -1.0 11 6 6 3 -1.0 11 4 7 1 0.0100 12593.9917 3 -1.0 12 6 7 3 -1.0 12 4 8 1 0.0100 14043.0591 3 -1.0 13 6 8 3 -1.0 13 4 9 1 0.0100 15510.0435 3 -1.0 14 6 9 3 -1.0 14 4 10 1 0.0100 16931.0419 3 -1.0 15 6 10 3 -1.0 15 4 11 1 0.0200 10975.0034 3 -1.0 8 5 4 3 -1.0 8 4 5 1 0.0100 13212.8309 3 -1.0 9 5 5 3 -1.0 9 4 6 1 0.0100 18153.3049 3 -1.0 11 5 7 3 -1.0 11 4 8 1 0.0100 26035.0939 3 -1.0 14 5 10 3 -1.0 14 4 11 1 0.0500 23052.7093 3 -1.0 5 5 1 3 -1.0 4 4 1 1 0.0050 #giant doublet 26506.2276 3 -1.0 6 5 2 3 -1.0 5 4 2 1 0.0050 24852.0239 3 -1.0 6 5 1 3 -1.0 5 4 1 1 0.0050 #giant doublet 9645.6970 3 -1.0 7 4 3 3 -1.0 7 4 4 1 0.0100 8195.3487 3 -1.0 5 5 1 3 -1.0 5 4 1 1 0.0100 8593.0173 3 -1.0 12 5 7 3 -1.0 12 5 8 1 0.0100 11326.6102 3 -1.0 13 5 8 3 -1.0 13 5 9 1 0.0100 13812.8818 3 -1.0 14 5 9 3 -1.0 14 5 10 1 0.0100 15945.1104 3 -1.0 15 5 10 3 -1.0 15 5 11 1 0.0100 12121.0905 3 -1.0 8 6 2 3 -1.0 8 5 3 1 0.0100 11114.5309 3 -1.0 9 6 3 3 -1.0 9 5 4 1 0.0100 11193.2896 3 -1.0 10 6 4 3 -1.0 10 5 5 1 0.0100 12448.2405 3 -1.0 11 6 5 3 -1.0 11 5 6 1 0.0100 14660.7734 3 -1.0 12 6 6 3 -1.0 12 5 7 1 0.0100 17175.1262 3 -1.0 23 6 17 3 -1.0 23 5 18 1 0.0100 20814.0646 3 -1.0 29 6 23 3 -1.0 29 5 24 1 0.0200 19614.5295 3 -1.0 19 6 14 3 -1.0 19 5 15 1 0.0200 11165.8759 3 -1.0 6 6 1 3 -1.0 6 5 1 1 0.0100 10506.5090 3 -1.0 10 7 4 3 -1.0 10 6 5 1 0.0100 10704.3338 3 -1.0 11 7 5 3 -1.0 11 6 6 1 0.0100 12245.1339 3 -1.0 12 7 6 3 -1.0 12 6 7 1 0.0100 14668.1114 3 -1.0 22 7 16 3 -1.0 22 6 17 1 0.0100 17222.4604 3 -1.0 23 7 17 3 -1.0 23 6 18 1 0.0100 21611.7102 3 -1.0 15 6 9 3 -1.0 15 6 10 1 0.0200 8955.8813 3 -1.0 15 7 8 3 -1.0 15 6 9 1 0.0100 9143.3928 3 -1.0 16 7 9 3 -1.0 16 6 10 1 0.0100 8318.7513 3 -1.0 18 8 10 3 -1.0 18 7 11 1 0.0100 11313.6324 3 -1.0 19 8 11 3 -1.0 19 7 12 1 0.0100 14581.6366 3 -1.0 21 8 13 3 -1.0 21 7 14 1 0.0100 14939.1531 3 -1.0 15 8 8 3 -1.0 15 7 9 1 0.0200 13100.4427 3 -1.0 20 8 13 3 -1.0 20 7 14 1 0.0100 13115.0151 3 -1.0 21 8 14 3 -1.0 21 7 15 1 0.0100 11721.5626 3 -1.0 23 9 14 3 -1.0 23 8 15 1 0.0200 11721.5645 3 -1.0 23 9 14 3 -1.0 23 8 15 1 0.0100 14536.9535 3 -1.0 24 9 15 3 -1.0 24 8 16 1 0.0100 9369.0884 3 -1.0 15 8 7 3 -1.0 15 8 8 1 0.0100 10967.6945 3 -1.0 16 9 7 3 -1.0 16 9 8 1 0.0100 10237.8034 3 -1.0 17 9 8 3 -1.0 17 9 9 1 0.0100 12193.4994 3 -1.0 18 9 9 3 -1.0 18 9 10 1 0.0100 14203.6053 3 -1.0 22 10 13 3 -1.0 22 9 14 1 0.0100 8513.2174 -3 -1.0 2 0 2 -3 -1.0 1 0 1 1 0.0050 !! m=-3! 12723.0622 -3 -1.0 3 0 3 -3 -1.0 2 0 2 1 0.0050 16877.7193 -3 -1.0 4 0 4 -3 -1.0 3 0 3 1 0.0050 20961.6418 -3 -1.0 5 0 5 -3 -1.0 4 0 4 1 0.0050 24963.9204 -3 -1.0 6 0 6 -3 -1.0 5 0 5 1 0.0050 9097.4572 -3 -1.0 2 1 1 -3 -1.0 1 1 0 1 0.0050 #giant doublet 13632.9094 -3 -1.0 3 1 2 -3 -1.0 2 1 1 1 0.0050 #giant doublet 18151.0691 -3 -1.0 4 1 3 -3 -1.0 3 1 2 1 0.0050 #giant doublet 22643.9567 -3 -1.0 5 1 4 -3 -1.0 4 1 3 1 0.0050 #giant doublet 7977.7921 -3 -1.0 2 1 2 -3 -1.0 1 1 1 1 0.0050 #giant doublet 11954.9221 -3 -1.0 3 1 3 -3 -1.0 2 1 2 1 0.0050 #giant doublet 15919.4783 -3 -1.0 4 1 4 -3 -1.0 3 1 3 1 0.0050 #giant doublet 19869.8834 -3 -1.0 5 1 5 -3 -1.0 4 1 4 1 0.0050 #giant doublet 23807.0282 -3 -1.0 6 1 6 -3 -1.0 5 1 5 1 0.0050 #giant doublet 8363.2376 -3 -1.0 5 1 4 -3 -1.0 5 1 5 1 0.0100 11658.1096 -3 -1.0 6 1 5 -3 -1.0 6 1 6 1 0.0100 8473.2851 -3 -1.0 10 2 8 -3 -1.0 10 2 9 1 0.0100 11610.0573 -3 -1.0 11 2 9 -3 -1.0 11 2 10 1 0.0100 12812.8261 -3 -1.0 3 2 2 -3 -1.0 2 2 1 1 0.0050 17063.1099 -3 -1.0 4 2 3 -3 -1.0 3 2 2 1 0.0050 21295.8534 -3 -1.0 5 2 4 -3 -1.0 4 2 3 1 0.0050 25507.0299 -3 -1.0 6 2 5 -3 -1.0 5 2 4 1 0.0050 12892.0270 -3 -1.0 3 2 1 -3 -1.0 2 2 0 1 0.0050 17260.0325 -3 -1.0 4 2 2 -3 -1.0 3 2 1 1 0.0050 21685.4289 -3 -1.0 5 2 3 -3 -1.0 4 2 2 1 0.0050 26175.9618 -3 -1.0 6 2 4 -3 -1.0 5 2 3 1 0.0050 17144.8780 -3 -1.0 4 3 1 -3 -1.0 3 3 0 1 0.0050 21456.0109 -3 -1.0 5 3 2 -3 -1.0 4 3 1 1 0.0050 25787.6472 -3 -1.0 6 3 3 -3 -1.0 5 3 2 1 0.0050 17140.6250 -3 -1.0 4 3 2 -3 -1.0 3 3 1 1 0.0050 21441.1666 -3 -1.0 5 3 3 -3 -1.0 4 3 2 1 0.0050 25748.3042 -3 -1.0 6 3 4 -3 -1.0 5 3 3 1 0.0050 9789.6866 -3 -1.0 15 3 12 -3 -1.0 15 3 13 1 0.0100 13169.6608 -3 -1.0 16 3 13 -3 -1.0 16 3 14 1 0.0100 17084.4930 -3 -1.0 17 3 14 -3 -1.0 17 3 15 1 0.0100 21418.8830 -3 -1.0 18 3 15 -3 -1.0 18 3 16 1 0.0100 25984.0791 -3 -1.0 19 3 16 -3 -1.0 19 3 17 1 0.0100 21439.5091 -3 -1.0 5 4 2 -3 -1.0 4 4 1 1 0.0050 25747.1714 -3 -1.0 6 4 3 -3 -1.0 5 4 2 1 0.0050 9032.6251 -3 -1.0 19 4 15 -3 -1.0 19 4 16 1 0.0100 12273.9621 -3 -1.0 20 4 16 -3 -1.0 20 4 17 1 0.0100 21439.7281 -3 -1.0 5 4 1 -3 -1.0 4 4 0 1 0.0050 8865.3682 -3 -1.0 23 5 18 -3 -1.0 23 5 19 1 0.0100 12076.3057 -3 -1.0 24 5 19 -3 -1.0 24 5 20 1 0.0100 25739.3154 -3 -1.0 6 5 1 -3 -1.0 5 5 0 1 0.0050 25739.3154 -3 -1.0 6 5 2 -3 -1.0 5 5 1 1 0.0050 15970.8547 -3 -1.0 22 0 22 3 -1.0 22 4 18 1 0.0100 !! m= +3 <- -3 ! 13852.9884 -3 -1.0 23 0 23 3 -1.0 23 4 19 1 0.0100 11479.6572 -3 -1.0 24 0 24 3 -1.0 24 4 20 1 0.0100 8956.5853 -3 -1.0 25 0 25 3 -1.0 25 4 21 1 0.0100 15973.7345 -3 -1.0 22 1 22 3 -1.0 22 5 18 1 0.0100 13853.8788 -3 -1.0 23 1 23 3 -1.0 23 5 19 1 0.0100 11479.8750 -3 -1.0 24 1 24 3 -1.0 24 5 20 1 0.0100 8956.5853 -3 -1.0 25 1 25 3 -1.0 25 5 21 1 0.0100 11579.2446 -3 -1.0 16 0 16 3 -1.0 16 7 10 1 0.0100 11251.3890 -3 -1.0 22 1 21 3 -1.0 22 7 15 1 0.0100 8012.4732 -3 -1.0 23 1 22 3 -1.0 23 7 16 1 0.0100 15458.6873 -3 -1.0 26 2 24 3 -1.0 26 8 18 1 0.0200 13792.2804 -3 -1.0 27 2 25 3 -1.0 27 8 19 1 0.0100 11169.2181 -3 -1.0 28 2 26 3 -1.0 28 8 20 1 0.0200 11726.6687 -3 -1.0 22 2 21 3 -1.0 22 8 15 1 0.0200 8088.9963 -3 -1.0 23 2 22 3 -1.0 23 8 16 1 0.0100 14043.9061 -3 -1.0 27 3 25 3 -1.0 27 9 19 1 0.0100 11241.2957 -3 -1.0 28 3 26 3 -1.0 28 9 20 1 0.0100 7974.5918 -3 -1.0 29 3 27 3 -1.0 29 9 21 1 0.0200 10526.6805 -3 -1.0 27 3 24 3 -1.0 27 12 15 1 0.0100 11438.4671 3 -1.0 21 6 15 -3 -1.0 21 1 20 1 0.0100 !! m= -3 <- +3 ! 11126.1558 3 -1.0 28 7 21 -3 -1.0 28 1 27 1 0.0100 11281.9545 3 -1.0 21 6 16 -3 -1.0 21 1 21 1 0.0500 10564.4233 3 -1.0 16 9 8 -3 -1.0 16 1 16 1 0.0100 8124.3007 3 -1.0 18 11 7 -3 -1.0 18 1 17 1 0.0100 14479.9208 3 -1.0 19 11 8 -3 -1.0 19 1 18 1 0.0500 B 9669.2884 3 -1.0 22 12 11 -3 -1.0 22 2 20 1 0.0100 10052.9627 3 -1.0 21 10 12 -3 -1.0 21 2 20 1 0.0100 11141.5703 3 -1.0 28 8 21 -3 -1.0 28 2 27 1 0.0100 14012.7732 3 -1.0 29 8 22 -3 -1.0 29 2 28 1 0.0100 11167.1221 3 -1.0 26 11 16 -3 -1.0 26 3 24 1 0.0100 10964.8262 3 -1.0 29 14 16 -3 -1.0 29 4 25 1 0.0100 8732.9536 3 -1.0 30 12 19 -3 -1.0 30 4 27 1 0.0100 4266.3395 0 -1.0 1 0 1 0 -1.0 0 0 0 1 0.0040 !! m=0 (ground state) from J.Mol.Spectrosc. 227 (2004) 109-113 ! 8410.4988 0 -1.0 2 0 2 0 -1.0 1 0 1 1 0.0020 9301.2799 0 -1.0 2 1 1 0 -1.0 1 1 0 1 0.0020 7764.0406 0 -1.0 2 1 2 0 -1.0 1 1 1 1 0.0020 12329.4745 0 -1.0 3 0 3 0 -1.0 2 0 2 1 0.0020 13868.4665 0 -1.0 3 1 2 0 -1.0 2 1 1 1 0.0020 4599.3872 0 -1.0 3 1 2 0 -1.0 3 1 3 1 0.0020 11574.9374 0 -1.0 3 1 3 0 -1.0 2 1 2 1 0.0020 13268.4949 0 -1.0 3 2 1 0 -1.0 2 2 0 1 0.0020 12798.9780 0 -1.0 3 2 2 0 -1.0 2 2 1 1 0.0050 14976.8857 0 -1.0 3 2 2 0 -1.0 3 0 3 1 0.0050 15993.2737 0 -1.0 4 0 4 0 -1.0 3 0 3 1 0.0020 18318.1440 0 -1.0 4 1 3 0 -1.0 3 1 2 1 0.0020 7601.1758 0 -1.0 4 1 3 0 -1.0 4 1 4 1 0.0020 15316.3559 0 -1.0 4 1 4 0 -1.0 3 1 3 1 0.0020 18040.6906 0 -1.0 4 2 2 0 -1.0 3 2 1 1 0.0020 16969.6845 0 -1.0 4 2 3 0 -1.0 3 2 2 1 0.0020 15953.3002 0 -1.0 4 2 3 0 -1.0 4 0 4 1 0.0050 17349.6663 0 -1.0 4 3 1 0 -1.0 3 3 0 1 0.0050 17276.9937 0 -1.0 4 3 2 0 -1.0 3 3 1 1 0.0050 19478.9282 0 -1.0 5 0 5 0 -1.0 4 0 4 1 0.0050 22585.4151 0 -1.0 5 1 4 0 -1.0 4 1 3 1 0.0050 11199.1733 0 -1.0 5 1 4 0 -1.0 5 1 5 1 0.0040 18987.4131 0 -1.0 5 1 5 0 -1.0 4 1 4 1 0.0050 22905.2699 0 -1.0 5 2 3 0 -1.0 4 2 2 1 0.0050 3507.2349 0 -1.0 5 2 3 0 -1.0 5 2 4 1 0.0020 21060.7211 0 -1.0 5 2 4 0 -1.0 4 2 3 1 0.0050 17535.0887 0 -1.0 5 2 4 0 -1.0 5 0 5 1 0.0050 21883.4223 0 -1.0 5 3 2 0 -1.0 4 3 1 1 0.0050 21638.4364 0 -1.0 5 3 3 0 -1.0 4 3 2 1 0.0050 21610.5624 0 -1.0 5 4 1 0 -1.0 4 4 0 1 0.0050 21602.4263 0 -1.0 5 4 2 0 -1.0 4 4 1 1 0.0050 22902.2770 0 -1.0 6 0 6 0 -1.0 5 0 5 1 0.0050 26600.7842 0 -1.0 6 1 5 0 -1.0 5 1 4 1 0.0050 15202.0546 0 -1.0 6 1 5 0 -1.0 6 1 6 1 0.0050 22597.9042 0 -1.0 6 1 6 0 -1.0 5 1 5 1 0.0050 25057.6627 0 -1.0 6 2 5 0 -1.0 5 2 4 1 0.0050 19690.4802 0 -1.0 6 2 5 0 -1.0 6 0 6 1 0.0050 26591.3467 0 -1.0 6 3 3 0 -1.0 5 3 2 1 0.0050 25983.3425 0 -1.0 6 3 4 0 -1.0 5 3 3 1 0.0050 24013.5201 0 -1.0 6 3 4 0 -1.0 6 1 5 1 0.0100 26038.0306 0 -1.0 6 4 2 0 -1.0 5 4 1 1 0.0050 26002.1409 0 -1.0 6 4 3 0 -1.0 5 4 2 1 0.0050 25907.2399 0 -1.0 6 5 1 0 -1.0 5 5 0 1 0.0050 25906.4705 0 -1.0 6 5 2 0 -1.0 5 5 1 1 0.0050 26332.2052 0 -1.0 7 0 7 0 -1.0 6 0 6 1 0.0050 26163.0410 0 -1.0 7 1 7 0 -1.0 6 1 6 1 0.0050 9583.2480 0 -1.0 7 2 5 0 -1.0 7 2 6 1 0.0050 23966.2875 0 -1.0 7 3 5 0 -1.0 7 1 6 1 0.0100 23486.2807 0 -1.0 8 1 7 0 -1.0 8 1 8 1 0.0100 13626.7634 0 -1.0 8 2 6 0 -1.0 8 2 7 1 0.0050 25272.7876 0 -1.0 8 2 7 0 -1.0 8 0 8 1 0.0100 24654.2837 0 -1.0 8 3 6 0 -1.0 8 1 7 1 0.0100 26102.5281 0 -1.0 9 3 7 0 -1.0 9 1 8 1 0.0100 10435.1666 0 -1.0 10 2 8 0 -1.0 9 4 5 1 0.0100 22758.9216 0 -1.0 10 2 8 0 -1.0 10 2 9 1 0.0050 10802.2396 0 -1.0 10 3 7 0 -1.0 10 3 8 1 0.0050 13741.2385 0 -1.0 11 2 9 0 -1.0 10 4 6 1 0.0100 15243.8007 0 -1.0 11 3 8 0 -1.0 11 3 9 1 0.0100 15229.1031 0 -1.0 12 2 10 0 -1.0 11 4 7 1 0.0100 20180.3234 0 -1.0 12 3 9 0 -1.0 12 3 10 1 0.0050 14806.7501 0 -1.0 13 2 11 0 -1.0 12 4 8 1 0.0100 15321.9580 0 -1.0 13 3 10 0 -1.0 12 5 7 1 0.0100 11441.3017 0 -1.0 13 4 9 0 -1.0 13 4 10 1 0.0050 12630.6526 0 -1.0 14 2 12 0 -1.0 13 4 9 1 0.0100 19692.9902 0 -1.0 14 3 11 0 -1.0 13 5 8 1 0.0050 16206.6671 0 -1.0 14 4 10 0 -1.0 14 4 11 1 0.0050 22157.7171 0 -1.0 15 3 12 0 -1.0 14 5 9 1 0.0100 12999.4059 0 -1.0 15 4 11 0 -1.0 14 6 8 1 0.0100 21561.6830 0 -1.0 15 4 11 0 -1.0 15 4 12 1 0.0050 22509.0012 0 -1.0 16 3 13 0 -1.0 15 5 10 1 0.0100 11624.6829 0 -1.0 16 5 11 0 -1.0 16 5 12 1 0.0050 20825.7789 0 -1.0 17 3 14 0 -1.0 16 5 11 1 0.0100 16625.1583 0 -1.0 17 5 12 0 -1.0 17 5 13 1 0.0050 16125.9059 0 -1.0 18 5 13 0 -1.0 17 7 10 1 0.0100 11452.1510 0 -1.0 19 6 13 0 -1.0 19 6 14 1 0.0050 16590.6044 0 -1.0 20 6 14 0 -1.0 20 6 15 1 0.0050 22573.4742 0 -1.0 21 6 15 0 -1.0 21 6 16 1 0.0050 11009.8539 0 -1.0 22 7 15 0 -1.0 22 7 16 1 0.0050 15802.4417 0 -1.0 23 4 19 0 -1.0 22 6 16 1 0.0100 16186.0231 0 -1.0 23 7 16 0 -1.0 23 7 17 1 0.0050 10373.5939 0 -1.0 25 8 17 0 -1.0 25 8 18 1 0.0050 12503.8790 0 -1.0 26 8 18 0 -1.0 25 10 15 1 0.0100 15489.5858 0 -1.0 26 8 18 0 -1.0 26 8 19 1 0.0050 23081.7605 0 -1.0 27 8 19 0 -1.0 26 10 16 1 0.0100 9609.3591 0 -1.0 28 9 19 0 -1.0 28 9 20 1 0.0050 13650.8851 0 -1.0 29 9 20 0 -1.0 28 11 17 1 0.0100 14575.0694 0 -1.0 29 9 20 0 -1.0 29 9 21 1 0.0050 10794.5711 0 -1.0 30 8 23 0 -1.0 29 10 20 1 0.0100 24660.7507 0 -1.0 30 9 21 0 -1.0 29 11 18 1 0.0100 20800.9569 0 -1.0 30 9 21 0 -1.0 30 9 22 1 0.0050 -1 --------------------------------------------------------------------------------- muz , 0, 1, 0, 0, 0, 0, 0, 0.37500000000000000E+00 , 0, 0, chi_aa , 0, 2, 0, 0, 0, 0, 0, 0.00000000000000000E-00 , -1, 0, chi_aa , 0, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , -1, -1, chi_bb , 0, 0, 2, 0, 0, 0, 0, 0.00000000000000000E-00 , -1, 0, chi_bb , 0, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , -1, -1, 0.5*V6 , 0, 0, 0, 0, 0, 0, 0, 0.24189180874980099E+01 , 1, 1, 0.5*V6 , 0, 0, 0, 0, 0, 2, 0, 0.10000000000000000E+01 , 1, -1, A-0.5(B+C) , 0, 2, 0, 0, 0, 0, 0, 0.11996110827918570E+00 , 2, 1, 0.5(B+C) , 1, 0, 0, 0, 0, 0, 0, 0.71155569872345753E-01 , 2, 1, 0.5(B-C) , 0, 0, 2, 0, 0, 0, 0, 0.12818373263691092E-01 , 2, 1, 0.5(B-C) , 0, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , 2, -1, F , 0, 0, 0, 0, 2, 0, 0, 0.54669559256922371E+01 , 1, 1, -2*RHO*F , 0, 1, 0, 0, 1, 0, 0, -0.37976551061658992E+00 , 1, 1, -DJ , 2, 0, 0, 0, 0, 0, 0, -0.41956612542907227E-08 , 2, 1, -DJK , 1, 2, 0, 0, 0, 0, 0, -0.12096216604594054E-07 , 2, 1, -DK , 0, 4, 0, 0, 0, 0, 0, -0.26469903842770360E-07 , 2, 1, -2*dj , 1, 0, 2, 0, 0, 0, 0, -0.26901102042687929E-08 , 2, 1, -2*dj , 1, 0, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , 2, -1, -2*dk , 0, 2, 2, 0, 0, 0, 0, -0.29942468837773131E-07 , 2, 1, -2*dk , 0, 2, 0, 2, 0, 0, 0, -0.10000000000000000E+01 , 2, -1, FJ , 1, 0, 0, 0, 2, 0, 0, -0.36765673069131763E-06 , 2, 1, FK , 0, 2, 0, 0, 2, 0, 0, -0.35922872106083025E-05 , 2, 1, RHOm , 0, 1, 0, 0, 3, 0, 0, 0.72376788246234357E-04 , 1, 1, RHOJ , 1, 1, 0, 0, 1, 0, 0, 0.11249708485973429E-06 , 2, 1, RHO3c , 0, 0, 0, 1, 1, 0, 1, -0.85536154961407540E-02 , 2, 1, RHOmm , 0, 1, 0, 0, 5, 0, 0, 0.22684463656155936E-05 , 2, 1, RHObc , 0, 1, 2, 0, 1, 0, 0, 0.51244681659514855E-07 , 2, 1, RHObc , 0, 1, 0, 2, 1, 0, 0, -0.10000000000000000E+01 , 2, -1, FmK , 0, 2, 0, 0, 4, 0, 0, -0.18482241411381347E-06 , 2, 1, RHOK , 0, 3, 0, 0, 1, 0, 0, 0.12788198693861360E-06 , 2, 1, RHOmK , 0, 3, 0, 0, 3, 0, 0, 0.32967722809749374E-07 , 2, 1, V6J , 1, 0, 0, 0, 0, 2, 0, -0.55186002627101790E-05 , 2, 1, FKK , 0, 4, 0, 0, 2, 0, 0, -0.10364559838050991E-08 , 2, 1, FmJ , 1, 0, 0, 0, 4, 0, 0, 0.19821776548242004E-08 , 2, 1, FJK , 1, 2, 0, 0, 2, 0, 0, 0.12439392391978285E-09 , 2, 1, D6bc , 0, 0, 1, 1, 0, 0, 2, 0.86516975013276737E-05 , 2, 1, D3ab , 0, 1, 1, 0, 0, 1, 0, 0.20475955231328541E-03 , 2, 1, RHOmmK , 0, 3, 0, 0, 5, 0, 0, -0.19671451125943781E-08 , 2, 1,