Pgopher 8.0.323 02 Mar 2015 21:09 64 bit Unicode (Delphi 24/24) Mixture: NH2D_B1X0_fit.pgo Units cm1 PrintLevel Detail Precision 3 BasisOrder boDiagonal QuantumNumberFormat J FitCycles 1 FitDetails False AutoReplot True AllowComplex True NoLineList False ShowEstUnc False ShowDerivatives False SVDlimit 5 ShowSubBasis False SVDThresh 1E-15 ScaleChanges 1 SmallE 2E-18 Species: NH3 Jmax 15 Concentration 1 AsymmetricMolecule: NH2D JAdjustSym True BlockMatrix True PointGroup C2v Representation IIIr SReduction True eeWt 1 eoWt 1 oeWt 3 ooWt 3 C2zAxis a C2xAxis c PseudoC2v False FakeSym False PhaseAdjust False Abundance 1 AsymmetricManifold: X Initial True EigenSearch True LimitSearch True AutoQConverge True UsePopParams False AsymmetricTop: X v=0 Symmetry A1 Kmin all Kmax all A 9.67729453687591 B 6.41088811513731 C 4.69666616829967 DK 0.00036523212668 DJK -0.00079847331583 DJ 0.00052744084375 deltaK 4.46759471180559E-6 deltaJ -0.0001393532405 HK -1.28669437708136E-7 HKJ 2.97174100357121E-7 HJK -2.87431477012007E-7 HJ 1.21678884930454E-7 phiK 1.1271594764402E-9 phiJK 1.35014570646737E-8 phiJ 6.07762757660835E-8 LK -4.60290098425358E-11 LKKJ 1.69190580504864E-10 LJK -1.67097265669038E-10 LJJK 9.39089535067623E-11 LJ -3.12213157810661E-11 llJ -1.15660648140788E-11 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1)))/4 = (N*(N+1)-K^2)/2 = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1)))/4 = (-sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))))/4 = (N*(N+1)-K^2)/2 = (-sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))))/4 = K^2 = -K^4 = -N*(N+1)*K^2 = -N^2*(N+1)^2 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)+(-K+2)*(K-3))*(N*(N+1)+(-K+3)*(K-4))*(N*(N+1)-K*(K-1))) = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)+(-K-2)*(K+3))*(N*(N+1)+(-K-3)*(K+4))*(N*(N+1)-K*(K+1))) = N*(N+1)*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))) = N*(N+1)*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))) = K^6 = N*(N+1)*K^4 = N^2*(N+1)^2*K^2 = N^3*(N+1)^3 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)+(-K+2)*(K-3))*(N*(N+1)+(-K+3)*(K-4))*(N*(N+1)+(-K+4)*(K-5))*(N*(N+1)+(-K+5)*(K-6))*(N*(N+1)-K*(K-1))) = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)+(-K-2)*(K+3))*(N*(N+1)+(-K-3)*(K+4))*(N*(N+1)+(-K-4)*(K+5))*(N*(N+1)+(-K-5)*(K+6))*(N*(N+1)-K*(K+1))) = N*(N+1)*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)+(-K+2)*(K-3))*(N*(N+1)+(-K+3)*(K-4))*(N*(N+1)-K*(K-1))) = N*(N+1)*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)+(-K-2)*(K+3))*(N*(N+1)+(-K-3)*(K+4))*(N*(N+1)-K*(K+1))) = N^2*(N+1)^2*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))) = N^2*(N+1)^2*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))) = K^8 = N*(N+1)*K^6 = N^2*(N+1)^2*K^4 = N^3*(N+1)^3*K^2 = N^4*(N+1)^4 = N^3*(N+1)^3*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))) = N^3*(N+1)^3*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))) AsymmetricTop: X v=1 Symmetry B1 Kmin all Kmax all Origin 0.4059278489254 A 9.67416903463261 B 6.40974892477115 C 4.69741338522932 DK 0.00035797749455 DJK -0.000785659778 DJ 0.00052127554856 deltaK 4.86134277600806E-6 deltaJ -0.00013663511374 HK -1.17038274525238E-7 HKJ 2.72300626055109E-7 HJK -2.62163373035889E-7 HJ 1.09952145627359E-7 phiK 1.27123508223813E-9 phiJK 1.19194903161973E-8 phiJ 5.41259753772725E-8 LK -2.61759753809417E-11 LKKJ 1.1950267274569E-10 LJK -1.19857084596838E-10 LJJK 6.66475939164554E-11 LJ -2.12893047496212E-11 llJ -7.62986505817968E-12 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1)))/4 = (N*(N+1)-K^2)/2 = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1)))/4 = (-sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))))/4 = (N*(N+1)-K^2)/2 = (-sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))))/4 = K^2 = -K^4 = -N*(N+1)*K^2 = -N^2*(N+1)^2 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)+(-K+2)*(K-3))*(N*(N+1)+(-K+3)*(K-4))*(N*(N+1)-K*(K-1))) = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)+(-K-2)*(K+3))*(N*(N+1)+(-K-3)*(K+4))*(N*(N+1)-K*(K+1))) = N*(N+1)*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))) = N*(N+1)*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))) = K^6 = N*(N+1)*K^4 = N^2*(N+1)^2*K^2 = N^3*(N+1)^3 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)+(-K+2)*(K-3))*(N*(N+1)+(-K+3)*(K-4))*(N*(N+1)+(-K+4)*(K-5))*(N*(N+1)+(-K+5)*(K-6))*(N*(N+1)-K*(K-1))) = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)+(-K-2)*(K+3))*(N*(N+1)+(-K-3)*(K+4))*(N*(N+1)+(-K-4)*(K+5))*(N*(N+1)+(-K-5)*(K+6))*(N*(N+1)-K*(K+1))) = N*(N+1)*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)+(-K+2)*(K-3))*(N*(N+1)+(-K+3)*(K-4))*(N*(N+1)-K*(K-1))) = N*(N+1)*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)+(-K-2)*(K+3))*(N*(N+1)+(-K-3)*(K+4))*(N*(N+1)-K*(K+1))) = N^2*(N+1)^2*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))) = N^2*(N+1)^2*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))) = K^8 = N*(N+1)*K^6 = N^2*(N+1)^2*K^4 = N^3*(N+1)^3*K^2 = N^4*(N+1)^4 = N^3*(N+1)^3*sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))) = N^3*(N+1)^3*sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))) AsymmetricTopPerturbation: X Value -0.17160591811819 = (sqrt(N*(N+1)-K*(K-1))*(2*K-1))/2 = (sqrt(N*(N+1)-K*(K+1))*(2*K+1))/2 AsymmetricManifold: B Initial True EigenSearch True LimitSearch True AutoQConverge True UsePopParams False AsymmetricTop: B A2 Colour Navy Symmetry B2 Kmin all Kmax all Origin 60092.5507428415 Float, Increment = 0.1 A 9.41285777136262 Float, Increment = 0.001 B 6.53113830009342 Float, Increment = 0.001 C 3.96664111884694 Float, Increment = 0.001 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1)))/4 = (N*(N+1)-K^2)/2 = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1)))/4 = (-sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))))/4 = (N*(N+1)-K^2)/2 = (-sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))))/4 = K^2 AsymmetricTop: B B1 Colour Maroon Symmetry A1 Kmin all Kmax all Origin 60125.0439242394 Float, Increment = 0.1 A 10.1346853770108 Float, Increment = 0.001 B 6.21037210393728 Float, Increment = 0.001 C 3.96664111884694 Float, Increment = 0.001 = sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1)))/4 = (N*(N+1)-K^2)/2 = sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1)))/4 = (-sqrt((N*(N+1)+(-K+1)*(K-2))*(N*(N+1)-K*(K-1))))/4 = (N*(N+1)-K^2)/2 = (-sqrt((N*(N+1)+(-K-1)*(K+2))*(N*(N+1)-K*(K+1))))/4 = K^2 AsymmetricTopPerturbation: B Value -6.54478069198945 Float = K AsymmetricTopPerturbation: B Value 0.678403186264876 Float = (-sqrt((-N*(N+1)+(K-1)*(K-2))*(N*(N+1)-K*(K-1))))/2 = sqrt((-N*(N+1)+(K+1)*(K+2))*(N*(N+1)-K*(K+1)))/2 TransitionMoments: SphericalTransitionMoment: Rank 2 Component 1 Strength 1 Reduced Matrix Elements of = -1^(2*N-2*K-5)*sqrt(((N-K)*(N+K)*(N+K-1)*(N+K-2))/(N*(2*N-1)*(N-1))) = -1^(2*N-2*K-7)*sqrt(((N-K)*(N-K-1)*(N-K-2)*(N+K))/(N*(2*N-1)*(N-1))) = -1^(2*N-2*K-3)*(N-2*K+1)*sqrt(((N+K)*(N+K-1))/(2*N*(N-1)*(N+1))) = -1^(2*N-2*K-5)*(-N-2*K-1)*sqrt(((N-K)*(N-K-1))/(2*N*(N-1)*(N+1))) = (-1^(2*N-2*K-1)*(2*N+1)*sqrt((6*(N-K+1)*(N+K))/(N*(2*N-1)*(2*N+1)*(2*N+3)*(N+1)))*(-2*K+1))/2 = (-1^(2*N-2*K-3)*(2*N+1)*sqrt((6*(N-K)*(N+K+1))/(N*(2*N-1)*(2*N+1)*(2*N+3)*(N+1)))*(2*K+1))/2 = -1^(2*N-2*K+1)*(-N-2*K)*sqrt(((N-K+1)*(N-K+2))/(2*N*(N+1)*(N+2))) = -1^(2*N-2*K-1)*(N-2*K)*sqrt(((N+K+1)*(N+K+2))/(2*N*(N+1)*(N+2))) = -1^(2*(N-K+2))*sqrt(((N-K+1)*(N-K+2)*(N-K+3)*(N+K+1))/((2*N+3)*(N+1)*(N+2))) = -1^(2*(N-K+1))*sqrt(((N-K+1)*(N+K+1)*(N+K+2)*(N+K+3))/((2*N+3)*(N+1)*(N+2))) Line Strengths from = (-1^(2*(2*N-2*K-5))*(N-K)*(N+K)*(N+K-1)*(N+K-2))/(N*(2*N-1)*(N-1)) = (-1^(2*(2*N-2*K-7))*(N-K)*(N-K-1)*(N-K-2)*(N+K))/(N*(2*N-1)*(N-1)) = (-1^(2*(2*N-2*K-3))*(N-2*K+1)^2*(N+K)*(N+K-1))/(2*N*(N-1)*(N+1)) = (-1^(2*(2*N-2*K-5))*(-N-2*K-1)^2*(N-K)*(N-K-1))/(2*N*(N-1)*(N+1)) = (3*-1^(2*(2*N-2*K-1))*(2*N+1)*(N-K+1)*(N+K)*(-2*K+1)^2)/(2*N*(2*N-1)*(2*N+3)*(N+1)) = (3*-1^(2*(2*N-2*K-3))*(2*N+1)*(N-K)*(N+K+1)*(2*K+1)^2)/(2*N*(2*N-1)*(2*N+3)*(N+1)) = (-1^(2*(2*N-2*K+1))*(-N-2*K)^2*(N-K+1)*(N-K+2))/(2*N*(N+1)*(N+2)) = (-1^(2*(2*N-2*K-1))*(N-2*K)^2*(N+K+1)*(N+K+2))/(2*N*(N+1)*(N+2)) = (-1^(4*(N-K+2))*(N-K+1)*(N-K+2)*(N-K+3)*(N+K+1))/((2*N+3)*(N+1)*(N+2)) = (-1^(4*(N-K+1))*(N-K+1)*(N+K+1)*(N+K+2)*(N+K+3))/((2*N+3)*(N+1)*(N+2)) SphericalTransitionMoment: Rank 2 Component -1 Strength 1 Reduced Matrix Elements of = -1^(2*(N-K-2))*sqrt(((N-K)*(N+K)*(N+K-1)*(N+K-2))/(N*(2*N-1)*(N-1))) = -1^(2*N-2*K-7)*sqrt(((N-K)*(N-K-1)*(N-K-2)*(N+K))/(N*(2*N-1)*(N-1))) = -1^(2*(N-K-1))*(N-2*K+1)*sqrt(((N+K)*(N+K-1))/(2*N*(N-1)*(N+1))) = -1^(2*N-2*K-5)*(-N-2*K-1)*sqrt(((N-K)*(N-K-1))/(2*N*(N-1)*(N+1))) = (-1^(2*(N-K))*(2*N+1)*sqrt((6*(N-K+1)*(N+K))/(N*(2*N-1)*(2*N+1)*(2*N+3)*(N+1)))*(-2*K+1))/2 = (-1^(2*N-2*K-3)*(2*N+1)*sqrt((6*(N-K)*(N+K+1))/(N*(2*N-1)*(2*N+1)*(2*N+3)*(N+1)))*(2*K+1))/2 = -1^(2*(N-K+1))*(-N-2*K)*sqrt(((N-K+1)*(N-K+2))/(2*N*(N+1)*(N+2))) = -1^(2*N-2*K-1)*(N-2*K)*sqrt(((N+K+1)*(N+K+2))/(2*N*(N+1)*(N+2))) = -1^(2*N-2*K+5)*sqrt(((N-K+1)*(N-K+2)*(N-K+3)*(N+K+1))/((2*N+3)*(N+1)*(N+2))) = -1^(2*(N-K+1))*sqrt(((N-K+1)*(N+K+1)*(N+K+2)*(N+K+3))/((2*N+3)*(N+1)*(N+2))) Line Strengths from = (-1^(4*(N-K-2))*(N-K)*(N+K)*(N+K-1)*(N+K-2))/(N*(2*N-1)*(N-1)) = (-1^(2*(2*N-2*K-7))*(N-K)*(N-K-1)*(N-K-2)*(N+K))/(N*(2*N-1)*(N-1)) = (-1^(4*(N-K-1))*(N-2*K+1)^2*(N+K)*(N+K-1))/(2*N*(N-1)*(N+1)) = (-1^(2*(2*N-2*K-5))*(-N-2*K-1)^2*(N-K)*(N-K-1))/(2*N*(N-1)*(N+1)) = (3*-1^(4*(N-K))*(2*N+1)*(N-K+1)*(N+K)*(-2*K+1)^2)/(2*N*(2*N-1)*(2*N+3)*(N+1)) = (3*-1^(2*(2*N-2*K-3))*(2*N+1)*(N-K)*(N+K+1)*(2*K+1)^2)/(2*N*(2*N-1)*(2*N+3)*(N+1)) = (-1^(4*(N-K+1))*(-N-2*K)^2*(N-K+1)*(N-K+2))/(2*N*(N+1)*(N+2)) = (-1^(2*(2*N-2*K-1))*(N-2*K)^2*(N+K+1)*(N+K+2))/(2*N*(N+1)*(N+2)) = (-1^(2*(2*N-2*K+5))*(N-K+1)*(N-K+2)*(N-K+3)*(N+K+1))/((2*N+3)*(N+1)*(N+2)) = (-1^(4*(N-K+1))*(N-K+1)*(N+K+1)*(N+K+2)*(N+K+3))/((2*N+3)*(N+1)*(N+2)) Simulation: Simulation Intensity factor:0.333333333333333 (1 from Spol) IntensityUnits Normalized LifeModel lmNone PlotUnits cm1 nDF 2000 WidthMult 6 AutoMin True AutoMax True ShowSum False ShowParts True ShowFortrat False UseUpper False ShowSymmetry True ShowDeltaJ True ScaleMarkSize True UseSymmetry False UseStateNumber False FortratQno J Fmin 60057.8318688789 Fmax 60241.5014879547 Ymin 2.71939904443527E-7 Ymax 0.0519343500441513 Temperature 20 Lorentzian 0.9 SMargin -1 OThreshold 1E-6 Tvib -3.335640952E-5 Tspin 300 PlotSplit 0.5 Fundamental Constants from CODATA 2010: h=6.62606957E-34 k=1.3806488E-23 NA=6.02214129E23 e=1.602176565E-19 me=9.10938291E-31 Residuals before fit for NH2D for the B - X Transition J'S' #' J"S" #" Observed Calculated Obs-Calc StdDev 1 E- 1 1 E- 1 60093.750 60093.719 0.031 1.00000 :B A2 1 1 0 - X v=1 1 1 1:: .00524 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 6:NH2D_B1X0.lin 1 O- 1 1 O- 2 60087.973 60088.027 -0.054 1.00000 :B A2 1 1 1 - X v=1 1 1 0:: .00664 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 7:NH2D_B1X0.lin 2 E- 1 1 E+ 1 60107.029 60107.220 -0.191 1.00000 :B A2 2 0 2 - X v=1 1 0 1:: .00876 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 8:NH2D_B1X0.lin 2 E- 1 2 E- 2 60068.567 60068.519 0.048 1.00000 :B A2 2 0 2 - X v=1 2 2 1:: .00276 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 9:NH2D_B1X0.lin 2 O+ 1 1 O- 2 60114.668 60114.512 0.156 1.00000 :B A2 2 1 1 - X v=1 1 1 0:: .00335 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 10:NH2D_B1X0.lin 2 E+ 1 1 E- 1 60104.817 60104.826 -0.009 1.00000 :B A2 2 1 2 - X v=1 1 1 1:: .00546 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 11:NH2D_B1X0.lin 2 E+ 1 2 E+ 2 60079.197 60079.197 -0.000 1.00000 :B A2 2 1 2 - X v=1 2 1 1:: .00157 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 12:NH2D_B1X0.lin 2 E- 2 1 E+ 1 60129.572 60129.579 -0.007 1.00000 :B A2 2 2 0 - X v=1 1 0 1:: .04442 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 13:NH2D_B1X0.lin 2 O- 1 0 O- 1 60138.278 60138.427 -0.149 1.00000 :B A2 2 2 1 - X v=1 0 0 0:: .10769 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 14:NH2D_B1X0.lin 2 O- 1 2 O- 1 60105.503 60105.647 -0.144 1.00000 :B A2 2 2 1 - X v=1 2 0 2:: .00401 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 15:NH2D_B1X0.lin 3 O+ 1 2 O- 1 60108.711 60108.791 -0.080 1.00000 :B A2 3 0 3 - X v=1 2 0 2:: .00715 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 16:NH2D_B1X0.lin 3 O+ 1 2 O- 3 60091.254 60091.250 0.004 1.00000 :B A2 3 0 3 - X v=1 2 2 0:: .00060 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 17:NH2D_B1X0.lin 3 E- 1 1 E- 1 60148.466 60148.273 0.193 1.00000 :B A2 3 1 2 - X v=1 1 1 1:: .00424 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 18:NH2D_B1X0.lin 3 O- 1 2 O+ 1 60107.029 60106.894 0.135 1.00000 :B A2 3 1 3 - X v=1 2 1 2:: .00281 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 19:NH2D_B1X0.lin 3 O+ 2 2 O- 1 60141.758 60141.711 0.047 1.00000 :B A2 3 2 1 - X v=1 2 0 2:: .00819 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 20:NH2D_B1X0.lin 3 E+ 1 1 E+ 1 60155.208 60155.298 -0.090 1.00000 :B A2 3 2 2 - X v=1 1 0 1:: .04149 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 21:NH2D_B1X0.lin 3 E- 2 1 E- 1 60176.405 60176.402 0.003 1.00000 :B A2 3 3 0 - X v=1 1 1 1:: .00975 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 22:NH2D_B1X0.lin 3 O- 2 1 O- 2 60173.749 60173.711 0.038 1.00000 :B A2 3 3 1 - X v=1 1 1 0:: .01142 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 23:NH2D_B1X0.lin 4 O- 1 2 O- 1 60170.469 60170.383 0.086 1.00000 :B A2 4 2 3 - X v=1 2 0 2:: .01056 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 24:NH2D_B1X0.lin 4 E- 4 2 E- 2 60209.197 60209.029 0.168 1.00000 :B A2 4 4 0 - X v=1 2 2 1:: .00418 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 25:NH2D_B1X0.lin 4 O- 3 2 O- 3 60208.404 60208.205 0.199 1.00000 :B A2 4 4 1 - X v=1 2 2 0:: .00449 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 26:NH2D_B1X0.lin 5 E+ 1 3 E+ 1 60183.881 60183.897 -0.016 1.00000 :B A2 5 2 4 - X v=1 3 0 3:: .00127 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 27:NH2D_B1X0.lin 5 O+ 4 3 O+ 2 60226.911 60227.028 -0.117 1.00000 :B A2 5 4 1 - X v=1 3 2 2:: .00028 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 28:NH2D_B1X0.lin 5 E+ 3 3 E+ 3 60222.418 60222.645 -0.227 1.00000 :B A2 5 4 2 - X v=1 3 2 1:: .00037 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 29:NH2D_B1X0.lin 0 E+ 1 2 E+ 2 60084.725 60084.639 0.086 1.00000 :B B1 0 0 0 - X v=1 2 1 1:: .00092 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 32:NH2D_B1X0.lin 1 O- 2 1 O- 2 60120.096 60120.138 -0.042 1.00000 :B B1 1 0 1 - X v=1 1 1 0:: .00262 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 33:NH2D_B1X0.lin 1 E+ 1 1 E+ 1 60129.572 60129.883 -0.311 1.00000 :B B1 1 1 0 - X v=1 1 0 1:: .01991 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 34:NH2D_B1X0.lin 1 O+ 2 2 O- 3 60089.728 60089.581 0.147 1.00000 :B B1 1 1 1 - X v=1 2 2 0:: .00053 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 35:NH2D_B1X0.lin 2 E+ 2 1 E- 1 60144.359 60144.312 0.047 1.00000 :B B1 2 0 2 - X v=1 1 1 1:: .00411 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 36:NH2D_B1X0.lin 2 O- 2 0 O- 1 60165.570 60165.448 0.122 1.00000 :B B1 2 1 1 - X v=1 0 0 0:: .03795 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 37:NH2D_B1X0.lin 2 O- 2 2 O- 1 60132.580 60132.669 -0.089 1.00000 :B B1 2 1 1 - X v=1 2 0 2:: .00513 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 38:NH2D_B1X0.lin 2 E- 3 3 E+ 1 60097.558 60097.537 0.021 1.00000 :B B1 2 1 2 - X v=1 3 0 3:: .00115 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 39:NH2D_B1X0.lin 2 E+ 3 1 E- 1 60162.307 60162.229 0.078 1.00000 :B B1 2 2 0 - X v=1 1 1 1:: .00494 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 40:NH2D_B1X0.lin 2 O+ 2 1 O- 2 60160.327 60160.316 0.011 1.00000 :B B1 2 2 1 - X v=1 1 1 0:: .00180 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 41:NH2D_B1X0.lin 3 O- 3 1 O- 2 60175.177 60174.925 0.252 1.00000 :B B1 3 0 3 - X v=1 1 1 0:: .00265 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 42:NH2D_B1X0.lin 3 E+ 2 1 E+ 1 60190.078 60190.085 -0.007 1.00000 :B B1 3 1 2 - X v=1 1 0 1:: .01467 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 43:NH2D_B1X0.lin 3 O+ 3 2 O- 1 60160.327 60160.432 -0.105 1.00000 :B B1 3 1 3 - X v=1 2 0 2:: .00106 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 44:NH2D_B1X0.lin 3 O- 4 1 O- 2 60197.189 60197.152 0.037 1.00000 :B B1 3 2 1 - X v=1 1 1 0:: .00257 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 45:NH2D_B1X0.lin 3 E- 3 1 E- 1 60197.189 60197.695 -0.506 1.00000 :B B1 3 2 2 - X v=1 1 1 1:: .00130 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 46:NH2D_B1X0.lin 3 E+ 3 1 E+ 1 60221.813 60221.697 0.116 1.00000 :B B1 3 3 0 - X v=1 1 0 1:: .00138 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 47:NH2D_B1X0.lin 3 E+ 3 2 E- 2 60182.967 60182.995 -0.028 1.00000 :B B1 3 3 0 - X v=1 2 2 1:: .00193 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 48:NH2D_B1X0.lin 3 O+ 4 2 O- 1 60199.949 60199.999 -0.050 1.00000 :B B1 3 3 1 - X v=1 2 0 2:: .00111 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 49:NH2D_B1X0.lin 3 O+ 4 2 O- 3 60182.536 60182.458 0.078 1.00000 :B B1 3 3 1 - X v=1 2 2 0:: .00154 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 50:NH2D_B1X0.lin 4 O- 2 2 O- 1 60214.862 60214.785 0.077 1.00000 :B B1 4 1 3 - X v=1 2 0 2:: .00307 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 51:NH2D_B1X0.lin 4 E+ 4 2 E+ 2 60220.676 60220.661 0.015 1.00000 :B B1 4 2 2 - X v=1 2 1 1:: .00077 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 52:NH2D_B1X0.lin 4 E- 5 3 E+ 1 60218.332 60218.305 0.027 1.00000 :B B1 4 3 2 - X v=1 3 0 3:: .00019 : v1_074_NH2D_664-666_laser_corrected.dat - Overlays : 53:NH2D_B1X0.lin SVD fit: 46 Observations, 9 Parameters Initial Average Error: 0.151113225269728 Predicted New Error: 0.151113225269728 Parameters: # Old New Std Dev Change/Std Sens Summary Name 1 60092.5507428415 60092.5507428383 .07152425 0.0000 .002640 60092.551(72) B A2 Origin 2 9.41285777136262 9.41285777203107 .01218767 0.0000 .000429 9.413(12) B A2 A 3 6.53113830009342 6.53113830100763 .01508249 0.0000 .000539 6.531(15) B A2 B 4 3.96664111884694 3.96664111865508 .00973339 0.0000 .000372 3.9666(97) B A2 C 5 60125.0439242394 60125.0439242400 .07075870 0.0000 .002626 60125.044(71) B B1 Origin 6 10.1346853770108 10.1346853766916 .01181544 0.0000 .000548 10.135(12) B B1 A 7 6.21037210393728 6.21037210388937 .01250301 0.0000 .000531 6.210(13) B B1 B 8 -6.54478069198945 -6.54478069110437 .03394647 0.0000 .001448 -6.545(34) B Value 9 .678403186264876 .678403187701682 .01426429 0.0000 .000562 0.678(14) B Value Constraints: NH3.NH2D.B.B1.C := NH3.NH2D.B.A2.C Correlation Matrix 1 2 3 4 5 6 7 8 9 1 1.000 2 -0.563 1.000 3 -0.390 0.024 1.000 4 -0.122 0.035 -0.293 1.000 5 -0.265 0.229 0.212 -0.389 1.000 6 0.287 -0.376 -0.234 0.232 -0.653 1.000 7 0.154 -0.251 -0.174 -0.406 -0.253 0.023 1.000 8 -0.351 0.232 0.007 -0.502 0.418 -0.281 0.386 1.000 9 -0.433 0.639 0.501 -0.170 0.216 -0.389 -0.176 0.257 1.000