37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Thu Sep 18 23:55:43 2008 60 1028 11 0 0.0000E+000 1.0000E+001 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162257611808139E+004 1.00000000E+001 /A 20000 2.701266431974198E+003 1.00000000E+001 /B 30000 2.228065208710473E+003 1.00000000E+001 /C 200 -5.185616023127050E-004 1.00000000E+000 /-DJ 1100 -3.865516928617661E-003 1.00000000E+000 /-DJK 2000 -4.600000000000003E-003 1.00000000E-037 /-DK 40100 -8.863999250870729E-005 1.00000000E+000 /d1 50000 -1.318840095053811E-005 1.00000000E+000 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.798862445623251E+005 1.00000000E+005 /E_5v9 10011 1.183382441542673E+004 1.00000000E+001 /A 20011 2.694433364456078E+003 1.00000000E+001 /B 30011 2.211862317339361E+003 1.00000000E+001 /C 211 -5.072143690592526E-004 1.00000000E+000 /-DJ 1111 -3.372490696219178E-003 1.00000000E+000 /-DJK 2011 -5.500000000000001E-003 1.00000000E-037 /-DK 40111 -9.251636999622537E-005 1.00000000E+000 /d1 50011 -1.477465440808268E-005 1.00000000E+000 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207645503284496E+004 1.00000000E+001 /A 20022 2.688959564693808E+003 1.00000000E+001 /B 30022 2.196517202273813E+003 1.00000000E+001 /C 222 -4.840159476528878E-004 1.00000000E+000 /-DJ 1122 -4.027335930996898E-003 1.00000000E+000 /-DJK 2022 -1.141000000000000E-002 1.00000000E-037 /-DK 40122 -8.940561321665717E-005 1.00000000E+000 /d1 50022 -1.770008133113108E-005 1.00000000E+000 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.489728370203804E+005 1.00000000E+005 /E_2v7v9 600001 9.582785728320405E+002 1.00000000E+002 /Gc 600101 -2.461846169284605E-003 1.00000000E+000 /GcJ 601001 -3.000000000000000E-002 1.00000000E-037 /GcK 600012 -7.884506440054073E+002 1.00000000E+002 /Gc 600112 -2.552928614163955E-004 1.00000000E+000 /GcJ 601012 -1.360000000000000E-002 1.00000000E-037 /GcK 1 4.625639269399353E+005 1.00000000E+004 /Fermi 101 -5.530000000000006E-001 1.00000000E-037 /FermiJ 1001 -1.875836260381361E+001 1.00000000E+001 /FermiK 12 -3.514026562138564E+005 1.00000000E+004 /Fermi 112 4.760000000000000E-001 1.00000000E-037 /FermiJ 1012 1.892556814602251E+001 1.00000000E+001 /FermiK ! !------------------------------------------------------------------------------- ! with reasoned assumptions concerning DK's and other minor constants ! ! RMS ERROR= 0.80576 0.80576 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Tue Sep 16 19:48:46 2008 60 1028 11 0 0.0000E+000 1.0000E+001 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162257611808139E+004 1.00000000E+001 /A 20000 2.701266431974198E+003 1.00000000E+001 /B 30000 2.228065208710473E+003 1.00000000E+001 /C 200 -5.185616023127050E-004 1.00000000E+000 /-DJ 1100 -3.865516928617661E-003 1.00000000E+000 /-DJK 2000 -4.600000000000003E-003 1.00000000E-037 /-DK 40100 -8.863999250870728E-005 1.00000000E+000 /d1 50000 -1.318840095053811E-005 1.00000000E+000 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.798862445623251E+005 1.00000000E+005 /E_5v9 10011 1.183382441542673E+004 1.00000000E+001 /A 20011 2.694433364456078E+003 1.00000000E+001 /B 30011 2.211862317339361E+003 1.00000000E+001 /C 211 -5.072143690592526E-004 1.00000000E+000 /-DJ 1111 -3.372490696219178E-003 1.00000000E+000 /-DJK 2011 -5.500000000000001E-003 1.00000000E-037 /-DK 40111 -9.251636999622537E-005 1.00000000E+000 /d1 50011 -1.477465440808268E-005 1.00000000E+000 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207645503284496E+004 1.00000000E+001 /A 20022 2.688959564693808E+003 1.00000000E+001 /B 30022 2.196517202273813E+003 1.00000000E+001 /C 222 -4.840159476528878E-004 1.00000000E+000 /-DJ 1122 -4.027335930996897E-003 1.00000000E+000 /-DJK 2022 -1.141000000000000E-002 1.00000000E-037 /-DK 40122 -8.940561321665717E-005 1.00000000E+000 /d1 50022 -1.770008133113108E-005 1.00000000E+000 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.489728370203804E+005 1.00000000E+005 /E_2v7v9 600001 9.582785728320405E+002 1.00000000E+002 /Gc 600101 -2.461846169284605E-003 1.00000000E+000 /GcJ 601001 -3.000000000000000E-002 1.00000000E-037 /GcK 600012 -7.884506440054073E+002 1.00000000E+002 /Gc 600112 -2.552928614163955E-004 1.00000000E+000 /GcJ 601012 -1.360000000000000E-002 1.00000000E-037 /GcK 1 4.625639269399353E+005 1.00000000E+004 /Fermi 101 -5.530000000000006E-001 1.00000000E-037 /FermiJ 1001 -1.875836260381361E+001 1.00000000E+001 /FermiK 12 -3.514026562138564E+005 1.00000000E+004 /Fermi 112 4.760000000000000E-001 1.00000000E-037 /FermiJ 1012 1.892556814602251E+001 1.00000000E+001 /FermiK ! !------------------------------------------------------------------------------- ! with d2's ! ! RMS ERROR= 0.81604 0.81604 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Thu Sep 11 15:20:22 2008 60 1028 11 0 0.0000E+000 5.0000E+001 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162208299417151E+004 1.00000000E+001 /A 20000 2.701264628850743E+003 1.00000000E+001 /B 30000 2.228083026767108E+003 1.00000000E+001 /C 200 -5.186701189787042E-004 1.00000000E+000 /-DJ 1100 -3.883518977477875E-003 1.00000000E+000 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.872747234673941E-005 1.00000000E+000 /d1 50000 -1.302471016597140E-005 1.00000000E+000 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.843619541901687E+005 1.00000000E+005 /E_5v9 10011 1.183422201836364E+004 1.00000000E+001 /A 20011 2.694420011418851E+003 1.00000000E+001 /B 30011 2.211837947396006E+003 1.00000000E+001 /C 211 -5.072732027244628E-004 1.00000000E+000 /-DJ 1111 -3.354587768761133E-003 1.00000000E+000 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.235081341045054E-005 1.00000000E+000 /d1 50011 -1.485980621633195E-005 1.00000000E+000 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207664335149288E+004 1.00000000E+001 /A 20022 2.688973929955938E+003 1.00000000E+001 /B 30022 2.196523260542820E+003 1.00000000E+001 /C 222 -4.836538255385661E-004 1.00000000E+000 /-DJ 1122 -4.021994134522183E-003 1.00000000E+000 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -8.939283039927232E-005 1.00000000E+000 /d1 50022 -1.778061463000449E-005 1.00000000E+000 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.466776531892985E+005 1.00000000E+005 /E_2v7v9 600001 9.784940733057865E+002 1.00000000E+002 /Gc 600101 -2.434777187583127E-003 1.00000000E+000 /GcJ 601001 -4.510000000000000E-002 1.00000000E-037 /GcK 600012 -7.872895278186028E+002 1.00000000E+002 /Gc 600112 -2.555900888606117E-004 1.00000000E+000 /GcJ 601012 -1.110000000000000E-002 1.00000000E-037 /GcK 1 4.611922247697840E+005 1.00000000E+004 /Fermi 101 -5.400000000000000E-001 1.00000000E-037 /FermiJ 1001 -1.982748999596430E+001 1.00000000E+001 /FermiK 12 -3.510704333692021E+005 1.00000000E+004 /Fermi 112 4.850000000000000E-001 1.00000000E-037 /FermiJ 1012 1.887693792651690E+001 1.00000000E+001 /FermiK ! !------------------------------------------------------------------------------- ! GJ's and FK's (but DK's blow up ! ! RMS ERROR= 0.81619 0.81619 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Thu Sep 11 14:48:50 2008 60 1028 11 0 0.0000E+000 5.0000E+001 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162221123699198E+004 1.00000000E+001 /A 20000 2.701270881545368E+003 1.00000000E+001 /B 30000 2.228086181221542E+003 1.00000000E+001 /C 200 -5.186125160307942E-004 1.00000000E+000 /-DJ 1100 -3.890015237540290E-003 1.00000000E+000 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.869759255245554E-005 1.00000000E+000 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.837713285786844E+005 1.00000000E+005 /E_5v9 10011 1.183400391102986E+004 1.00000000E+001 /A 20011 2.694408105826906E+003 1.00000000E+001 /B 30011 2.211839834421174E+003 1.00000000E+001 /C 211 -5.077419469420436E-004 1.00000000E+000 /-DJ 1111 -3.339816168338620E-003 1.00000000E+000 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.227903036281132E-005 1.00000000E+000 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207670582253260E+004 1.00000000E+001 /A 20022 2.688979797509478E+003 1.00000000E+001 /B 30022 2.196518304479295E+003 1.00000000E+001 /C 222 -4.831974421211212E-004 1.00000000E+000 /-DJ 1122 -4.037289587728114E-003 1.00000000E+000 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -8.952459305033233E-005 1.00000000E+000 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.470094665080485E+005 1.00000000E+005 /E_2v7v9 600001 9.769278197131513E+002 1.00000000E+002 /Gc 600101 -2.562738511258495E-003 1.00000000E+000 /GcJ 601001 -4.512566953466324E-002 1.00000000E-037 /GcK 600012 -7.893864650176836E+002 1.00000000E+002 /Gc 600112 -1.848227940787453E-004 1.00000000E+000 /GcJ 601012 -1.109830217314013E-002 1.00000000E-037 /GcK 1 4.613525184783284E+005 1.00000000E+004 /Fermi 101 -5.395338998744672E-001 1.00000000E-037 /FermiJ 1001 -1.965962683532987E+001 1.00000000E+001 /FermiK 12 -3.510888276962964E+005 1.00000000E+004 /Fermi 112 4.852992571697606E-001 1.00000000E-037 /FermiJ 1012 1.892070486660713E+001 1.00000000E+001 /FermiK ! !------------------------------------------------------------------------------- ! With G's also fitted ! ! RMS ERROR= 0.83975 0.83975 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Wed Aug 20 16:02:10 2008 66 1028 11 0 0.0000E+000 5.0000E+000 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162083396032433E+004 1.00000000E+001 /A 20000 2.701059164721592E+003 1.00000000E+001 /B 30000 2.227904352401451E+003 1.00000000E+001 /C 200 -5.203830409280816E-004 1.00000000E+000 /-DJ 1100 -3.729517554212835E-003 1.00000000E+000 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.959333986065104E-005 1.00000000E+000 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.824518266173094E+005 1.00000000E+005 /E_5v9 10011 1.183626991116662E+004 1.00000000E+001 /A 20011 2.694674064896001E+003 1.00000000E+001 /B 30011 2.212110859737166E+003 1.00000000E+001 /C 211 -5.057184298975407E-004 1.00000000E+000 /-DJ 1111 -3.661368879864464E-003 1.00000000E+000 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -8.959268300932072E-005 1.00000000E+000 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207580116781313E+004 1.00000000E+001 /A 20022 2.688923993816682E+003 1.00000000E+001 /B 30022 2.196429361800658E+003 1.00000000E+001 /C 222 -4.833744703604416E-004 1.00000000E+000 /-DJ 1122 -3.875597084751860E-003 1.00000000E+000 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.123644552214591E-005 1.00000000E+000 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.481557958105762E+005 1.00000000E+005 /E_2v7v9 600001 9.846214930669489E+002 1.00000000E+002 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.994744757809116E+002 1.00000000E+002 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.617057838754064E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.510315635117862E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! ! After another batch of EBJ lines+correcdtions, same constants as below ! ! RMS ERROR= 0.85527 0.85527 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Wed Aug 20 15:58:15 2008 66 1028 11 0 0.0000E+000 5.0000E+000 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162074406642308E+004 1.00000000E+001 /A 20000 2.701060035366948E+003 1.00000000E+001 /B 30000 2.227903761923137E+003 1.00000000E+001 /C 200 -5.204487506001443E-004 1.00000000E+000 /-DJ 1100 -3.709779140127508E-003 1.00000000E+000 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.963777517828359E-005 1.00000000E+000 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.817684184861998E+005 1.00000000E+005 /E_5v9 10011 1.183591956857705E+004 1.00000000E+001 /A 20011 2.694685447098700E+003 1.00000000E+001 /B 30011 2.212110895006105E+003 1.00000000E+001 /C 211 -5.054181403072076E-004 1.00000000E+000 /-DJ 1111 -3.736044370148129E-003 1.00000000E+000 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -8.938975370418491E-005 1.00000000E+000 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207622800162897E+004 1.00000000E+001 /A 20022 2.688912280945461E+003 1.00000000E+001 /B 30022 2.196429727884151E+003 1.00000000E+001 /C 222 -4.836010599506031E-004 1.00000000E+000 /-DJ 1122 -3.819885874442121E-003 1.00000000E+000 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.142754415397747E-005 1.00000000E+000 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.477038706756319E+005 1.00000000E+005 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.621627510819843E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.513260108829910E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! ABC two DE's and two F's, DJ DJK d1 fitted ! ! 8 lines rejected at 5 sigma ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Tue Aug 12 19:33:10 2008 66 880 11 0 0.0000E+000 5.0000E+000 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162068280229460E+004 1.00000000E+001 /A 20000 2.701062436031170E+003 1.00000000E+001 /B 30000 2.227906935658798E+003 1.00000000E+001 /C 200 -5.208724923504162E-004 1.00000000E+000 /-DJ 1100 -3.683584199550425E-003 1.00000000E+000 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.987600264118262E-005 1.00000000E+000 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.815513833218657E+005 1.00000000E+005 /E_5v9 10011 1.183598844566332E+004 1.00000000E+001 /A 20011 2.694680724789739E+003 1.00000000E+001 /B 30011 2.212109373038810E+003 1.00000000E+001 /C 211 -5.036909601820233E-004 1.00000000E+000 /-DJ 1111 -3.826768880882104E-003 1.00000000E+000 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -8.864140682495634E-005 1.00000000E+000 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207622302320929E+004 1.00000000E+001 /A 20022 2.688913447961787E+003 1.00000000E+001 /B 30022 2.196427948858855E+003 1.00000000E+001 /C 222 -4.846098270437736E-004 1.00000000E+000 /-DJ 1122 -3.764416045628511E-003 1.00000000E+000 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.179987140976261E-005 1.00000000E+000 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.477251305954335E+005 1.00000000E+005 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.622774657841825E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.514009644112603E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! As below but now both DJ and d1 fitted /two lines rejected at 10sigma/ ! ! RMS ERROR= 1.10414 1.10414 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Tue Aug 12 19:26:27 2008 66 880 11 0 0.0000E+000 1.0000E+001 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.161973048722186E+004 1.00000000E+000 /A 20000 2.701084760233927E+003 1.00000000E+000 /B 30000 2.227967738471121E+003 1.00000000E+000 /C 200 -5.194885033957084E-004 1.00000000E+000 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -9.006648898796110E-005 1.00000000E+000 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.775036436299798E+005 1.00000000E+004 /E_5v9 10011 1.183632554220366E+004 1.00000000E+000 /A 20011 2.694672906133590E+003 1.00000000E+000 /B 30011 2.212078699282867E+003 1.00000000E+000 /C 211 -5.055902694462668E-004 1.00000000E+000 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -8.925853064671490E-005 1.00000000E+000 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207682442586895E+004 1.00000000E+000 /A 20022 2.688899638889681E+003 1.00000000E+000 /B 30022 2.196397691389173E+003 1.00000000E+000 /C 222 -4.841808638569970E-004 1.00000000E+000 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.106039830677615E-005 1.00000000E+000 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.480255500079082E+005 1.00000000E+004 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.641032924147000E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.521930497987202E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! As below but now DJ fitted and two lines rejected at 10sigma ! ! RMS ERROR= 1.13548 1.13548 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Tue Aug 12 19:23:53 2008 66 880 11 0 0.0000E+000 1.0000E+001 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.161995030919474E+004 1.00000000E+000 /A 20000 2.701069660349343E+003 1.00000000E+000 /B 30000 2.227948562562738E+003 1.00000000E+000 /C 200 -5.188989192315785E-004 1.00000000E+000 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.908400000000003E-005 1.00000000E-037 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.789380367735751E+005 1.00000000E+004 /E_5v9 10011 1.183661788593267E+004 1.00000000E+000 /A 20011 2.694694674078560E+003 1.00000000E+000 /B 30011 2.212084408681645E+003 1.00000000E+000 /C 211 -5.074088131526129E-004 1.00000000E+000 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.127900000000001E-005 1.00000000E-037 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207646153635757E+004 1.00000000E+000 /A 20022 2.688896532163011E+003 1.00000000E+000 /B 30022 2.196409857357582E+003 1.00000000E+000 /C 222 -4.834610485207135E-004 1.00000000E+000 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.039800000000001E-005 1.00000000E-037 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.478961123308748E+005 1.00000000E+004 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.634673267786286E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.519134305307023E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! ABC two deltaEs and two Fs in fit ! ! RMS ERROR= 1.58204 1.58204 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Tue Aug 12 19:21:05 2008 66 880 11 0 0.0000E+000 2.5000E+005 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.161957358491607E+004 1.00000000E+000 /A 20000 2.701076201373821E+003 1.00000000E+000 /B 30000 2.227978656614637E+003 1.00000000E+000 /C 200 -5.196500000000004E-004 1.00000000E-037 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.908400000000003E-005 1.00000000E-037 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.772011798028961E+005 1.00000000E+004 /E_5v9 10011 1.183629866663237E+004 1.00000000E+000 /A 20011 2.694689385270784E+003 1.00000000E+000 /B 30011 2.212059609912368E+003 1.00000000E+000 /C 211 -5.034650000000000E-004 1.00000000E-037 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.127900000000001E-005 1.00000000E-037 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207700571378001E+004 1.00000000E+000 /A 20022 2.688895456870702E+003 1.00000000E+000 /B 30022 2.196401349118629E+003 1.00000000E+000 /C 222 -4.860940000000002E-004 1.00000000E-037 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.039800000000001E-005 1.00000000E-037 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.479261141526169E+005 1.00000000E+004 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.642411901947494E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.522166151833012E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! As below, after more EBJ lines ! ! RMS ERROR= 2.46550 2.46550 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Tue Aug 12 19:19:21 2008 66 880 11 0 0.0000E+000 2.5000E+005 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162048000000000E+004 1.00000000E-037 /A 20000 2.701084948208761E+003 1.00000000E+000 /B 30000 2.227965301508227E+003 1.00000000E+000 /C 200 -5.196500000000004E-004 1.00000000E-037 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.908400000000003E-005 1.00000000E-037 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.774576863354653E+005 1.00000000E+004 /E_5v9 10011 1.183328000000000E+004 1.00000000E-037 /A 20011 2.694660072110787E+003 1.00000000E+000 /B 30011 2.212084774049360E+003 1.00000000E+000 /C 211 -5.034650000000000E-004 1.00000000E-037 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.127900000000001E-005 1.00000000E-037 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207769500000000E+004 1.00000000E-037 /A 20022 2.688910506680914E+003 1.00000000E+000 /B 30022 2.196398390272844E+003 1.00000000E+000 /C 222 -4.860940000000002E-004 1.00000000E-037 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.039800000000001E-005 1.00000000E-037 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.478614296300774E+005 1.00000000E+004 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.640107716471479E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.519249076600515E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! B,C of each state, two DE's and two F's fitted ! ! RMS ERROR= 1.54332 1.54332 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Mon Aug 04 20:35:38 2008 66 443 11 0 0.0000E+000 2.5000E+005 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162048000000000E+004 1.00000000E-037 /A 20000 2.700993399628877E+003 1.00000000E+000 /B 30000 2.227974328608904E+003 1.00000000E+000 /C 200 -5.196500000000004E-004 1.00000000E-037 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.908400000000003E-005 1.00000000E-037 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.778985572047910E+005 1.00000000E+004 /E_5v9 10011 1.183328000000000E+004 1.00000000E-037 /A 20011 2.694965033240636E+003 1.00000000E+000 /B 30011 2.212049202233145E+003 1.00000000E+000 /C 211 -5.034650000000000E-004 1.00000000E-037 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.127900000000001E-005 1.00000000E-037 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207769500000000E+004 1.00000000E-037 /A 20022 2.688771804737483E+003 1.00000000E+000 /B 30022 2.196418163822826E+003 1.00000000E+000 /C 222 -4.860940000000002E-004 1.00000000E-037 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.039800000000001E-005 1.00000000E-037 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.480858605231766E+005 1.00000000E+004 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000010E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.640119265598925E+005 1.00000000E+004 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.523534636174633E+005 1.00000000E+004 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! with forgotten sextics added - no appreciable effect on the RMS ! - but without sextics the fit does not converge to the RMS above ! ! RMS ERROR= 54.92417 54.92417 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Sun Aug 03 23:05:13 2008 66 443 1 0 0.0000E+000 2.5000E+005 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162048000000000E+004 1.00000000E-037 /A 20000 2.701191200000000E+003 1.00000000E-037 /B 30000 2.227908900000000E+003 1.00000000E-037 /C 200 -5.196500000000004E-004 1.00000000E-037 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.908400000000003E-005 1.00000000E-037 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 -1.248295422822922E-010 1.00000000E-037 /HJ 1200 -5.504283605932723E-009 1.00000000E-037 /HJK 2100 -1.488860474731619E-008 1.00000000E-037 /HKJ 3000 3.667038865642880E-008 1.00000000E-037 /HK 40200 -2.141661252459279E-011 1.00000000E-037 /h1 50100 -2.968936840723660E-012 1.00000000E-037 /h2 60000 4.567905314879395E-012 1.00000000E-037 /h3 0 -6.818671200000000E+005 1.00000000E-037 /E_5v9 10011 1.183328000000000E+004 1.00000000E-037 /A 20011 2.694559900000000E+003 1.00000000E-037 /B 30011 2.211917500000000E+003 1.00000000E-037 /C 211 -5.034650000000000E-004 1.00000000E-037 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.127900000000001E-005 1.00000000E-037 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 -1.248295422822922E-010 1.00000000E-037 /HJ 1211 -5.504283605932723E-009 1.00000000E-037 /HJK 2111 -1.488860474731619E-008 1.00000000E-037 /HKJ 3011 3.667038865642880E-008 1.00000000E-037 /HK 40211 -2.141661252459279E-011 1.00000000E-037 /h1 50111 -2.968936840723660E-012 1.00000000E-037 /h2 60011 4.567905314879395E-012 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207769500000000E+004 1.00000000E-037 /A 20022 2.688848800000000E+003 1.00000000E-037 /B 30022 2.196381350000000E+003 1.00000000E-037 /C 222 -4.860940000000002E-004 1.00000000E-037 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.039800000000001E-005 1.00000000E-037 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 -1.248295422822922E-010 1.00000000E-037 /HJ 1222 -5.504283605932723E-009 1.00000000E-037 /HJK 2122 -1.488860474731619E-008 1.00000000E-037 /HKJ 3022 3.667038865642880E-008 1.00000000E-037 /HK 40222 -2.141661252459279E-011 1.00000000E-037 /h1 50122 -2.968936840723660E-012 1.00000000E-037 /h2 60022 4.567905314879395E-012 1.00000000E-037 /h3 22 4.354180000000000E+005 1.00000000E-037 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000006E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.524998600000000E+005 1.00000000E-037 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.495300000000000E+005 1.00000000E-037 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! EBJ zeroth order: !------------------------------------------------------------------------------- ! stale odgadniete na podstawie sekwencji diada 2nu9, diada 3nu9, triada 4nu9 ! + poprawka z 35Cl ! ! RMS ERROR= 53.93392 53.93392 ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Sun Aug 03 23:05:13 2008 66 443 1 0 0.0000E+000 2.5000E+005 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162048000000000E+004 1.00000000E-037 /A 20000 2.701191200000000E+003 1.00000000E-037 /B 30000 2.227908900000000E+003 1.00000000E-037 /C 200 -5.196500000000004E-004 1.00000000E-037 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.908400000000003E-005 1.00000000E-037 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 1.000000000000000E-025 1.00000000E-037 /HJ 1200 1.000000000000000E-025 1.00000000E-037 /HJK 2100 1.000000000000000E-025 1.00000000E-037 /HKJ 3000 1.000000000000000E-025 1.00000000E-037 /HK 40200 1.000000000000000E-025 1.00000000E-037 /h1 50100 1.000000000000000E-025 1.00000000E-037 /h2 60000 1.000000000000000E-025 1.00000000E-037 /h3 0 -6.818671200000000E+005 1.00000000E-037 /E_5v9 10011 1.183328000000000E+004 1.00000000E-037 /A 20011 2.694559900000000E+003 1.00000000E-037 /B 30011 2.211917500000000E+003 1.00000000E-037 /C 211 -5.034650000000000E-004 1.00000000E-037 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.127900000000001E-005 1.00000000E-037 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 1.000000000000000E-025 1.00000000E-037 /HJ 1211 1.000000000000000E-025 1.00000000E-037 /HJK 2111 1.000000000000000E-025 1.00000000E-037 /HKJ 3011 1.000000000000000E-025 1.00000000E-037 /HK 40211 1.000000000000000E-025 1.00000000E-037 /h1 50111 1.000000000000000E-025 1.00000000E-037 /h2 60011 1.000000000000000E-025 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207769500000000E+004 1.00000000E-037 /A 20022 2.688848800000000E+003 1.00000000E-037 /B 30022 2.196381350000000E+003 1.00000000E-037 /C 222 -4.860940000000002E-004 1.00000000E-037 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.039800000000001E-005 1.00000000E-037 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 1.000000000000000E-025 1.00000000E-037 /HJ 1222 1.000000000000000E-025 1.00000000E-037 /HJK 2122 1.000000000000000E-025 1.00000000E-037 /HKJ 3022 1.000000000000000E-025 1.00000000E-037 /HK 40222 1.000000000000000E-025 1.00000000E-037 /h1 50122 1.000000000000000E-025 1.00000000E-037 /h2 60022 1.000000000000000E-025 1.00000000E-037 /h3 22 4.354180000000000E+005 1.00000000E-037 /E_2v7v9 600001 9.804033000000001E+002 1.00000000E-037 /Gc 600101 -8.580000000000006E-004 1.00000000E-037 /GcJ 601001 -3.815000000000000E-002 1.00000000E-037 /GcK 600012 -7.938300000000002E+002 1.00000000E-037 /Gc 600112 1.599000000000005E-003 1.00000000E-037 /GcJ 601012 -8.300000000000000E-003 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.524998600000000E+005 1.00000000E-037 /Fermi 101 -6.635000000000004E-001 1.00000000E-037 /FermiJ 1001 -2.001020000000000E+001 1.00000000E-037 /FermiK 12 -3.495300000000000E+005 1.00000000E-037 /Fermi 112 4.940000000000003E-001 1.00000000E-037 /FermiJ 1012 1.891500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK ! !------------------------------------------------------------------------------- ! stale odgadniete na podstawie sekwencji diada 2nu9, diada 3nu9, triada 4nu9 ! ! 37ClONO2: 0-5v9, 1-v73v9, 2-2v7v9 Wed Jul 23 13:01:57 2008 66 73 1 0 0.0000E+000 2.5000E+005 1.0000E+000 1.0000000000 's' 1 3 , , , , 1 , 4 , 4 , , , 3 10000 1.162048000000000E+004 1.00000000E-037 /A 20000 2.701191200000000E+003 1.00000000E-037 /B 30000 2.227908900000000E+003 1.00000000E-037 /C 200 -5.196500000000004E-004 1.00000000E-037 /-DJ 1100 -3.762400000000001E-003 1.00000000E-037 /-DJK 2000 -4.425000000000005E-003 1.00000000E-037 /-DK 40100 -8.908400000000003E-005 1.00000000E-037 /d1 50000 -1.316100000000000E-005 1.00000000E-037 /d2 300 1.000000000000000E-025 1.00000000E-037 /HJ 1200 1.000000000000000E-025 1.00000000E-037 /HJK 2100 1.000000000000000E-025 1.00000000E-037 /HKJ 3000 1.000000000000000E-025 1.00000000E-037 /HK 40200 1.000000000000000E-025 1.00000000E-037 /h1 50100 1.000000000000000E-025 1.00000000E-037 /h2 60000 1.000000000000000E-025 1.00000000E-037 /h3 0 -6.877501200000000E+005 1.00000000E-037 /E_5v9 10011 1.183328000000000E+004 1.00000000E-037 /A 20011 2.694559900000000E+003 1.00000000E-037 /B 30011 2.211917500000000E+003 1.00000000E-037 /C 211 -5.034650000000000E-004 1.00000000E-037 /-DJ 1111 -3.715700000000000E-003 1.00000000E-037 /-DJK 2011 -6.266000000000003E-003 1.00000000E-037 /-DK 40111 -9.127900000000001E-005 1.00000000E-037 /d1 50011 -1.455500000000000E-005 1.00000000E-037 /d2 311 1.000000000000000E-025 1.00000000E-037 /HJ 1211 1.000000000000000E-025 1.00000000E-037 /HJK 2111 1.000000000000000E-025 1.00000000E-037 /HKJ 3011 1.000000000000000E-025 1.00000000E-037 /HK 40211 1.000000000000000E-025 1.00000000E-037 /h1 50111 1.000000000000000E-025 1.00000000E-037 /h2 60011 1.000000000000000E-025 1.00000000E-037 /h3 11 1.000000000000000E-025 1.00000000E-037 /E_v73v9 10022 1.207769500000000E+004 1.00000000E-037 /A 20022 2.688848800000000E+003 1.00000000E-037 /B 30022 2.196381350000000E+003 1.00000000E-037 /C 222 -4.860940000000002E-004 1.00000000E-037 /-DJ 1122 -3.789500000000003E-003 1.00000000E-037 /-DJK 2022 -1.195300000000000E-002 1.00000000E-037 /-DK 40122 -9.039800000000001E-005 1.00000000E-037 /d1 50022 -1.803200000000000E-005 1.00000000E-037 /d2 322 1.000000000000000E-025 1.00000000E-037 /HJ 1222 1.000000000000000E-025 1.00000000E-037 /HJK 2122 1.000000000000000E-025 1.00000000E-037 /HKJ 3022 1.000000000000000E-025 1.00000000E-037 /HK 40222 1.000000000000000E-025 1.00000000E-037 /h1 50122 1.000000000000000E-025 1.00000000E-037 /h2 60022 1.000000000000000E-025 1.00000000E-037 /h3 22 4.386720000000000E+005 1.00000000E-037 /E_2v7v9 600001 9.803200000000001E+002 1.00000000E-037 /Gc 600101 -2.338000000000002E-003 1.00000000E-037 /GcJ 601001 -2.370000000000000E-002 1.00000000E-037 /GcK 600012 -7.069300000000002E+002 1.00000000E-037 /Gc 600112 1.103000000000005E-003 1.00000000E-037 /GcJ 601012 2.479000000000000E-002 1.00000000E-037 /GcK 600002 1.000000000000000E-025 1.00000000E-037 /Gc 600102 1.000000000000000E-025 1.00000000E-037 /GcJ 601002 1.000000000000000E-025 1.00000000E-037 /GcK 1 4.499640000000000E+005 1.00000000E-037 /Fermi 101 -4.552000000000003E-001 1.00000000E-037 /FermiJ 1001 -2.111900000000000E+001 1.00000000E-037 /FermiK 12 -3.067440000000000E+005 1.00000000E-037 /Fermi 112 3.771000000000002E-001 1.00000000E-037 /FermiJ 1012 1.742500000000000E+001 1.00000000E-037 /FermiK 2 1.000000000000000E-025 1.00000000E-037 /Fermi 102 1.000000000000000E-025 1.00000000E-037 /FermiJ 1002 1.000000000000000E-025 1.00000000E-037 /FermiK !