2,2-dichloropropane Thu May 26 08:22:36 2011 25 149 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 , 1.0, 1.0, , , 3 , , 10000 3.660688796389822E+003 1.00000000E-037 /A 20000 2.457869172701322E+003 1.00000000E-037 /B 30000 2.158297641735694E+003 1.00000000E-037 /C 200 -4.144766792432402E-004 1.00000000E-037 /-DJ 1100 1.883981258269788E-004 1.00000000E-037 /-DJK 2000 -8.259883542174954E-004 1.00000000E-037 /-DK 40100 -8.241482791209484E-005 1.00000000E-037 /-dJ 41000 -1.532892382861256E-004 1.00000000E-037 /-dK 300 8.239445076205646E-011 1.00000000E-037 /HJ 1200 2.199319601624294E-010 1.00000000E-037 /HJK 2100 -1.375957327356260E-009 1.00000000E-037 /HKJ 3000 1.878188479378614E-009 1.00000000E-037 /HK 40200 2.603175848804472E-011 1.00000000E-037 /hJ 110010000 -5.582141304175975E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582141304175975E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415627152514546E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.415627152514546E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.107232085448579E+001 5.00000000E+005 /chi.ab -220610000 5.107232085448579E+001 1.00000000E-037 /chi.ab 10010000 8.351151935747681E-004 9.99999970E+000 /M.aa {+IMJ -20010000 8.351151935747681E-004 1.00000000E-037 /M.aa {+IMJ 10020000 8.303081684968925E-004 9.99999970E+000 /M.bb {+IMJ -20020000 8.303081684968925E-004 1.00000000E-037 /M.bb {+IMJ 10030000 1.049536452534735E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.049536452534735E-003 1.00000000E-037 /M.cc {+IMJ ! ! !------------------------------------------------------------------------------- ! Final ABC and centrifugals transfered back from the MMW fit where ! the ten hyperfine-free frequencies were used with 0.001 errors ! ! MICROWAVE RMS = 0.001129 MHz ! RMS ERROR= 0.56440 0.56440 ! 2,2-dichloropropane Thu May 26 08:22:36 2011 25 149 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 , 1.0, 1.0, , , 3 , , 10000 3.660688796389822E+003 1.00000000E-037 /A 20000 2.457869172701322E+003 1.00000000E-037 /B 30000 2.158297641735694E+003 1.00000000E-037 /C 200 -4.144766792432402E-004 1.00000000E-037 /-DJ 1100 1.883981258269788E-004 1.00000000E-037 /-DJK 2000 -8.259883542174954E-004 1.00000000E-037 /-DK 40100 -8.241482791209484E-005 1.00000000E-037 /-dJ 41000 -1.532892382861256E-004 1.00000000E-037 /-dK 300 8.239445076205646E-011 1.00000000E-037 /HJ 1200 2.199319601624294E-010 1.00000000E-037 /HJK 2100 -1.375957327356260E-009 1.00000000E-037 /HKJ 3000 1.878188479378614E-009 1.00000000E-037 /HK 40200 2.603175848804472E-011 1.00000000E-037 /hJ 110010000 -5.582141304175975E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582141304175975E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415627152514546E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.415627152514546E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.107232085448579E+001 5.00000000E+005 /chi.ab -220610000 5.107232085448579E+001 1.00000000E-037 /chi.ab 10010000 8.351151935747681E-004 9.99999970E+000 /M.aa {+IMJ -20010000 8.351151935747681E-004 1.00000000E-037 /M.aa {+IMJ 10020000 8.303081684968925E-004 9.99999970E+000 /M.bb {+IMJ -20020000 8.303081684968925E-004 1.00000000E-037 /M.bb {+IMJ 10030000 1.049536452534735E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.049536452534735E-003 1.00000000E-037 /M.cc {+IMJ ! !------------------------------------------------------------------------------- ! without the suspicious 10662.5820 line ! ! MICROWAVE RMS = 0.001256 MHz ! RMS ERROR= 0.62791 0.62791 ! 2,2-dichloropropane Wed May 25 23:21:49 2011 25 149 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 ,21.0,15.0, , , 3 , , 10000 3.660688923980184E+003 1.00000000E-037 /A 20000 2.457869197688002E+003 1.00000000E-037 /B 30000 2.158297634980281E+003 1.00000000E-037 /C 200 -4.144772311913944E-004 1.00000000E-037 /-DJ 1100 1.883759246168257E-004 1.00000000E-037 /-DJK 2000 -8.260164919207832E-004 1.00000000E-037 /-DK 40100 -8.241665748319024E-005 1.00000000E-037 /-dJ 41000 -1.532971290510225E-004 1.00000000E-037 /-dK 300 8.234583561777150E-011 1.00000000E-037 /HJ 1200 2.212181757740463E-010 1.00000000E-037 /HJK 2100 -1.374389020738197E-009 1.00000000E-037 /HKJ 3000 1.880712768604318E-009 1.00000000E-037 /HK 40200 2.616821026925591E-011 1.00000000E-037 /hJ 110010000 -5.582127492512213E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582127492512213E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415633976625331E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.415633976625331E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.106892795542608E+001 5.00000000E+005 /chi.ab -220610000 5.106892795542608E+001 1.00000000E-037 /chi.ab 10010000 9.118245479686154E-004 9.99999970E+000 /M.aa {+IMJ -20010000 9.118245479686154E-004 1.00000000E-037 /M.aa {+IMJ 10020000 8.756239941521115E-004 9.99999970E+000 /M.bb {+IMJ -20020000 8.756239941521115E-004 1.00000000E-037 /M.bb {+IMJ 10030000 1.035573278351098E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.035573278351098E-003 1.00000000E-037 /M.cc {+IMJ ! !------------------------------------------------------------------------------- ! fitting all M's and A,B,C fixed at MMW values ! kHz deviation worsened by two error=0.01 lines ! ! MICROWAVE RMS = 0.001556 MHz ! RMS ERROR= 0.62485 0.62485 ! 2,2-dichloropropane Wed May 25 23:13:36 2011 25 150 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 ,21.0,15.0, , , 3 , , 10000 3.660688923980184E+003 1.00000000E-037 /A 20000 2.457869197688002E+003 1.00000000E-037 /B 30000 2.158297634980281E+003 1.00000000E-037 /C 200 -4.144772311913944E-004 1.00000000E-037 /-DJ 1100 1.883759246168257E-004 1.00000000E-037 /-DJK 2000 -8.260164919207832E-004 1.00000000E-037 /-DK 40100 -8.241665748319024E-005 1.00000000E-037 /-dJ 41000 -1.532971290510225E-004 1.00000000E-037 /-dK 300 8.234583561777150E-011 1.00000000E-037 /HJ 1200 2.212181757740463E-010 1.00000000E-037 /HJK 2100 -1.374389020738197E-009 1.00000000E-037 /HKJ 3000 1.880712768604318E-009 1.00000000E-037 /HK 40200 2.616821026925591E-011 1.00000000E-037 /hJ 110010000 -5.582131314557159E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582131314557159E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415627594510616E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.415627594510616E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.106863829880705E+001 5.00000000E+005 /chi.ab -220610000 5.106863829880705E+001 1.00000000E-037 /chi.ab 10010000 9.098448136736157E-004 9.99999970E+000 /M.aa {+IMJ -20010000 9.098448136736157E-004 1.00000000E-037 /M.aa {+IMJ 10020000 8.799266653788137E-004 9.99999970E+000 /M.bb {+IMJ -20020000 8.799266653788137E-004 1.00000000E-037 /M.bb {+IMJ 10030000 1.035719316840713E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.035719316840713E-003 1.00000000E-037 /M.cc {+IMJ ! !------------------------------------------------------------------------------- ! fitting all M's ! ! MICROWAVE RMS = 0.001404 MHz ! RMS ERROR= 0.49686 0.49686 ! 2,2-dichloropropane Wed May 25 18:52:18 2011 25 150 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 ,21.0,15.0, , , 0 , , 10000 3.660688528882711E+003 1.00000000E+000 /A 20000 2.457869099533240E+003 1.00000000E+000 /B 30000 2.158297678135885E+003 1.00000000E+000 /C 200 -4.144772311913944E-004 1.00000000E-037 /-DJ 1100 1.883759246168257E-004 1.00000000E-037 /-DJK 2000 -8.260164919207829E-004 1.00000000E-037 /-DK 40100 -8.241665748319024E-005 1.00000000E-037 /-dJ 41000 -1.532971290510225E-004 1.00000000E-037 /-dK 300 8.234583561777150E-011 1.00000000E-037 /HJ 1200 2.212181757740463E-010 1.00000000E-037 /HJK 2100 -1.374389020738197E-009 1.00000000E-037 /HKJ 3000 1.880712768604318E-009 1.00000000E-037 /HK 40200 2.616821026925591E-011 1.00000000E-037 /hJ 110010000 -5.582172836467549E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582172836467549E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415626613977457E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.415626613977457E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.107224533634577E+001 5.00000000E+005 /chi.ab -220610000 5.107224533634577E+001 1.00000000E-037 /chi.ab 10010000 6.584684371669116E-004 9.99999970E+000 /M.aa {+IMJ -20010000 6.584684371669116E-004 1.00000000E-037 /M.aa {+IMJ 10020000 7.358519415564293E-004 9.99999970E+000 /M.bb {+IMJ -20020000 7.358519415564293E-004 1.00000000E-037 /M.bb {+IMJ 10030000 1.104430772536710E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.104430772536710E-003 1.00000000E-037 /M.cc {+IMJ ! !------------------------------------------------------------------------------- ! with latest quartics and sextics ! ! RMS ERROR= 0.75234 0.75234 ! 2,2-dichloropropane Wed May 25 16:36:12 2011 25 150 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 ,21.0,15.0, , , 0 , , 10000 3.660688324640457E+003 1.00000000E+000 /A 20000 2.457868994200374E+003 1.00000000E+000 /B 30000 2.158297697088539E+003 1.00000000E+000 /C 200 -4.144772311913944E-004 1.00000000E-037 /-DJ 1100 1.883759246168257E-004 1.00000000E-037 /-DJK 2000 -8.260164919207825E-004 1.00000000E-037 /-DK 40100 -8.241665748319024E-005 1.00000000E-037 /-dJ 41000 -1.532971290510225E-004 1.00000000E-037 /-dK 300 8.234583561777150E-011 1.00000000E-037 /HJ 1200 2.212181757740463E-010 1.00000000E-037 /HJK 2100 -1.374389020738197E-009 1.00000000E-037 /HKJ 3000 1.880712768604318E-009 1.00000000E-037 /HK 40200 2.616821026925591E-011 1.00000000E-037 /hJ 110010000 -5.582154786307990E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582154786307990E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.416220281864522E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.416220281864522E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.108606280307625E+001 5.00000000E+005 /chi.ab -220610000 5.108606280307625E+001 1.00000000E-037 /chi.ab 10010000 1.000000000000000E-025 9.99999970E-037 /M.aa {+IMJ -20010000 1.000000000000000E-025 1.00000000E-037 /M.aa {+IMJ 10020000 1.000000000000000E-025 9.99999970E-037 /M.bb {+IMJ -20020000 1.000000000000000E-025 1.00000000E-037 /M.bb {+IMJ 10030000 1.233832777600631E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.233832777600631E-003 1.00000000E-037 /M.cc {+IMJ ! !------------------------------------------------------------------------------- ! old zk + d-ki z sub mm ! rms= 1.16 2,2-dichloropropane Mon Apr 23 21:36:11 2007 16 45 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 ,21.0,15.0,,,,,,,,,,,,, 10000 3.660688709662220E+003 1.00000000E+001 /A 20000 2.457868901727672E+003 1.00000000E+001 /B 30000 2.158297759193531E+003 1.00000000E+001 /C 200 -4.144840000000001E-004 1.00000000E-035 /-DJ 1100 1.883770000000000E-004 1.00000000E-035 /-DJK 2000 -8.260228600000007E-004 1.00000000E-035 /-DK 40100 -8.240987900000003E-005 1.00000000E-035 /-delJ 41000 -1.532778900000000E-004 1.00000000E-035 /-delK 110010000 -5.581997041135764E+001 1.00000000E+001 /chi.aa*3/2 -220010000 -5.581997041135764E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415682593340378E+000 1.00000000E+001 /chi(b-c)/4 -220040000 -9.415682593340378E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.091114665939986E+001 5.00000000E+001 /chi.ab -220610000 5.091114665939986E+001 1.00000000E-037 /chi.ab 10030000 1.000000000000000E-016 9.99999970E-020 /M.cc {+IMJ -20030000 1.000000000000000E-016 1.00000000E-037 /M.cc {+IMJ ! ! pomiary zk + Mc ! rms= 0.63 2,2-dichloropropane Wed Apr 25 19:41:24 2007 20 45 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 ,21.0,15.0, , , 0 , , 10000 3.660688642435766E+003 1.00000000E+000 /A 20000 2.457869098330684E+003 1.00000000E+000 /B 30000 2.158297657134286E+003 1.00000000E+000 /C 200 -4.144840000000001E-004 1.00000000E-025 /-DJ 1100 1.883770000000000E-004 1.00000000E-025 /-DJK 2000 -8.260228600000007E-004 1.00000000E-025 /-DK 40100 -8.240987900000003E-005 1.00000000E-025 /-delJ 41000 -1.532778900000000E-004 1.00000000E-025 /-delK 110010000 -5.582260527285585E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582260527285585E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415548091398776E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.415548091398776E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.109993925914595E+001 5.00000000E+005 /chi.ab -220610000 5.109993925914595E+001 1.00000000E-037 /chi.ab 10010000 1.000000000000000E-025 9.99999970E-037 /M.aa {+IMJ -20010000 1.000000000000000E-025 1.00000000E-037 /M.aa {+IMJ 10020000 1.000000000000000E-025 9.99999970E-037 /M.bb {+IMJ -20020000 1.000000000000000E-025 1.00000000E-037 /M.bb {+IMJ 10030000 1.372461220153180E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.372461220153180E-003 1.00000000E-037 /M.cc {+IMJ ! ! ! ! rms= 0.639 ! 2,2-dichloropropane Tue May 22 00:22:42 2007 20 112 3 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 ,21.0,15.0, , , 0 , , 10000 3.660688434184528E+003 1.00000000E+000 /A 20000 2.457869071903052E+003 1.00000000E+000 /B 30000 2.158297710115245E+003 1.00000000E+000 /C 200 -4.144840000000001E-004 1.00000000E-025 /-DJ 1100 1.883770000000000E-004 1.00000000E-025 /-DJK 2000 -8.260228600000007E-004 1.00000000E-025 /-DK 40100 -8.240987900000003E-005 1.00000000E-025 /-delJ 41000 -1.532778900000000E-004 1.00000000E-025 /-delK 110010000 -5.582155298817981E+001 1.00000000E+005 /chi.aa*3/2 -220010000 -5.582155298817981E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.415896246709339E+000 1.00000000E+005 /chi(b-c)/4 -220040000 -9.415896246709339E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.110143729840718E+001 5.00000000E+005 /chi.ab -220610000 5.110143729840718E+001 1.00000000E-037 /chi.ab 10010000 1.000000000000000E-025 9.99999970E-037 /M.aa {+IMJ -20010000 1.000000000000000E-025 1.00000000E-037 /M.aa {+IMJ 10020000 1.000000000000000E-025 9.99999970E-037 /M.bb {+IMJ -20020000 1.000000000000000E-025 1.00000000E-037 /M.bb {+IMJ 10030000 1.384636671391807E-003 9.99999970E+000 /M.cc {+IMJ -20030000 1.384636671391807E-003 1.00000000E-037 /M.cc {+IMJ !------------------------------------------------------------------------------ ! Final to MMW+qudrupole free FTMW ! ! (up to Ka=51) ! RMS ERROR= 0.74771 0.74771 ! 2,2 Dichloropropane Thu May 26 00:06:41 2011 13 1322 5 0 0.0000E+000 3.0000E+001 1.0000E+000 1.0000000000 s 1 2 0, , , , , , , ,,,,, 10000 3.660688796389822E+003 1.00000000E+020 /A 20000 2.457869172701322E+003 1.00000000E+020 /B 30000 2.158297641735694E+003 1.00000000E+020 /C 200 -4.144766792432402E-004 1.00000000E+020 /-DJ 1100 1.883981258269788E-004 1.00000000E+020 /-DJK 2000 -8.259883542174954E-004 1.00000000E+020 /-DK 40100 -8.241482791209484E-005 1.00000000E+020 /-dJ 41000 -1.532892382861256E-004 1.00000000E+020 /-dK 300 8.239445076205643E-011 1.00000000E+020 /HJ 1200 2.199319601624294E-010 1.00000000E+020 /HJK 2100 -1.375957327356260E-009 1.00000000E+020 /HKJ 3000 1.878188479378614E-009 1.00000000E+020 /HK 40200 2.603175848804472E-011 1.00000000E+020 /hJ ! !------------------------------------------------------------------------------