H3O+ 17:41Tue Jan 05 10:58:13 2010 114 1114 100 0 0.0000E+000 1.0000E+001 1.0000E+000 1.0000000000 g -1 -14 0 99 0 6 0 4 -1 2 0 10 g -1 -0 0 99 0 6 4 0 -1 2 g -1 -2 0 99 0 6 4 0 -1 2 g -1 -4 0 99 0 6 4 0 -1 2 g -1 -6 0 99 0 6 4 0 -1 102 g -1 -7 0 99 0 6 4 0 -1 202 g -1 -8 0 99 0 6 0 4 -1 102 g -1 -9 0 99 0 6 0 4 -1 202 g -1 -10 0 99 0 6 4 0 -1 102 g -1 -11 0 99 0 6 4 0 -1 202 g -1 -12 0 99 0 6 0 4 -1 102 g -1 -13 0 99 0 6 0 4 -0 202 9999 -5.217233884139100E+005 1.00000000E-037 /E 0 1.659350475306767E+006 1.00000000E+037 /E 202 2.861219842243194E+007 1.00000000E+037 /E 303 1.742324222756686E+007 1.00000000E+037 /E 404 1.046628172864035E+008 1.00000000E+037 /E 505 1.032785740008734E+008 1.00000000E+037 /E 606 1.071701795916225E+008 1.00000000E+037 /E 808 1.060083782296212E+008 1.00000000E+037 /E 1010 5.078345179108390E+007 1.00000000E+037 /E 1212 4.874753157394937E+007 1.00000000E+037 /E 10000 3.314117657836994E+005 1.00000000E+037 /B 10101 3.374002028177249E+005 1.00000000E+037 /B 10202 3.207020720591266E+005 1.00000000E+037 /B 10303 3.352599896328557E+005 1.00000000E+037 /B 10404 3.270738943063957E+005 1.00000000E+037 /B 10505 3.322409228263003E+005 1.00000000E+037 /B 10606 3.260461137954430E+005 1.00000000E+037 /B 10808 3.305224083852401E+005 1.00000000E+037 /B 11010 3.402061153794280E+005 1.00000000E+037 /B 11212 3.472715660730552E+005 1.00000000E+037 /B 100000 -1.445749960340220E+005 1.00000000E+037 /C-B 100101 -1.530325171023576E+005 1.00000000E+037 /C-B 100202 -1.324433805973651E+005 1.00000000E+037 /C-B 100303 -1.521700185114485E+005 1.00000000E+037 /C-B 100404 -1.422260092715510E+005 1.00000000E+037 /C-B 100505 -1.493261986436646E+005 1.00000000E+037 /C-B 100606 -1.400390782318110E+005 1.00000000E+037 /C-B 100808 -1.464993460022840E+005 1.00000000E+037 /C-B 101010 -1.554432841728783E+005 1.00000000E+037 /C-B 101212 -1.653898531355235E+005 1.00000000E+037 /C-B 20000 -3.045310850025351E+001 1.00000000E+037 /-DJ 20101 -4.046227583521389E+001 1.00000000E+037 /-DJ 20202 -1.528114809221961E+001 1.00000000E+037 /-DJ 20303 -1.981301455822251E+001 1.00000000E+037 /-DJ 20404 -3.381153078920816E+001 1.00000000E+037 /-DJ 20505 -3.777975078822931E+001 1.00000000E+037 /-DJ 20606 -2.981597043950304E+001 1.00000000E+037 /-DJ 20808 -3.780291790720471E+001 1.00000000E+037 /-DJ 21010 -6.703161666291514E+001 1.00000000E+037 /-DJ 21212 -8.829959112601935E+001 1.00000000E+037 /-DJ 110000 5.634453635331091E+001 1.00000000E+037 /-DJK 110101 8.372702073339890E+001 1.00000000E+037 /-DJK 110202 1.678739875011512E+001 1.00000000E+037 /-DJK 110303 2.576798735200066E+001 1.00000000E+037 /-DJK 110404 8.076276322984559E+001 1.00000000E+037 /-DJK 110505 7.302202680413073E+001 1.00000000E+037 /-DJK 110606 5.537848842154790E+001 1.00000000E+037 /-DJK 110808 7.791395825424236E+001 1.00000000E+037 /-DJK 111010 1.590207960586841E+002 1.00000000E+037 /-DJK 111212 1.730475500078098E+002 1.00000000E+037 /-DJK 200000 -3.167243617529295E+001 1.00000000E+037 /-DK 200101 -5.012713243112373E+001 1.00000000E+037 /-DK 200202 -5.747236298749826E+000 1.00000000E+037 /-DK 200303 -8.591082924494062E+000 1.00000000E+037 /-DK 200404 -5.052063910332659E+001 1.00000000E+037 /-DK 200505 -4.498153428630508E+001 1.00000000E+037 /-DK 200606 -3.158024874060054E+001 1.00000000E+037 /-DK 200808 -4.663486302066423E+001 1.00000000E+037 /-DK 201010 -7.889645746072772E+001 1.00000000E+037 /-DK 201212 -8.941564726303886E+001 1.00000000E+037 /-DK 30000 4.871947899362831E-003 1.00000000E+037 /HJ 30101 1.388998663739455E-002 1.00000000E+037 /HJ 30202 -5.262107952348594E-003 1.00000000E+037 /HJ 30404 1.541114951976461E-001 1.00000000E+037 /HJ 30505 2.095809485389958E-002 1.00000000E+037 /HJ 30606 8.880454163599474E-003 1.00000000E+037 /HJ 30808 1.266334641022633E-002 1.00000000E+037 /HJ 31010 9.122598196667361E-001 1.00000000E+037 /HJ 31212 1.066736270699817E+000 1.00000000E+037 /HJ 120000 -1.375379205410390E-002 1.00000000E+037 /HJJK 120101 -5.066152402417219E-002 1.00000000E+037 /HJJK 120202 2.467167787767121E-002 1.00000000E+037 /HJJK 120303 5.133151717500444E-003 1.00000000E+037 /HJJK 120404 -7.659017486477748E-001 1.00000000E+037 /HJJK 120606 -1.998084706235457E-002 1.00000000E+037 /HJJK 120808 -5.271163226174167E-002 1.00000000E+037 /HJJK 121010 -2.730130324529413E+000 1.00000000E+037 /HJJK 121212 -2.931206431712227E+000 1.00000000E+037 /HJJK 210000 1.370364782799563E-002 1.00000000E+037 /HJKK 210101 6.219434915136844E-002 1.00000000E+037 /HJKK 210202 -3.325766532581199E-002 1.00000000E+037 /HJKK 210303 -1.532473444512033E-002 1.00000000E+037 /HJKK 210404 6.348087624060665E-001 1.00000000E+037 /HJKK 210505 1.724629275370095E-002 1.00000000E+037 /HJKK 210606 1.375292194821609E-002 1.00000000E+037 /HJKK 210808 6.853539074221265E-002 1.00000000E+037 /HJKK 211010 1.789023212907953E+000 1.00000000E+037 /HJKK 211212 1.922051347917351E+000 1.00000000E+037 /HJKK 300101 -2.036569471432344E-002 1.00000000E+037 /HK 300202 1.473798466564212E-002 1.00000000E+037 /HK 300303 1.075958133909688E-002 1.00000000E+037 /HK 300808 -2.845580866283122E-002 1.00000000E+037 /HK 130101 7.500989776927388E-006 1.00000000E+037 /LJJJK 220101 -1.926625252902382E-005 1.00000000E+037 /LJJKK 310000 -1.161201988738160E-005 1.00000000E+037 /LJKKK 60000707 -3.064333661788678E+004 1.00000000E+037 /-2Czeta 60010707 -8.975152060313167E+000 1.00000000E+037 /etaJ 60100707 1.374020313110692E+001 1.00000000E+037 /etak 4000607 8.300422447340553E+002 1.00000000E+037 /q/2 60000909 -2.986460436950240E+004 1.00000000E+037 /-2Czeta 60010909 -8.292550640762746E+000 1.00000000E+037 /etaJ 60100909 1.234109856458019E+001 1.00000000E+037 /etak 4000809 8.858797819245036E+002 1.00000000E+037 /q/2 60001111 7.698615326507301E+004 1.00000000E+037 /-2Czeta 60011111 -1.066065567041626E+002 1.00000000E+037 /etaJ 4001011 -5.979691284775027E+003 1.00000000E+037 /q/2 60001313 6.554272140141070E+004 1.00000000E+037 /-2Czeta 60011313 -7.927014186913631E+000 1.00000000E+037 /etaJ 4001213 -6.139951356101256E+003 1.00000000E+037 /q/2 23000001 8.506277429196684E+000 1.00000000E+037 /sqrt(2)a 20000506 1.136279344524021E+004 1.00000000E+037 /h3 -20000408 1.136279344524021E+004 1.00000000E-037 /h3/2 4000704 2.143907535533538E+003 1.00000000E+037 /(h4)/2 -4000905 2.143907535533538E+003 1.00000000E-037 /(h4)/2