H235ClCCF3 v_18=1: (Ogata v=0, MMW v=1) Tue Jan 31 15:00:53 2017 18 2042 11 0 0.0000E+000 3.0000E+005 1.0000E+000 1.0000000000 a 4 2 , , , , , , , -1 , , , a 1 1 , , , , , , , , , , 10099 5.324967909723155E+003 1.00000000E+005 /A 20099 1.800578352158109E+003 1.00000000E+005 /B 30099 1.784594882209142E+003 1.00000000E+005 /C 299 -2.760335886317513E-004 1.00000000E+000 /-DJ 1199 -2.823666724942853E-003 1.00000000E+000 /-DJK 2099 1.765175706252184E-003 1.00000000E+000 /-DK 40199 2.843888455660053E-007 1.00000000E+000 /-dJ 41099 -5.566864847196916E-004 1.00000000E+000 /-dK 399 2.920124109716303E-011 1.00000000E+000 /HJ 1299 2.925344076229984E-010 1.00000000E+000 /HJK 2199 -2.483787691199530E-009 1.00000000E+000 /HKJ 3099 2.417885965257658E-009 1.00000000E+000 /HK 40299 -3.263589384910335E-012 1.00000000E+000 /hJ 41199 7.276012626049765E-009 1.00000000E+000 /hJK 42099 0.000000000000000E+000 1.00000000E-037 /hK 110010000 -6.894770000000000E+001 1.00000000E-037 /chi.aa*3/2 110040000 -8.714370000000001E+000 1.00000000E-037 /chi(b-c)/4 110610000 5.210300000000000E+001 1.00000000E-037 /chi.ab ! !------------------------------------------------------------------------------- !-------------------------------------------------------------------------------