CH2CL2: v4=2 Fri Jun 21 14:19:51 2024 31 139 5 0 0.0000E+000 3.0000E+002 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 , 1.0, 1.0,,,,,,,,,,,,, 10000 3.239346367588102E+004 1.00000000E+000 / A 20000 3.315084772499275E+003 1.00000000E+000 / B 30000 3.056603325702677E+003 1.00000000E+000 / C 200 -1.386048237292037E-003 1.00000000E+000 /-DJ 1100 2.606717200367655E-002 1.00000000E+000 /-DJK 2000 -5.023909040378202E-001 1.00000000E+000 /-DK 40100 -1.767208743682760E-004 1.00000000E+000 /-delJ 41000 -6.442868735141411E-003 1.00000000E+000 /-delK 300 8.848100000000003E-010 1.00000000E-037 /HJ 1200 1.168200000000000E-008 1.00000000E-037 /HJK 2100 -1.737970000000002E-006 1.00000000E-037 /HKJ 3000 2.305110000000000E-005 1.00000000E-037 /HK 40200 2.842200000000000E-010 1.00000000E-037 /hJ 41100 4.058000000000002E-009 1.00000000E-037 /hJK 42000 1.492000000000000E-006 1.00000000E-037 /hK 400 0.000000000000000E+000 1.00000000E-037 /LJ 1300 -6.470000000000004E-014 1.00000000E-037 /LJJK 2200 4.890000000000000E-012 1.00000000E-037 /LJK 3100 1.026000000000000E-010 1.00000000E-037 /LKKJ 4000 -1.511200000000000E-009 1.00000000E-037 /LK 40300 0.000000000000000E+000 1.00000000E-037 /lJ 41200 0.000000000000000E+000 1.00000000E-037 /lJK 42100 0.000000000000000E+000 1.00000000E-037 /lKJ 43000 7.590000000000008E-010 1.00000000E-037 /lK 5000 -0.000000000000000E+000 1.00000000E-037 /PK 110010000 -6.319821052276246E+001 1.00000000E+000 /chi.aa*3/2 -220010000 -6.319821052276246E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.481533350876724E+000 1.00000000E+000 /chi(b-c)/4 -220040000 -9.481533350876724E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.104729834771094E+001 1.00000000E+001 /chi.ab -220610000 5.104729834771094E+001 1.00000000E-037 /chi.ab ! !------------------------------------------------------------------------------- ! Switching to g.s. fixed sextics and higher (ir values were used below) ! ! RMS ERROR= 0.75475 0.75475 ! CH2CL2: v4=2 Fri Jun 21 14:19:51 2024 31 139 5 0 0.0000E+000 3.0000E+002 1.0000E+000 1.0000000000 a 44 1 0 , , , -2 , 1.0, 1.0,,,,,,,,,,,,, 10000 3.239346367588102E+004 1.00000000E+000 / A 20000 3.315084772499275E+003 1.00000000E+000 / B 30000 3.056603325702677E+003 1.00000000E+000 / C 200 -1.386048237292037E-003 1.00000000E+000 /-DJ 1100 2.606717200367655E-002 1.00000000E+000 /-DJK 2000 -5.023909040378202E-001 1.00000000E+000 /-DK 40100 -1.767208743682760E-004 1.00000000E+000 /-delJ 41000 -6.442868735141411E-003 1.00000000E+000 /-delK 300 8.848100000000003E-010 1.00000000E-037 /HJ 1200 1.168200000000000E-008 1.00000000E-037 /HJK 2100 -1.737970000000002E-006 1.00000000E-037 /HKJ 3000 2.305110000000000E-005 1.00000000E-037 /HK 40200 2.842200000000000E-010 1.00000000E-037 /hJ 41100 4.058000000000002E-009 1.00000000E-037 /hJK 42000 1.492000000000000E-006 1.00000000E-037 /hK 400 0.000000000000000E+000 1.00000000E-037 /LJ 1300 -6.470000000000004E-014 1.00000000E-037 /LJJK 2200 4.890000000000000E-012 1.00000000E-037 /LJK 3100 1.026000000000000E-010 1.00000000E-037 /LKKJ 4000 -1.511200000000000E-009 1.00000000E-037 /LK 40300 0.000000000000000E+000 1.00000000E-037 /lJ 41200 0.000000000000000E+000 1.00000000E-037 /lJK 42100 0.000000000000000E+000 1.00000000E-037 /lKJ 43000 7.590000000000008E-010 1.00000000E-037 /lK 5000 -0.000000000000000E+000 1.00000000E-037 /PK 110010000 -6.319821052276246E+001 1.00000000E+000 /chi.aa*3/2 -220010000 -6.319821052276246E+001 1.00000000E-037 /chi.aa*3/2 110040000 -9.481533350876724E+000 1.00000000E+000 /chi(b-c)/4 -220040000 -9.481533350876724E+000 1.00000000E-037 /chi(b-c)/4 110610000 -5.104729834771094E+001 1.00000000E+001 /chi.ab -220610000 5.104729834771094E+001 1.00000000E-037 /chi.ab ! !-------------------------------------------------------------------------------