CH2CL2: v4=2 Fri Jun 21 14:19:46 2024 -------------------------------------------------------------------------------------========= obs o-c error blends Notes o-c wt / instead of : below denotes (o-c)>3*err -------------------------------------------------------------------------------------========= 1: 42 4 39 2 41 41 5 36 2 40 8280.2388 -0.0054 0.010 -0.0046 0.50 2: 42 4 39 1 41 41 5 36 1 40 8280.2388 -0.0038 0.010 -0.0046 0.50 ! 3: 26 2 25 3 26 25 3 22 3 25 8662.8716 -0.0164 0.010 -0.0084 0.50 4: 26 2 25 0 26 25 3 22 2 25 8662.8716 -0.0004 0.010 -0.0084 0.50 5: 26 2 25 1 27 25 3 22 1 26 8665.5954 0.0024 0.010 -0.0016 0.17 6: 26 2 25 2 27 25 3 22 2 26 8665.5954 0.0104 0.010 -0.0016 0.17 7: 26 2 25 2 25 25 3 22 2 24 8665.5954 -0.0034 0.010 -0.0016 0.16 8: 26 2 25 2 28 25 3 22 2 27 8665.5954 -0.0037 0.010 -0.0016 0.18 9: 26 2 25 1 25 25 3 22 1 24 8665.5954 -0.0117 0.010 -0.0016 0.16 10: 26 2 25 2 24 25 3 22 2 23 8665.5954 -0.0046 0.010 -0.0016 0.15 11: 26 2 25 2 26 25 3 22 0 25 8668.3138 0.0006 0.010 0.0007 0.50 12: 26 2 25 1 26 25 3 22 1 25 8668.3138 0.0006 0.010 0.0007 0.50 ! 13: 10 2 9 3 11 11 1 10 3 12 9193.9546 0.0003 0.010 14: 10 2 9 3 10 11 1 10 3 11 9194.6882 -0.0069 0.010 15: 10 2 9 1 9 11 1 10 1 10 9195.0693 -0.0012 0.010 16: 10 2 9 3 8 11 1 10 3 9 9199.4283 0.0010 0.010 17: 10 2 9 3 13 11 1 10 3 14 9201.2224 0.0018 0.010 18: 10 2 9 3 7 11 1 10 3 8 9202.4329 0.0044 0.010 ! 19: 2 1 2 3 4 3 0 3 3 5 9711.7732 0.0040 0.010 20: 2 1 2 3 5 3 0 3 3 6 9711.8837 0.0136 0.010 21: 2 1 2 0 2 3 0 3 0 3 9712.9769 0.0024 0.010 22: 2 1 2 2 2 3 0 3 2 3 9713.5351 -0.0146 0.010 23: 2 1 2 1 3 3 0 3 1 4 9714.5609 0.0047 0.010 24: 2 1 2 3 3 3 0 3 3 4 9714.7388 -0.0037 0.010 ! 25: 32 3 29 3 35 31 4 28 3 34 9958.5917 0.0111 0.010 26: 32 3 29 1 32 31 4 28 1 31 9958.8098 0.0108 0.010 0.0105 0.50 27: 32 1 31 2 32 31 4 28 2 31 9958.8098 0.0102 0.010 0.0105 0.50 upper label 28: 32 3 29 3 29 31 4 28 3 28 9959.0291 0.0089 0.010 29: 32 3 29 2 30 31 4 28 2 29 9959.8678 0.0167 0.010 -0.0120 0.31 30: 32 3 29 1 33 31 4 28 1 32 9959.8678 -0.0035 0.010 -0.0120 0.34 31: 32 3 29 2 33 31 4 28 2 32 9959.8678 -0.0467 0.010 -0.0120 0.34 32: 32 3 29 3 30 31 4 28 3 29 9960.4162 0.0001 0.010 33: 32 3 29 1 31 31 4 28 1 30 9960.6005 0.0032 0.010 34: 32 3 29 3 34 31 4 28 3 33 9960.7390 -0.0062 0.010 35: 32 3 29 3 31 31 4 28 3 30 9961.3243 0.0028 0.010 36: 32 3 29 3 32 31 4 28 3 31 9961.7221 -0.0084 0.010 37: 32 3 29 3 33 31 4 28 3 32 9962.1734 -0.0092 0.010 ! 38: 19 3 17 3 20 20 2 18 3 21 10240.0366 0.0124 0.010 39: 19 3 17 3 18 20 2 18 3 19 10240.4056 -0.0025 0.010 40: 19 3 17 3 21 20 2 18 3 22 10242.0146 0.0006 0.010 41: 19 3 17 2 21 20 2 18 2 22 10242.4057 0.0034 0.010 0.0074 0.51 42: 19 3 17 2 20 20 2 18 2 21 10242.4057 0.0114 0.010 0.0074 0.49 43: 19 3 17 3 22 20 2 18 3 23 10244.4073 0.0118 0.010 44: 19 3 17 1 19 20 2 18 1 20 10244.5867 0.0010 0.010 0.0010 0.50 45: 19 3 17 2 19 20 2 18 0 20 10244.5867 0.0010 0.010 0.0010 0.50 46: 19 3 17 3 16 20 2 18 3 17 10244.7891 -0.0040 0.010 ! 47: 6 0 6 3 3 5 1 5 3 2 10846.2321 -0.0036 0.010 48: 6 0 6 3 4 5 1 5 3 3 10847.7442 -0.0003 0.010 49: 6 0 6 3 9 5 1 5 3 8 10849.0555 -0.0013 0.010 50: 6 0 6 3 5 5 1 5 3 4 10849.9901 0.0009 0.010 51: 6 0 6 1 7 5 1 5 1 6 10850.8761 0.0000 0.010 52: 6 0 6 1 5 5 1 5 1 4 10853.4891 0.0070 0.010 53: 6 0 6 0 6 5 1 5 2 5 10854.7204 0.0015 0.010 54: 6 0 6 3 7 5 1 5 3 6 10855.4911 0.0018 0.010 ! 55: 14 2 12 3 11 15 1 15 3 12 11058.8338 0.0063 0.010 56: 14 2 12 1 14 15 1 15 1 15 11059.5177 -0.0004 0.010 -0.0005 0.50 57: 14 2 12 0 14 15 1 15 0 15 11059.5177 -0.0005 0.010 -0.0005 0.50 58: 14 2 12 3 17 15 1 15 3 18 11060.1405 -0.0093 0.010 59: 14 2 12 3 12 15 1 15 3 13 11065.6011 0.0092 0.010 60: 14 2 12 3 13 15 1 15 1 14 11066.9320 0.0022 0.010 -0.0022 0.46 61: 14 2 12 1 15 15 1 15 1 16 11066.9320 -0.0060 0.010 -0.0022 0.54 62: 14 2 12 3 16 15 1 15 3 17 11068.2733 -0.0072 0.010 63: 14 2 12 1 13 15 1 15 3 14 11073.8074 0.0040 0.010 64: 14 2 12 3 14 15 1 15 3 15 11074.3631 0.0034 0.010 65: 14 2 12 2 14 15 1 15 2 15 11074.5097 -0.0108 0.010 66: 14 2 12 3 15 15 1 15 3 16 11075.1500 0.0097 0.010 ! 67: 33 2 31 3 31 34 1 34 3 32 12634.2986 0.0168 0.010 68: 33 2 31 1 34 34 1 34 1 35 12635.2314 0.0159 0.010 -0.0005 0.17 69: 33 2 31 2 35 34 1 34 2 36 12635.2314 -0.0094 0.010 -0.0005 0.18 70: 33 2 31 2 31 34 1 34 2 32 12635.2314 -0.0087 0.010 -0.0005 0.16 71: 33 2 31 1 32 34 1 34 1 33 12635.2314 0.0183 0.010 -0.0005 0.16 72: 33 2 31 2 32 34 1 34 2 33 12635.2314 -0.0106 0.010 -0.0005 0.16 73: 33 2 31 2 34 34 1 34 2 35 12635.2314 -0.0085 0.010 -0.0005 0.17 ! 74: 28 4 25 2 26 29 3 26 2 27 13044.1284 -0.0102 0.010 -0.0053 0.16 75: 28 4 25 2 27 29 3 26 2 28 13044.1284 0.0000 0.010 -0.0053 0.16 76: 28 4 25 2 29 29 3 26 2 30 13044.1284 -0.0011 0.010 -0.0053 0.17 77: 28 4 25 1 27 29 3 26 1 28 13044.1284 -0.0056 0.010 -0.0053 0.16 78: 28 4 25 1 29 29 3 26 1 30 13044.1284 -0.0065 0.010 -0.0053 0.17 79: 28 4 25 2 30 29 3 26 2 31 13044.1284 -0.0084 0.010 -0.0053 0.18 80: 28 4 25 2 28 29 3 26 0 29 13045.1609 -0.0105 0.010 ! 81: 23 2 21 1 23 22 3 20 1 22 14075.6008 0.0071 0.010 0.0072 0.50 82: 23 2 21 2 23 22 3 20 2 22 14075.6008 0.0071 0.010 0.0072 0.50 83: 23 2 21 3 21 22 3 20 3 20 14077.9382 -0.0009 0.010 84: 23 2 21 3 25 22 3 20 3 24 14078.7608 0.0045 0.010 85: 23 2 21 3 22 22 3 20 3 21 14080.8969 0.0041 0.010 86: 23 2 21 3 24 22 3 20 3 23 14081.3252 -0.0141 0.010 ! 87: 13 2 11 3 10 14 1 14 3 11 14649.8170 0.0113 0.010 88: 13 2 11 1 13 14 1 14 1 14 14650.5155 -0.0040 0.010 -0.0041 0.50 89: 13 2 11 0 13 14 1 14 0 14 14650.5155 -0.0041 0.010 -0.0041 0.50 90: 13 2 11 3 16 14 1 14 3 17 14651.1461 -0.0227 0.010 91: 13 2 11 3 11 14 1 14 3 12 14656.3636 0.0127 0.010 ! 92: 14 1 13 3 11 13 2 12 3 10 14670.3393 0.0077 0.010 93: 14 1 13 1 14 13 2 12 1 13 14670.8299 -0.0028 0.010 94: 14 1 13 3 17 13 2 12 3 16 14671.2770 0.0014 0.010 95: 14 1 13 3 12 13 2 12 3 11 14673.6955 -0.0013 0.010 96: 14 1 13 3 16 13 2 12 3 15 14675.6422 0.0002 0.010 97: 14 1 13 1 13 13 2 12 1 12 14678.1430 0.0025 0.010 98: 14 1 13 3 14 13 2 12 3 13 14678.5063 -0.0031 0.010 99: 14 1 13 3 15 13 2 12 3 14 14679.1100 0.0029 0.010 ! 100: 1 1 1 1 1 2 0 2 1 2 16323.7958 0.0087 0.010 101: 1 1 1 2 2 2 0 2 0 2 16324.9644 -0.0135 0.010 102: 1 1 1 3 4 2 0 2 3 5 16330.0253 0.0076 0.010 103: 1 1 1 3 2 2 0 2 1 3 16332.5068 -0.0182 0.010 104: 1 1 1 1 2 2 0 2 3 2 16336.6186 -0.0055 0.010 105: 1 1 1 1 0 2 0 2 1 1 16345.8550 0.0065 0.010 106: 1 1 1 3 3 2 0 2 3 4 16345.9900 -0.0086 0.010 107: 1 1 1 1 2 2 0 2 3 3 16348.7269 0.0024 0.010 ! 108: 34 2 32 1 35 35 1 35 1 36 16471.8719 0.0115 0.010 -0.0042 0.17 109: 34 2 32 1 33 35 1 35 1 34 16471.8719 0.0136 0.010 -0.0042 0.16 110: 34 2 32 2 32 35 1 35 2 33 16471.8719 -0.0119 0.010 -0.0042 0.16 111: 34 2 32 2 36 35 1 35 2 37 16471.8719 -0.0126 0.010 -0.0042 0.18 112: 34 2 32 2 35 35 1 35 2 36 16471.8719 -0.0117 0.010 -0.0042 0.17 113: 34 2 32 2 33 35 1 35 2 34 16471.8719 -0.0137 0.010 -0.0042 0.16 114: 34 2 32 3 36 35 1 35 3 37 16472.7599 -0.0097 0.010 ! 115: 9 2 8 2 9 10 1 9 2 10 16930.3111 -0.0066 0.010 116: 9 2 8 3 9 10 1 9 3 10 16930.6289 0.0074 0.010 117: 9 2 8 1 8 10 1 9 1 9 16930.9937 0.0038 0.010 118: 9 2 8 3 11 10 1 9 3 12 16932.6689 0.0020 0.010 119: 9 2 8 1 10 10 1 9 1 11 16933.9222 -0.0056 0.010 120: 9 2 8 3 8 10 1 9 3 9 16934.0281 0.0000 0.010 121: 9 2 8 3 7 10 1 9 3 8 16935.2399 -0.0007 0.010 122: 9 2 8 3 12 10 1 9 3 13 16936.7142 -0.0001 0.010 123: 9 2 8 0 9 10 1 9 0 10 16937.3004 0.0006 0.010 124: 9 2 8 3 6 10 1 9 3 7 16938.0000 0.0000 0.010 ! 125: 28 2 27 1 27 27 3 24 1 26 17395.8600 -0.0031 0.010 0.0072 0.24 126: 28 2 27 2 29 27 3 24 2 28 17395.8600 0.0167 0.010 0.0072 0.26 127: 28 2 27 2 27 27 3 24 2 26 17395.8600 0.0061 0.010 0.0072 0.24 128: 28 2 27 1 29 27 3 24 1 28 17395.8600 0.0083 0.010 0.0072 0.26 129: 28 2 27 2 28 27 3 24 0 27 17398.9930 0.0074 0.010 0.0074 0.50 130: 28 2 27 1 28 27 3 24 1 27 17398.9930 0.0074 0.010 0.0074 0.50 ! 131: 7 0 7 1 7 6 1 6 1 6 17911.3693 0.0065 0.010 0.0036 0.50 132: 7 0 7 2 7 6 1 6 0 6 17911.3693 0.0006 0.010 0.0036 0.50 133: 7 0 7 3 5 6 1 6 3 4 17912.0885 0.0038 0.010 134: 7 0 7 3 10 6 1 6 3 9 17912.3755 0.0003 0.010 135: 7 0 7 3 6 6 1 6 3 5 17914.1342 0.0164 0.010 136: 7 0 7 3 9 6 1 6 3 8 17916.8353 -0.0200 0.010 137: 7 0 7 1 6 6 1 6 1 5 17917.3806 -0.0013 0.010 138: 7 0 7 0 7 6 1 6 2 6 17918.5118 -0.0030 0.010 139: 7 0 7 3 8 6 1 6 3 7 17919.2589 -0.0055 0.010 -------------------------------------------------------------------------------- PARAMETERS IN FIT (values truncated and Nlines statistics): 10000 A /MHz 32393.4637(37) 1 20000 B /MHz 3315.08477(36) 2 30000 C /MHz 3056.60333(35) 3 200 DJ /kHz 1.3860(31) 4 1100 DJK /kHz -26.067(87) 5 2000 DK /kHz 502.39(94) 6 40100 delJ /kHz 0.17672(12) 7 41000 delK /kHz 6.442(10) 8 300 HJ /Hz [ 0.00088481] 9 1200 HJK /Hz [ 0.011682] 10 2100 HKJ /Hz [-1.73797] 11 3000 HK /Hz [23.0511] 12 40200 hJ /Hz [ 0.00028422] 13 41100 hJK /Hz [ 0.004058] 14 42000 hK /Hz [ 1.492] 15 400 LJ /mHz [ 0.] 16 1300 LJJK /mHz [-0.0000647] 17 2200 LJK /mHz [ 0.00489] 18 3100 LKKJ /mHz [ 0.1026] 19 4000 LK /mHz [-1.5112] 20 40300 lJ /mHz [ 0.] 21 41200 lJK /mHz [ 0.] 22 42100 lKJ /mHz [ 0.] 23 43000 lK /mHz [ 0.759] 24 5000 PK /mHz [ 0.] 25 110010000 chi.aa*3/2 /MHz -63.198(18) 26 -220010000 chi.aa*3 /MHz -63.198(18) = 1.00000 * 26 110040000 chi(b-c)/4 /MHz -9.4815(28) 27 -220040000 chi(b-c) /MHz -9.4815(28) = 1.00000 * 27 110610000 chi.ab /MHz -51.04(27) 28 -220610000 chi.ab /MHz 51.04(27) = -1.00000 * 28 MICROWAVE AVG = 0.000096 MHz, IR AVG = 0.00000 MICROWAVE RMS = 0.007548 MHz, IR RMS = 0.00000 END OF ITERATION 1 OLD, NEW RMS ERROR= 0.75475 0.75475 distinct frequency lines in fit: 102 distinct parameters of fit: 11 upper state lower state overall limits of quantum number 1: 1 42 2 41 1 42 limits of quantum number 2: 0 4 0 5 0 5 limits of quantum number 3: 1 39 2 36 1 39 limits of quantum number 4: 0 3 0 3 0 3 limits of quantum number 5: 0 41 1 40 0 41 frequency range: 8280 17919 PARAMETERS IN FIT WITH STANDARD ERRORS ON THOSE THAT ARE FITTED: (values rounded and degrees of freedom, Ndegf=Nlines-Nconst, statistics) 10000 A /MHz 32393.4637(30) 1 20000 B /MHz 3315.08477(29) 2 30000 C /MHz 3056.60333(28) 3 200 DJ /kHz 1.3861(24) 4 1100 DJK /kHz -26.067(70) 5 2000 DK /kHz 502.39(75) 6 40100 delJ /kHz 0.176721(94) 7 41000 delK /kHz 6.4429(80) 8 300 HJ /Hz [ 0.00088481] 9 1200 HJK /Hz [ 0.011682] 10 2100 HKJ /Hz [-1.73797] 11 3000 HK /Hz [23.0511] 12 40200 hJ /Hz [ 0.00028422] 13 41100 hJK /Hz [ 0.004058] 14 42000 hK /Hz [ 1.492] 15 400 LJ /mHz [ 0.] 16 1300 LJJK /mHz [-0.0000647] 17 2200 LJK /mHz [ 0.00489] 18 3100 LKKJ /mHz [ 0.1026] 19 4000 LK /mHz [-1.5112] 20 40300 lJ /mHz [ 0.] 21 41200 lJK /mHz [ 0.] 22 42100 lKJ /mHz [ 0.] 23 43000 lK /mHz [ 0.759] 24 5000 PK /mHz [ 0.] 25 110010000 chi.aa*3/2 /MHz -63.198(14) 26 110040000 chi(b-c)/4 /MHz -9.4815(22) 27 110610000 chi.ab /MHz -51.05(21) 28 CORRELATION COEFFICIENTS, C.ij: A B C -DJ -DJK -DK -delJ -delK A 1.0000 B 0.8824 1.0000 C 0.9817 0.9256 1.0000 -DJ 0.2039 -0.2523 0.1152 1.0000 -DJK 0.2429 -0.2152 0.1530 0.9983 1.0000 -DK -0.3406 0.1188 -0.2453 -0.9764 -0.9873 1.0000 -delJ 0.2174 -0.2397 0.1334 0.9982 0.9969 -0.9762 1.0000 -delK 0.2202 -0.2104 0.1572 0.9183 0.9139 -0.8882 0.9248 1.0000 chi.aa*3/2 0.0063 -0.0045 0.0097 0.0274 0.0271 -0.0255 0.0300 0.0276 chi(b-c)/4 -0.0451 -0.0478 -0.0305 0.0324 0.0294 -0.0190 0.0366 0.0266 chi.ab 0.0834 0.1017 0.0680 -0.0324 -0.0167 -0.0161 -0.0392 -0.1808 chi.aa*3 chi(b-c) chi.ab chi.aa*3/2 1.0000 chi(b-c)/4 0.4171 1.0000 chi.ab -0.0201 -0.0092 1.0000 Mean value of |C.ij|, i.ne.j = 0.3063 Mean value of C.ij, i.ne.j = 0.0947 Worst correlations, with absolute value greater than 0.9950: 1100 -DJK <-> 200 -DJ 0.998255 40100 -delJ <-> 200 -DJ 0.998195 40100 -delJ <-> 1100 -DJK 0.996905 Worst fitted lines (obs-calc/error): 90: -2.3 136: -2.0 103: -1.8 67: 1.7 135: 1.6 22: -1.5 86: -1.4 20: 1.4 101: -1.3 91: 1.3 38: 1.2 29: -1.2 43: 1.2 87: 1.1 25: 1.1 65: -1.1 26: 1.1 80: -1.1 66: 1.0 114: -1.0 58: -0.9 37: -0.9 59: 0.9 28: 0.9 100: 0.9 106: -0.9 36: -0.8 3: -0.8 92: 0.8 102: 0.8 129: 0.7 116: 0.7 41: 0.7 125: 0.7 62: -0.7 81: 0.7 52: 0.7 14: -0.7 115: -0.7 105: 0.6 55: 0.6 34: -0.6 119: -0.6 139: -0.5 104: -0.5 74: -0.5 23: 0.5 1: -0.5 84: 0.4 18: 0.4 90: 13 2 11 3 16 14 1 14 3 17 14651.1461 -0.0227 0.010 136: 7 0 7 3 9 6 1 6 3 8 17916.8353 -0.0200 0.010 103: 1 1 1 3 2 2 0 2 1 3 16332.5068 -0.0182 0.010 67: 33 2 31 3 31 34 1 34 3 32 12634.2986 0.0168 0.010 135: 7 0 7 3 6 6 1 6 3 5 17914.1342 0.0164 0.010 22: 2 1 2 2 2 3 0 3 2 3 9713.5351 -0.0146 0.010 86: 23 2 21 3 24 22 3 20 3 23 14081.3252 -0.0141 0.010 20: 2 1 2 3 5 3 0 3 3 6 9711.8837 0.0136 0.010 101: 1 1 1 2 2 2 0 2 0 2 16324.9644 -0.0135 0.010 91: 13 2 11 3 11 14 1 14 3 12 14656.3636 0.0127 0.010 _____________________________________ __________________________________________/ SPFIT output reformatted with PIFORM