CH2CL2 13C Tue Jun 11 16:00:01 2024 -------------------------------------------------------------------------------------========= obs o-c error blends Notes o-c wt / instead of : below denotes (o-c)>3*err -------------------------------------------------------------------------------------========= ! ! legacy = Harmony et al. JMS 75,144-149(1979) ! 1: 1 1 0 2 2 1 0 1 2 2 27692.6800 -0.0249 0.050 -0.0250 0.17 2: 1 1 0 2 3 1 0 1 2 3 27692.6800 -0.0300 0.050 -0.0250 0.17 3: 1 1 0 2 2 1 0 1 2 3 27692.6800 -0.0200 0.050 -0.0250 0.17 4: 1 1 0 2 1 1 0 1 0 1 27692.6800 0.5503 0.050 -0.0250 0.17 5: 1 1 0 2 3 1 0 1 2 2 27692.6800 -0.0349 0.050 -0.0250 0.17 6: 1 1 0 0 1 1 0 1 2 1 27692.6800 -0.5902 0.050 -0.0250 0.17 ! 7: 2 1 1 2 1 2 0 2 2 0 27961.9000 -0.0496 0.050 -0.0252 0.12 8: 2 1 1 3 2 2 0 2 3 2 27961.9000 -0.0040 0.050 -0.0252 0.12 9: 2 1 1 2 0 2 0 2 2 1 27961.9000 -0.0604 0.050 -0.0252 0.12 10: 2 1 1 2 1 2 0 2 2 1 27961.9000 -0.0406 0.050 -0.0252 0.12 11: 2 1 1 2 3 2 0 2 2 4 27961.9000 -0.0028 0.050 -0.0252 0.12 12: 2 1 1 2 4 2 0 2 2 4 27961.9000 -0.0108 0.050 -0.0252 0.12 13: 2 1 1 2 3 2 0 2 2 3 27961.9000 -0.0127 0.050 -0.0252 0.12 14: 2 1 1 2 4 2 0 2 2 3 27961.9000 -0.0207 0.050 -0.0252 0.12 ! 15: 4 1 3 2 6 4 0 4 2 6 28919.2000 0.0235 0.050 0.0116 0.12 16: 4 1 3 2 2 4 0 4 2 3 28919.2000 0.0630 0.050 0.0116 0.12 17: 4 1 3 2 6 4 0 4 2 5 28919.2000 0.0569 0.050 0.0116 0.12 18: 4 1 3 2 5 4 0 4 2 5 28919.2000 0.0428 0.050 0.0116 0.12 19: 4 1 3 2 2 4 0 4 2 2 28919.2000 0.0336 0.050 0.0116 0.12 20: 4 1 3 2 5 4 0 4 2 6 28919.2000 0.0094 0.050 0.0116 0.12 21: 4 1 3 2 3 4 0 4 2 3 28919.2000 -0.0536 0.050 0.0116 0.12 22: 4 1 3 2 3 4 0 4 2 2 28919.2000 -0.0830 0.050 0.0116 0.12 ! 23: 5 1 4 2 4 5 0 5 2 3 29617.4000 0.0173 0.050 0.0081 0.02 24: 5 1 4 2 7 5 0 5 2 7 29617.4000 0.0143 0.050 0.0081 0.34 25: 5 1 4 2 6 5 0 5 2 7 29617.4000 0.0128 0.050 0.0081 0.02 26: 5 1 4 2 7 5 0 5 2 6 29617.4000 -0.0199 0.050 0.0081 0.02 27: 5 1 4 2 4 5 0 5 2 4 29617.4000 -0.0002 0.050 0.0081 0.17 28: 5 1 4 2 3 5 0 5 2 4 29617.4000 0.0367 0.050 0.0081 0.02 29: 5 1 4 2 3 5 0 5 2 3 29617.4000 0.0543 0.050 0.0081 0.15 30: 5 1 4 2 6 5 0 5 2 6 29617.4000 -0.0214 0.050 0.0081 0.27 ! 31: 6 1 5 2 7 6 0 6 2 8 30470.9300 -0.149 UNFITTD 30471.0791 32: 6 1 5 2 4 6 0 6 2 4 30470.9300 -0.140 UNFITTD 30471.0710 33: 6 1 5 2 4 6 0 6 2 5 30470.9300 -0.143 UNFITTD 30471.0733 34: 6 1 5 2 5 6 0 6 2 4 30470.9300 -0.162 UNFITTD 30471.0925 35: 6 1 5 2 7 6 0 6 2 7 30470.9300 -0.163 UNFITTD 30471.0937 36: 6 1 5 2 8 6 0 6 2 8 30470.9300 -0.153 UNFITTD 30471.0839 37: 6 1 5 2 5 6 0 6 2 5 30470.9300 -0.164 UNFITTD 30471.0949 38: 6 1 5 2 8 6 0 6 2 7 30470.9300 -0.168 UNFITTD 30471.0984 ! 39: 7 1 6 2 5 7 0 7 2 5 31488.5800 0.0083 0.050 0.0054 0.18 40: 7 1 6 2 8 7 0 7 2 9 31488.5800 0.0036 0.050 0.0054 0.01 41: 7 1 6 2 8 7 0 7 2 8 31488.5800 -0.0077 0.050 0.0054 0.27 42: 7 1 6 2 9 7 0 7 2 9 31488.5800 0.0225 0.050 0.0054 0.32 43: 7 1 6 2 9 7 0 7 2 8 31488.5800 0.0111 0.050 0.0054 0.01 44: 7 1 6 2 5 7 0 7 2 6 31488.5800 0.0093 0.050 0.0054 0.01 45: 7 1 6 2 6 7 0 7 2 5 31488.5800 -0.0072 0.050 0.0054 0.01 46: 7 1 6 2 6 7 0 7 2 6 31488.5800 -0.0062 0.050 0.0054 0.20 ! 47: 8 1 7 2 10 8 0 8 2 10 32679.3100 -0.1274 0.050 -0.1373 0.31 48: 8 1 7 2 9 8 0 8 2 9 32679.3100 -0.1434 0.050 -0.1373 0.27 49: 8 1 7 2 6 8 0 8 2 6 32679.3100 -0.1358 0.050 -0.1373 0.19 50: 8 1 7 2 6 8 0 8 2 7 32679.3100 -0.1329 0.050 -0.1373 0.01 51: 8 1 7 2 9 8 0 8 2 10 32679.3100 -0.1327 0.050 -0.1373 0.01 52: 8 1 7 2 10 8 0 8 2 9 32679.3100 -0.1380 0.050 -0.1373 0.01 53: 8 1 7 2 7 8 0 8 2 7 32679.3100 -0.1453 0.050 -0.1373 0.21 54: 8 1 7 2 7 8 0 8 2 6 32679.3100 -0.1482 0.050 -0.1373 0.01 ! 55: 9 1 8 2 7 9 0 9 2 8 34054.4300 0.0485 0.050 0.0445 0.01 56: 9 1 8 2 10 9 0 9 2 11 34054.4300 0.0500 0.050 0.0445 0.01 57: 9 1 8 2 10 9 0 9 2 10 34054.4300 0.0393 0.050 0.0445 0.27 58: 9 1 8 2 7 9 0 9 2 7 34054.4300 0.0433 0.050 0.0445 0.20 59: 9 1 8 2 8 9 0 9 2 8 34054.4300 0.0377 0.050 0.0445 0.21 60: 9 1 8 2 11 9 0 9 2 11 34054.4300 0.0546 0.050 0.0445 0.30 61: 9 1 8 2 11 9 0 9 2 10 34054.4300 0.0440 0.050 0.0445 0.01 62: 9 1 8 2 8 9 0 9 2 7 34054.4300 0.0326 0.050 0.0445 0.01 ! 63: 1 1 1 1 2 0 0 0 1 1 33799.6400 -0.3562 0.050 -0.0683 0.17 64: 1 1 1 1 1 0 0 0 1 1 33799.6400 0.2976 0.050 -0.0683 0.17 65: 1 1 1 1 2 0 0 0 3 3 33799.6400 -0.3562 0.050 -0.0683 0.17 66: 1 1 1 3 4 0 0 0 3 3 33799.6400 0.1251 0.050 -0.0683 0.17 67: 1 1 1 2 3 0 0 0 2 2 33799.6400 -0.0603 0.050 -0.0683 0.17 68: 1 1 1 2 2 0 0 0 2 2 33799.6400 -0.0599 0.050 -0.0683 0.17 ! ! waveguide FTMW ! 69: 6 0 6 3 3 5 1 5 3 2 12560.3118 -0.0108 0.010 70: 6 0 6 3 4 5 1 5 3 3 12561.8480 0.0053 0.010 71: 6 0 6 1 6 5 1 5 1 5 12561.9697 0.0015 0.010 -0.0047 0.50 72: 6 0 6 2 6 5 1 5 0 5 12561.9697 -0.0110 0.010 -0.0047 0.50 73: 6 0 6 3 9 5 1 5 3 8 12563.1360 -0.0070 0.010 74: 6 0 6 3 5 5 1 5 3 4 12564.0838 0.0007 0.010 75: 6 0 6 1 7 5 1 5 1 6 12564.9566 -0.0104 0.010 76: 6 0 6 2 5 5 1 5 2 4 12565.3879 -0.0116 0.010 -0.0022 0.20 77: 6 0 6 2 7 5 1 5 2 6 12565.3879 0.0094 0.010 -0.0022 0.28 78: 6 0 6 2 8 5 1 5 2 7 12565.3879 -0.0012 0.010 -0.0022 0.33 79: 6 0 6 2 7 5 1 5 2 7 12565.3879 0.0133 0.010 -0.0022 0.01 80: 6 0 6 2 4 5 1 5 2 3 12565.3879 -0.0131 0.010 -0.0022 0.16 81: 6 0 6 2 4 5 1 5 2 4 12565.3879 -0.0140 0.010 -0.0022 0.01 82: 6 0 6 1 5 5 1 5 1 4 12567.5728 -0.0013 0.010 -0.0038 0.39 83: 6 0 6 3 8 5 1 5 3 7 12567.5728 -0.0052 0.010 -0.0038 0.61 84: 6 0 6 0 6 5 1 5 2 5 12568.8130 0.0068 0.010 85: 6 0 6 3 7 5 1 5 3 6 12569.5666 -0.0066 0.010 ! 86: 9 2 8 3 10 10 1 9 3 11 11739.5534 0.0055 0.010 87: 9 2 8 2 9 10 1 9 2 10 11740.0679 0.0124 0.010 88: 9 2 8 3 9 10 1 9 3 10 11740.3625 0.0048 0.010 89: 9 2 8 1 8 10 1 9 1 9 11740.7285 0.0033 0.010 90: 9 2 8 3 11 10 1 9 3 12 11742.4252 0.0017 0.010 91: 9 2 8 2 7 10 1 9 2 8 11743.5715 -0.0034 0.010 -0.0040 0.26 92: 9 2 8 2 10 10 1 9 2 11 11743.5715 0.0027 0.010 -0.0040 0.35 93: 9 2 8 2 11 10 1 9 2 12 11743.5715 -0.0106 0.010 -0.0040 0.39 94: 9 2 8 1 10 10 1 9 1 11 11743.6752 -0.0117 0.010 95: 9 2 8 3 8 10 1 9 3 9 11743.7832 -0.0003 0.010 96: 9 2 8 3 7 10 1 9 3 8 11744.9999 0.0049 0.010 97: 9 2 8 3 12 10 1 9 3 13 11746.4922 -0.0048 0.010 98: 9 2 8 0 9 10 1 9 0 10 11747.0785 -0.0003 0.010 99: 9 2 8 3 6 10 1 9 3 7 11747.7935 0.0176 0.010 ! 100: 13 1 12 2 13 12 2 11 2 12 11929.9269 0.0026 0.010 0.0028 0.50 101: 13 1 12 1 13 12 2 11 1 12 11929.9269 0.0028 0.010 0.0028 0.50 102: 13 1 12 3 16 12 2 11 3 15 11930.4027 0.0162 0.010 103: 13 1 12 2 14 12 2 11 2 13 11933.7878 0.0180 0.010 -0.0021 0.27 104: 13 1 12 2 12 12 2 11 2 11 11933.7878 -0.0215 0.010 -0.0021 0.23 105: 13 1 12 2 11 12 2 11 2 10 11933.7878 -0.0077 0.010 -0.0021 0.21 106: 13 1 12 2 15 12 2 11 2 14 11933.7878 -0.0011 0.010 -0.0021 0.29 107: 13 1 12 3 15 12 2 11 3 14 11934.7410 0.0029 0.010 108: 13 1 12 3 13 12 2 11 3 12 11937.4780 -0.0028 0.010 109: 13 1 12 0 13 12 2 11 0 12 11937.6514 -0.0174 0.010 ! 110: 13 2 11 3 11 14 1 14 3 12 10471.4317 -0.0069 0.010 111: 13 2 11 2 15 14 1 14 2 16 10472.9476 0.0196 0.010 0.0045 0.29 112: 13 2 11 2 14 14 1 14 2 15 10472.9476 0.0201 0.010 0.0045 0.27 113: 13 2 11 2 12 14 1 14 2 13 10472.9476 -0.0164 0.010 0.0045 0.23 114: 13 2 11 2 11 14 1 14 2 12 10472.9476 -0.0124 0.010 0.0045 0.22 ! 115: 17 3 15 3 18 18 2 16 3 19 16646.5335 0.0127 0.010 116: 17 3 15 3 16 18 2 16 3 17 16646.9156 0.0104 0.010 117: 17 3 15 3 19 18 2 16 3 20 16648.2274 0.0051 0.010 118: 17 3 15 1 16 18 2 16 1 17 16648.6112 -0.0091 0.010 0.0053 0.17 119: 17 3 15 2 15 18 2 16 2 16 16648.6112 0.0113 0.010 0.0053 0.17 120: 17 3 15 1 18 18 2 16 1 19 16648.6112 -0.0083 0.010 0.0053 0.17 121: 17 3 15 2 19 18 2 16 2 20 16648.6112 0.0066 0.010 0.0053 0.17 122: 17 3 15 2 16 18 2 16 2 17 16648.6112 0.0196 0.010 0.0053 0.17 123: 17 3 15 2 18 18 2 16 2 19 16648.6112 0.0116 0.010 0.0053 0.17 124: 17 3 15 3 15 18 2 16 3 16 16649.0155 0.0121 0.010 125: 17 3 15 3 20 18 2 16 3 21 16650.3060 -0.0035 0.010 126: 17 3 15 2 17 18 2 16 0 18 16650.4763 -0.0141 0.010 -0.0142 0.50 127: 17 3 15 1 17 18 2 16 1 18 16650.4763 -0.0142 0.010 -0.0142 0.50 ! 128: 18 3 16 3 19 19 2 17 3 20 8908.8077 -0.0051 0.010 129: 18 3 16 3 20 19 2 17 3 21 8910.7509 0.0031 0.010 130: 18 3 16 2 20 19 2 17 2 21 8911.1471 -0.0051 0.010 -0.0023 0.19 131: 18 3 16 2 16 19 2 17 2 17 8911.1471 0.0022 0.010 -0.0023 0.15 132: 18 3 16 1 19 19 2 17 1 20 8911.1471 -0.0131 0.010 -0.0023 0.18 133: 18 3 16 1 17 19 2 17 1 18 8911.1471 -0.0162 0.010 -0.0023 0.16 134: 18 3 16 2 19 19 2 17 2 20 8911.1471 0.0077 0.010 -0.0023 0.18 135: 18 3 16 2 17 19 2 17 2 18 8911.1471 0.0114 0.010 -0.0023 0.16 136: 18 3 16 3 16 19 2 17 3 17 8911.5536 0.0002 0.010 137: 18 3 16 3 21 19 2 17 3 22 8913.0786 -0.0123 0.010 138: 18 3 16 2 18 19 2 17 0 19 8913.2781 -0.0022 0.010 -0.0023 0.50 139: 18 3 16 1 18 19 2 17 1 19 8913.2781 -0.0023 0.010 -0.0023 0.50 ! 140: 19 3 16 1 19 20 2 19 1 20 14480.4773 -0.0024 0.010 -0.0025 0.50 141: 19 1 18 2 19 20 2 19 0 20 14480.4773 -0.0024 0.010 -0.0025 0.50 unstable upper labels 142: 19 3 16 2 20 20 2 19 2 21 14482.4926 0.0099 0.010 0.0035 0.26 143: 19 3 16 2 21 20 2 19 2 22 14482.4926 0.0080 0.010 0.0035 0.27 144: 19 3 16 1 20 20 2 19 1 21 14482.4926 0.0090 0.010 0.0035 0.26 145: 19 3 16 2 17 20 2 19 2 18 14482.4926 -0.0161 0.010 0.0035 0.22 ! 146: 20 3 17 3 17 21 2 20 3 18 9045.9693 -0.0163 0.010 147: 20 3 17 0 20 21 2 20 0 21 9046.0751 -0.0027 0.010 -0.0028 0.50 148: 20 3 17 1 20 21 2 20 1 21 9046.0751 -0.0027 0.010 -0.0028 0.50 149: 20 3 17 3 23 21 2 20 3 24 9046.1734 0.0090 0.010 150: 20 3 17 3 22 21 2 20 3 23 9048.3927 0.0104 0.010 151: 20 3 17 3 19 21 2 20 3 20 9050.1216 0.0005 0.010 152: 20 3 17 3 21 21 2 20 3 22 9050.3735 -0.0009 0.010 ! 153: 22 2 20 3 20 21 3 19 3 19 15348.7013 -0.0040 0.010 154: 22 2 20 3 24 21 3 19 3 23 15349.5557 0.0118 0.010 155: 22 2 20 3 23 21 3 19 3 22 15352.1043 -0.0109 0.010 ! 156: 25 2 24 3 26 24 3 21 3 25 10947.8184 -0.0061 0.010 157: 25 2 24 0 25 24 1 23 2 24 10947.9514 0.0015 0.010 -0.0070 0.50 unstable lower labels 158: 25 2 24 3 25 24 3 21 3 24 10947.9514 -0.0156 0.010 -0.0070 0.50 159: 25 2 24 3 24 24 3 21 3 23 10948.0918 0.0063 0.010 160: 25 2 24 3 27 24 3 21 3 26 10950.4534 -0.0083 0.010 161: 25 2 24 2 23 24 3 21 2 22 10950.7408 0.0072 0.010 -0.0007 0.17 162: 25 2 24 1 26 24 3 21 1 25 10950.7408 -0.0028 0.010 -0.0007 0.17 163: 25 2 24 2 24 24 3 21 2 23 10950.7408 0.0035 0.010 -0.0007 0.17 164: 25 2 24 2 26 24 3 21 2 25 10950.7408 0.0059 0.010 -0.0007 0.17 165: 25 2 24 1 24 24 3 21 1 23 10950.7408 -0.0057 0.010 -0.0007 0.17 166: 25 2 24 2 27 24 3 21 2 26 10950.7408 -0.0124 0.010 -0.0007 0.17 167: 25 2 24 3 23 24 3 21 3 22 10951.0102 -0.0039 0.010 ! 168: 26 2 25 0 26 25 3 22 2 25 15417.2893 0.0109 0.010 0.0020 0.50 unstable upper labels 169: 26 2 25 3 26 25 3 22 3 25 15417.2893 -0.0070 0.010 0.0020 0.50 170: 26 2 25 3 28 25 3 22 3 27 15419.9930 0.0022 0.010 171: 26 2 25 1 25 25 3 22 1 24 15420.2851 -0.0024 0.010 0.0018 0.16 172: 26 2 25 2 27 25 3 22 2 26 15420.2851 0.0071 0.010 0.0018 0.17 173: 26 2 25 2 28 25 3 22 2 27 15420.2851 -0.0101 0.010 0.0018 0.18 174: 26 2 25 1 27 25 3 22 1 26 15420.2851 -0.0019 0.010 0.0018 0.17 175: 26 2 25 2 24 25 3 22 2 23 15420.2851 0.0122 0.010 0.0018 0.15 176: 26 2 25 2 25 25 3 22 2 24 15420.2851 0.0074 0.010 0.0018 0.16 177: 26 2 25 1 26 25 3 22 1 25 15423.2812 0.0026 0.010 0.0026 0.50 178: 26 2 25 2 26 25 3 22 0 25 15423.2812 0.0026 0.010 0.0026 0.50 ! 179: 26 4 23 0 26 27 3 24 2 27 15215.9547 0.0081 0.010 0.0018 0.50 unstable upper labels 180: 26 4 23 3 26 27 3 24 3 27 15215.9547 -0.0045 0.010 0.0018 0.50 181: 26 4 23 2 25 27 3 24 2 26 15216.8631 0.0033 0.010 -0.0044 0.16 182: 26 4 23 2 28 27 3 24 2 29 15216.8631 -0.0100 0.010 -0.0044 0.18 183: 26 4 23 1 25 27 3 24 1 26 15216.8631 -0.0029 0.010 -0.0044 0.16 184: 26 4 23 2 27 27 3 24 2 28 15216.8631 -0.0023 0.010 -0.0044 0.17 185: 26 4 23 2 24 27 3 24 2 25 15216.8631 -0.0055 0.010 -0.0044 0.15 186: 26 4 23 1 27 27 3 24 1 28 15216.8631 -0.0081 0.010 -0.0044 0.17 187: 26 4 23 2 26 27 3 24 0 27 15217.7671 -0.0107 0.010 -0.0108 0.50 188: 26 4 23 1 26 27 3 24 1 27 15217.7671 -0.0107 0.010 -0.0108 0.50 ! 189: 27 4 23 3 30 28 3 26 3 31 13998.9172 -0.0045 0.010 -0.0037 0.28 190: 27 4 23 2 27 28 3 26 0 28 13998.9172 -0.0034 0.010 -0.0037 0.25 191: 27 4 23 3 24 28 3 26 3 25 13998.9172 -0.0031 0.010 -0.0037 0.22 192: 27 4 23 1 27 28 3 26 1 28 13998.9172 -0.0034 0.010 -0.0037 0.25 193: 27 4 23 1 26 28 3 26 1 27 13999.4178 0.0059 0.010 0.0103 0.19 194: 27 4 23 1 28 28 3 26 1 29 13999.4178 0.0094 0.010 0.0103 0.20 195: 27 4 23 2 26 28 3 26 2 27 13999.4178 0.0057 0.010 0.0103 0.19 196: 27 4 23 2 28 28 3 26 2 29 13999.4178 0.0123 0.010 0.0103 0.20 197: 27 4 23 3 29 28 3 26 3 30 13999.4178 0.0169 0.010 0.0103 0.21 198: 27 4 23 0 27 28 3 26 2 28 13999.8995 0.0050 0.010 0.0046 0.50 199: 27 4 23 3 27 28 3 26 3 28 13999.8995 0.0041 0.010 0.0046 0.50 ! 200: 31 3 28 1 32 30 4 27 1 31 15359.8057 0.0141 0.010 0.0094 0.17 201: 31 3 28 1 30 30 4 27 1 29 15359.8057 0.0261 0.010 0.0094 0.16 202: 31 3 28 2 30 30 4 27 2 29 15359.8057 0.0177 0.010 0.0094 0.16 203: 31 3 28 2 29 30 4 27 2 28 15359.8057 -0.0133 0.010 0.0094 0.16 204: 31 3 28 2 32 30 4 27 2 31 15359.8057 0.0097 0.010 0.0094 0.17 205: 31 3 28 2 33 30 4 27 2 32 15359.8057 0.0014 0.010 0.0094 0.18 ! 206: 32 3 30 3 32 31 4 27 3 31 10380.5359 0.0032 0.010 0.0033 0.25 207: 32 3 30 3 33 31 4 27 3 32 10380.5359 0.0146 0.010 0.0033 0.26 208: 32 5 28 0 32 31 4 27 2 31 10380.5359 0.0029 0.010 0.0033 0.25 unstable upper labels 209: 32 3 30 3 31 31 4 27 3 30 10380.5359 -0.0084 0.010 0.0033 0.24 210: 32 3 30 2 31 31 4 27 2 30 10381.2554 0.0036 0.010 0.0047 0.16 211: 32 3 30 1 33 31 4 27 1 32 10381.2554 0.0113 0.010 0.0047 0.17 212: 32 3 30 1 31 31 4 27 1 30 10381.2554 0.0043 0.010 0.0047 0.16 213: 32 3 30 2 33 31 4 27 2 32 10381.2554 0.0119 0.010 0.0047 0.17 214: 32 3 30 2 34 31 4 27 2 33 10381.2554 -0.0048 0.010 0.0047 0.18 215: 32 3 30 2 30 31 4 27 2 29 10381.2554 0.0015 0.010 0.0047 0.16 216: 32 3 30 1 32 31 4 27 1 31 10381.9682 0.0049 0.010 0.0049 0.50 217: 32 3 30 2 32 31 4 27 0 31 10381.9682 0.0049 0.010 0.0049 0.50 unstable lower labels ! 218: 33 3 31 3 33 32 4 28 3 32 16259.4632 -0.0052 0.010 -0.0051 0.50 219: 33 3 31 0 33 32 2 30 2 32 16259.4632 -0.0048 0.010 -0.0051 0.50 unstable lower labels 220: 33 3 31 2 31 32 4 28 2 30 16260.2829 0.0134 0.010 0.0116 0.24 221: 33 3 31 1 32 32 4 28 1 31 16260.2829 0.0139 0.010 0.0116 0.25 222: 33 3 31 2 32 32 4 28 2 31 16260.2829 0.0138 0.010 0.0116 0.25 223: 33 3 31 2 35 32 4 28 2 34 16260.2829 0.0057 0.010 0.0116 0.27 224: 33 3 31 1 33 32 4 28 1 32 16261.0652 -0.0003 0.010 -0.0004 0.50 225: 33 3 31 2 33 32 4 28 0 32 16261.0652 -0.0003 0.010 -0.0004 0.50 unstable upper labels ! 226: 35 5 31 3 35 36 4 32 3 36 13331.8739 0.0158 0.010 0.0180 0.50 227: 35 5 31 0 35 36 2 34 2 36 13331.8739 0.0201 0.010 0.0180 0.50 unstable lower labels 228: 35 5 31 2 33 36 4 32 2 34 13332.3155 -0.0030 0.010 0.0015 0.16 229: 35 5 31 1 36 36 4 32 1 37 13332.3155 0.0008 0.010 0.0015 0.17 230: 35 5 31 2 37 36 4 32 2 38 13332.3155 -0.0056 0.010 0.0015 0.18 231: 35 5 31 2 36 36 4 32 2 37 13332.3155 0.0032 0.010 0.0015 0.17 232: 35 5 31 1 34 36 4 32 1 35 13332.3155 0.0062 0.010 0.0015 0.16 233: 35 5 31 2 34 36 4 32 2 35 13332.3155 0.0080 0.010 0.0015 0.16 234: 35 5 31 2 35 36 4 32 0 36 13332.7417 -0.0239 0.010 -0.0239 0.50 235: 35 5 31 1 35 36 4 32 1 36 13332.7417 -0.0239 0.010 -0.0239 0.50 ! 236: 40 4 37 3 38 39 5 34 3 37 10351.5029 0.0295 0.010 0.0092 0.12 237: 40 4 37 1 41 39 5 34 1 40 10351.5029 0.0098 0.010 0.0092 0.13 238: 40 4 37 1 39 39 5 34 1 38 10351.5029 0.0100 0.010 0.0092 0.12 239: 40 4 37 2 41 39 5 34 2 40 10351.5029 0.0092 0.010 0.0092 0.13 240: 40 4 37 2 39 39 5 34 2 38 10351.5029 0.0084 0.010 0.0092 0.12 241: 40 4 37 3 42 39 5 34 3 41 10351.5029 0.0052 0.010 0.0092 0.13 242: 40 4 37 2 42 39 5 34 2 41 10351.5029 0.0009 0.010 0.0092 0.13 243: 40 4 37 2 38 39 5 34 2 37 10351.5029 0.0016 0.010 0.0092 0.12 ! 244: 44 6 39 2 46 45 5 40 2 47 10943.3890 0.0012 0.010 0.0080 0.15 245: 44 6 39 3 42 45 5 40 3 43 10943.3890 -0.0039 0.010 0.0080 0.14 246: 44 6 39 2 45 45 5 40 2 46 10943.3890 0.0120 0.010 0.0080 0.15 247: 44 6 39 2 43 45 5 40 2 44 10943.3890 0.0167 0.010 0.0080 0.14 248: 44 6 39 1 45 45 5 40 1 46 10943.3890 0.0106 0.010 0.0080 0.15 249: 44 6 39 1 43 45 5 40 1 44 10943.3890 0.0162 0.010 0.0080 0.14 250: 44 6 39 2 42 45 5 40 2 43 10943.3890 0.0025 0.010 0.0080 0.14 251: 44 6 39 1 44 45 5 40 1 45 10943.6259 -0.0126 0.010 -0.0127 0.50 252: 44 6 39 2 44 45 5 40 0 45 10943.6259 -0.0126 0.010 -0.0127 0.50 ! 253: 48 5 43 1 48 47 6 42 1 47 10064.2994 0.0134 0.010 0.0135 0.50 254: 48 5 43 2 48 47 8 40 0 47 10064.2994 0.0134 0.010 0.0135 0.50 unstable lower labels 255: 48 5 43 3 50 47 6 42 3 49 10064.6945 -0.0103 0.010 0.0004 0.15 256: 48 5 43 1 47 47 6 42 1 46 10064.6945 0.0075 0.010 0.0004 0.14 257: 48 5 43 1 49 47 6 42 1 48 10064.6945 0.0090 0.010 0.0004 0.14 258: 48 5 43 2 49 47 6 42 2 48 10064.6945 0.0086 0.010 0.0004 0.14 259: 48 5 43 2 47 47 6 42 2 46 10064.6945 0.0057 0.010 0.0004 0.14 260: 48 5 43 2 50 47 6 42 2 49 10064.6945 -0.0059 0.010 0.0004 0.15 261: 48 5 43 2 46 47 6 42 2 45 10064.6945 -0.0117 0.010 0.0004 0.14 262: 48 5 43 3 49 47 6 42 3 48 10065.0671 -0.0388 0.010 -0.0207 0.34 263: 48 5 43 3 47 47 6 42 3 46 10065.0671 -0.0030 0.010 -0.0207 0.33 264: 48 5 43 3 48 47 6 42 3 47 10065.0671 -0.0195 0.010 -0.0207 0.33 ! 265: 48 5 44 3 50 47 6 41 3 49 8063.8686 -0.0080 0.010 -0.0104 0.15 266: 48 5 44 2 49 47 6 41 2 48 8063.8686 -0.0021 0.010 -0.0104 0.15 267: 48 5 44 1 47 47 6 41 1 46 8063.8686 -0.0082 0.010 -0.0104 0.14 268: 48 5 44 1 49 47 6 41 1 48 8063.8686 -0.0020 0.010 -0.0104 0.15 269: 48 5 44 2 47 47 6 41 2 46 8063.8686 -0.0097 0.010 -0.0104 0.14 270: 48 5 44 2 50 47 6 41 2 49 8063.8686 -0.0206 0.010 -0.0104 0.15 271: 48 5 44 2 46 47 6 41 2 45 8063.8686 -0.0224 0.010 -0.0104 0.14 ! ! cavity FTMW ! 272: 2 1 2 3 2 3 0 3 3 2 8039.5056 -0.0009 0.002 273: 2 1 2 3 3 3 0 3 3 3 8039.6767 0.0005 0.002 274: 2 1 2 3 4 3 0 3 3 5 8044.2189 0.0003 0.002 275: 2 1 2 3 5 3 0 3 3 6 8044.4038 -0.0004 0.002 276: 2 1 2 1 1 3 0 3 1 2 8045.1844 -0.0024 0.002 277: 2 1 2 0 2 3 0 3 0 3 8045.5364 0.0000 0.002 278: 2 1 2 2 2 3 0 3 2 3 8045.9820 0.0016 0.002 279: 2 1 2 1 2 3 0 3 1 3 8046.1560 -0.0023 0.002 280: 2 1 2 1 3 3 0 3 1 4 8047.0535 0.0021 0.002 281: 2 1 2 3 3 3 0 3 3 4 8047.1587 0.0007 0.002 282: 2 1 2 3 2 3 0 3 3 3 8051.1055 -0.0013 0.002 ! 283: 1 1 1 3 4 2 0 2 3 5 14672.9078 0.0018 0.002 284: 1 1 1 3 4 2 0 2 3 4 14687.8890 0.0049 0.002 285: 1 1 1 3 3 2 0 2 3 4 14688.6258 -0.0013 0.002 286: 1 1 1 2 1 2 0 2 2 2 14690.8888 -0.0023 0.002 287: 1 1 1 1 2 2 0 2 3 3 14691.3770 -0.0005 0.002 288: 1 1 1 3 3 2 0 2 3 3 14691.6383 -0.0009 0.002 289: 1 1 1 3 2 2 0 2 1 2 14666.4808 -0.0029 0.002 290: 1 1 1 1 1 2 0 2 1 2 14666.7537 -0.0013 0.002 291: 1 1 1 0 1 2 0 2 0 2 14667.3383 0.0024 0.002 292: 1 1 1 1 2 2 0 2 1 3 14676.3741 -0.0021 0.002 293: 1 1 1 3 3 2 0 2 1 3 14676.6371 -0.0008 0.002 294: 1 1 1 1 1 2 0 2 3 2 14678.7282 0.0003 0.002 295: 1 1 1 2 3 2 0 2 2 4 14679.0967 0.0034 0.002 -0.0007 0.56 296: 1 1 1 2 3 2 0 2 2 3 14679.0967 -0.0064 0.002 -0.0007 0.15 297: 1 1 1 2 2 2 0 2 2 3 14679.0967 -0.0060 0.002 -0.0007 0.29 298: 1 1 1 1 2 2 0 2 3 2 14679.3864 0.0046 0.002 -------------------------------------------------------------------------------------========= 1 Lines rejected from fit PARAMETERS IN FIT (values truncated and Nlines statistics): 10000 A /MHz 30746.5973(18) 1 20000 B /MHz 3320.68528(18) 2 30000 C /MHz 3053.51320(23) 3 200 DJ /kHz 1.3855(43) 4 1100 DJK /kHz -24.87(12) 5 2000 DK /kHz 446.0(12) 6 40100 delJ /kHz 0.18376(28) 7 41000 delK /kHz 5.378(21) 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 -62.6257(40) 26 -220010000 chi.aa*3 /MHz -62.6257(40) = 1.00000 * 26 110040000 chi(b-c)/4 /MHz -9.5358(14) 27 -220040000 chi(b-c) /MHz -9.5358(14) = 1.00000 * 27 110610000 chi.ab /MHz [-51.39] 28 -220610000 chi.ab /MHz [51.3900000000001] = -1.00000 * 28 10030000 Mcc {+IMJ /MHz [ 0.001323] 29 -20030000 Mcc /MHz [ 0.001323] = 1.00000 * 29 MICROWAVE AVG = -0.001571 MHz, IR AVG = 0.00000 MICROWAVE RMS = 0.016666 MHz, IR RMS = 0.00000 END OF ITERATION 1 OLD, NEW RMS ERROR= 0.90782 0.90782 distinct frequency lines in fit: 120 distinct parameters of fit: 10 lines rejected from fit: 1 (ERRTST = 3.00E+00) upper state lower state overall limits of quantum number 1: 1 48 0 47 0 48 limits of quantum number 2: 0 6 0 8 0 8 limits of quantum number 3: 0 44 0 42 0 44 limits of quantum number 4: 0 3 0 3 0 3 limits of quantum number 5: 0 50 0 49 0 50 frequency range: 8039 34054 PARAMETERS IN FIT WITH STANDARD ERRORS ON THOSE THAT ARE FITTED: (values rounded and degrees of freedom, Ndegf=Nlines-Nconst, statistics) 10000 A /MHz 30746.5974(17) 1 20000 B /MHz 3320.68529(17) 2 30000 C /MHz 3053.51320(22) 3 200 DJ /kHz 1.3855(41) 4 1100 DJK /kHz -24.88(12) 5 2000 DK /kHz 446.1(11) 6 40100 delJ /kHz 0.18377(27) 7 41000 delK /kHz 5.378(20) 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 -62.6257(38) 26 -220010000 chi.aa*3 /MHz -62.6257(38) = 1.00000 * 26 110040000 chi(b-c)/4 /MHz -9.5359(13) 27 -220040000 chi(b-c) /MHz -9.5359(13) = 1.00000 * 27 110610000 chi.ab /MHz [-51.39] 28 -220610000 chi.ab /MHz [51.3900000000001] = -1.00000 * 28 10030000 Mcc {+IMJ /MHz [ 0.001323] 29 -20030000 Mcc /MHz [ 0.001323] = 1.00000 * 29 CORRELATION COEFFICIENTS, C.ij: A B C -DJ -DJK -DK -delJ -delK A 1.0000 B 0.6220 1.0000 C 0.9597 0.6780 1.0000 -DJ 0.6888 -0.1074 0.6203 1.0000 -DJK 0.7022 -0.0851 0.6355 0.9992 1.0000 -DK -0.7107 0.0727 -0.6423 -0.9968 -0.9991 1.0000 -delJ 0.7484 0.0392 0.7056 0.9657 0.9747 -0.9780 1.0000 -delK -0.6122 -0.3011 -0.5935 -0.5964 -0.6263 0.6436 -0.7749 1.0000 chi.aa*3/2 -0.0332 0.0011 -0.0152 -0.0257 -0.0247 0.0249 -0.0162 -0.0064 chi(b-c)/4 -0.0769 -0.0401 -0.0471 -0.0300 -0.0292 0.0301 -0.0196 -0.0056 chi.aa*3 chi(b-c) chi.aa*3/2 1.0000 chi(b-c)/4 0.7781 1.0000 Mean value of |C.ij|, i.ne.j = 0.4285 Mean value of C.ij, i.ne.j = 0.0555 Worst correlations, with absolute value greater than 0.9950: 1100 -DJK <-> 200 -DJ 0.999158 2000 -DK <-> 200 -DJ -0.996825 2000 -DK <-> 1100 -DJK -0.999051 Worst fitted lines (obs-calc/error): 47: -2.7 284: 2.4 234: -2.4 298: 2.3 262: -2.1 226: 1.8 99: 1.8 109: -1.7 146: -1.6 102: 1.6 289: -1.4 126: -1.4 63: -1.4 253: 1.3 115: 1.3 251: -1.3 87: 1.2 137: -1.2 124: 1.2 291: 1.2 276: -1.2 154: 1.2 94: -1.2 220: 1.2 279: -1.1 286: -1.1 155: -1.1 69: -1.1 187: -1.1 280: 1.0 292: -1.0 265: -1.0 150: 1.0 75: -1.0 116: 1.0 193: 1.0 200: 0.9 236: 0.9 149: 0.9 283: 0.9 55: 0.9 160: -0.8 278: 0.8 244: 0.8 157: -0.7 73: -0.7 110: -0.7 84: 0.7 85: -0.7 285: -0.6 47: 8 1 7 2 10 8 0 8 2 10 32679.3100 -0.1274 0.050 -0.1373 0.31 284: 1 1 1 3 4 2 0 2 3 4 14687.8890 0.0049 0.002 234: 35 5 31 2 35 36 4 32 0 36 13332.7417 -0.0239 0.010 -0.0239 0.50 298: 1 1 1 1 2 2 0 2 3 2 14679.3864 0.0046 0.002 262: 48 5 43 3 49 47 6 42 3 48 10065.0671 -0.0388 0.010 -0.0207 0.34 226: 35 5 31 3 35 36 4 32 3 36 13331.8739 0.0158 0.010 0.0180 0.50 99: 9 2 8 3 6 10 1 9 3 7 11747.7935 0.0176 0.010 109: 13 1 12 0 13 12 2 11 0 12 11937.6514 -0.0174 0.010 146: 20 3 17 3 17 21 2 20 3 18 9045.9693 -0.0163 0.010 102: 13 1 12 3 16 12 2 11 3 15 11930.4027 0.0162 0.010 _____________________________________ __________________________________________/ SPFIT output reformatted with PIFORM