81Br Bromobenzene Tue Sep 26 12:00:47 2017 -------------------------------------------------------------------------------------========= obs o-c error blends Notes o-c wt / instead of : below denotes (o-c)>3*err -------------------------------------------------------------------------------------========= ! ! Etchison...Cooke, JMS 242,39(2007) ! 1: 1 0 1 0 1 0 0 0 0 2 1709.7843 0.0002 0.002 2: 1 0 1 0 3 0 0 0 0 2 1801.3860 0.0029 0.002 correction 3: 1 0 1 0 2 0 0 0 0 2 1918.5128 0.0003 0.002 ! ! IFPAN FTMW ! 4: 2 0 2 0 2 1 0 1 0 2 3553.8085 -0.0001 0.002 5: 2 0 2 0 2 1 0 1 0 1 3762.5369 -0.0001 0.002 6: 2 0 2 0 3 1 0 1 0 2 3633.7628 0.0018 0.002 7: 2 0 2 0 4 1 0 1 0 3 3634.3265 -0.0003 0.002 ! 8: 2 1 1 0 1 1 1 0 0 1 3682.5219 -0.0004 0.002 9: 2 1 1 0 3 1 1 0 0 2 3883.9746 0.0000 0.002 10: 2 1 1 0 4 1 1 0 0 3 3765.4706 0.0002 0.002 11: 2 1 2 0 2 1 1 1 0 2 3554.1444 -0.0002 0.002 12: 2 1 2 0 4 1 1 1 0 3 3474.2119 0.0000 0.002 ! 13: 3 0 3 0 2 2 0 2 0 1 5481.2581 -0.0004 0.002 14: 3 0 3 0 2 2 0 2 0 2 5362.6519 -0.0008 0.002 15: 3 0 3 0 3 2 0 2 0 3 5399.5089 -0.0002 0.002 16: 3 0 3 0 3 2 0 2 0 2 5479.4614 0.0000 0.002 17: 3 0 3 0 4 2 0 2 0 3 5451.7304 0.0000 0.002 18: 3 0 3 0 5 2 0 2 0 4 5452.1087 -0.0002 0.002 19: 3 1 2 0 2 2 1 1 0 2 5615.6903 -0.0006 0.002 ! 20: 3 1 2 0 2 2 1 1 0 1 5675.0147 -0.0002 0.002 21: 3 1 2 0 3 2 1 1 0 3 5661.8690 -0.0004 0.002 22: 3 1 2 0 3 2 1 1 0 2 5705.2668 0.0000 0.002 23: 3 1 2 0 4 2 1 1 0 4 5766.3256 0.0005 0.002 24: 3 1 2 0 4 2 1 1 0 3 5703.3505 -0.0002 0.002 25: 3 1 2 0 5 2 1 1 0 4 5675.2363 0.0008 0.002 ! 26: 3 2 1 0 2 2 2 0 0 1 5370.1891 -0.0007 0.002 27: 3 2 1 0 3 2 2 0 0 2 5486.0109 0.0000 0.002 28: 3 2 1 0 4 2 2 0 0 3 5569.0491 -0.0003 0.002 29: 3 2 1 0 5 2 2 0 0 4 5451.3210 0.0028 1.002 30: 3 2 2 0 2 2 2 1 0 1 5356.9349 -0.0009 0.002 31: 3 2 2 0 3 2 2 1 0 2 5472.5531 -0.0003 0.002 32: 3 2 2 0 4 2 2 1 0 3 5555.5225 0.0002 0.002 33: 3 2 2 0 5 2 2 1 0 4 5437.9888 0.0017 0.002 ! 34: 5 0 5 0 6 4 0 4 0 5 9048.7591 -0.0005 0.002 35: 5 0 5 0 7 4 0 4 0 6 9049.1380 -0.0025 0.002 ! 36: 5 1 4 0 6 4 1 3 0 5 9468.6340 0.0007 0.002 37: 5 1 4 0 7 4 1 3 0 6 9463.1020 0.0019 0.002 38: 5 1 5 0 6 4 1 4 0 5 8740.5498 0.0012 0.002 39: 5 1 5 0 7 4 1 4 0 6 8735.0304 0.0005 0.002 ! 40: 5 2 3 0 6 4 2 2 0 5 9190.1954 0.0000 0.002 41: 5 2 4 0 7 4 2 3 0 6 9100.7482 0.0000 0.002 ! 42: 7 0 7 0 8 6 0 6 0 7 12581.2028 0.0000 0.002 43: 7 0 7 0 9 6 0 6 0 8 12581.6545 0.0000 0.002 ! 44: 7 1 7 0 8 6 1 6 0 7 12213.4491 -0.0004 0.002 45: 7 1 7 0 9 6 1 6 0 8 12211.5454 -0.0004 0.002 ! 46: 7 2 5 0 7 6 2 4 0 6 12926.2363 0.0000 0.002 47: 7 2 5 0 8 6 2 4 0 7 12925.1315 0.0002 0.002 48: 7 2 6 0 6 6 2 5 0 5 12735.4473 -0.0003 0.002 49: 7 2 6 0 9 6 2 5 0 8 12734.6893 0.0000 0.002 ! 50: 7 3 4 0 8 6 3 3 0 7 12806.3369 -0.0005 0.002 51: 7 3 5 0 6 6 3 4 0 5 12778.9975 -0.0004 0.002 ! 52: 9 0 9 0 11 8 0 8 0 10 16039.2141 0.0012 0.002 ! 53: 9 1 9 0 9 8 1 8 0 8 15671.2504 -0.0002 0.002 54: 9 1 9 0 11 8 1 8 0 10 15668.5401 -0.0003 0.002 ! ! Peebles+Peebles, J.Mol.Struct. 657,107(2003) ! 55: 4 1 4 0 6 3 1 3 0 5 6989.5274 -0.0011 0.002 56: 4 1 4 0 3 3 1 3 0 2 6994.4169 -0.0002 0.002 57: 4 1 4 0 5 3 1 3 0 4 7000.6395 -0.0047 0.002 58: 4 1 4 0 4 3 1 3 0 3 7006.3656 0.0008 0.002 ! 59: 4 0 4 0 5 3 0 3 0 4 7257.2493 -0.0053 0.002 60: 4 0 4 0 6 3 0 3 0 5 7257.6130 0.0014 0.002 61: 4 0 4 0 4 3 0 3 0 3 7270.2956 0.0053 0.002 62: 4 0 4 0 3 3 0 3 0 2 7270.9854 0.0038 0.002 ! 63: 4 1 3 0 6 3 1 2 0 5 7572.4367 0.0012 0.002 64: 4 1 3 0 3 3 1 2 0 2 7578.1496 -0.0041 0.002 65: 4 1 3 0 5 3 1 2 0 4 7583.6015 0.0011 0.002 66: 4 1 3 0 4 3 1 2 0 3 7590.0989 -0.0049 0.002 ! 67: 4 2 3 0 6 3 2 2 0 5 7275.1521 0.0003 0.002 68: 4 2 3 0 4 3 2 2 0 3 7305.4974 -0.0014 0.002 69: 4 2 3 0 5 3 2 2 0 4 7320.8604 -0.0039 0.002 ! 70: 4 2 2 0 3 3 2 1 0 2 7290.8381 -0.0001 0.002 71: 4 2 2 0 6 3 2 1 0 5 7308.4274 0.0023 0.002 72: 4 2 2 0 4 3 2 1 0 3 7339.0265 0.0017 0.002 73: 4 2 2 0 5 3 2 1 0 4 7354.4165 0.0028 0.002 ! 74: 5 1 5 0 7 4 1 4 0 6 8735.0313 0.0014 0.002 75: 5 1 5 0 4 4 1 4 0 3 8739.5640 -0.0001 0.002 76: 5 1 5 0 6 4 1 4 0 5 8740.5501 0.0015 0.002 77: 5 1 5 0 5 4 1 4 0 4 8745.4378 0.0000 0.002 ! 78: 5 0 5 0 6 4 0 4 0 5 9048.7579 -0.0017 0.002 79: 5 0 5 0 7 4 0 4 0 6 9049.1387 -0.0018 0.002 80: 5 0 5 0 5 4 0 4 0 4 9056.4941 -0.0012 0.002 81: 5 0 5 0 4 4 0 4 0 3 9056.9938 -0.0007 0.002 ! 82: 5 1 4 0 7 4 1 3 0 6 9463.0991 -0.0009 0.002 83: 5 1 4 0 4 4 1 3 0 3 9468.1180 0.0014 0.002 84: 5 1 4 0 6 4 1 3 0 5 9468.6349 0.0016 0.002 85: 5 1 4 0 5 4 1 3 0 4 9473.9770 -0.0005 0.002 ! 86: 5 2 4 0 4 4 2 3 0 3 9096.6370 0.0032 0.002 87: 5 2 4 0 7 4 2 3 0 6 9100.7479 -0.0003 0.002 88: 5 2 4 0 5 4 2 3 0 4 9120.5972 0.0034 0.002 89: 5 2 4 0 6 4 2 3 0 5 9123.4481 -0.0031 0.002 ! 90: 5 2 3 0 4 4 2 2 0 3 9162.9766 0.0018 0.002 91: 5 2 3 0 7 4 2 2 0 6 9167.1674 -0.0007 0.002 92: 5 2 3 0 5 4 2 2 0 4 9187.2572 -0.0014 0.002 93: 5 2 3 0 6 4 2 2 0 5 9190.1969 0.0014 0.002 ! 94: 5 3 3 0 4 4 3 2 0 3 9091.6980 0.0053 0.002 95: 5 3 3 0 7 4 3 2 0 6 9109.8441 0.0013 0.002 96: 5 3 3 0 5 4 3 2 0 4 9144.8976 0.0005 0.002 97: 5 3 3 0 6 4 3 2 0 5 9161.7765 0.0045 0.002 ! 98: 5 3 2 0 4 4 3 1 0 3 9092.6972 0.0005 0.002 99: 5 3 2 0 7 4 3 1 0 6 9110.8479 -0.0016 0.002 100: 5 3 2 0 5 4 3 1 0 4 9145.9098 -0.0021 0.002 101: 5 3 2 0 6 4 3 1 0 5 9162.7872 -0.0027 0.002 ! 102: 6 1 6 0 8 5 1 5 0 7 10475.6677 0.0015 0.002 103: 6 1 6 0 7 5 1 5 0 6 10478.7787 -0.0002 0.002 104: 6 1 6 0 5 5 1 5 0 4 10479.2865 -0.0010 0.002 105: 6 1 6 0 6 5 1 5 0 5 10482.5773 0.0015 0.002 ! 106: 6 0 6 0 7 5 0 5 0 6 10824.0225 -0.0012 0.002 107: 6 0 6 0 8 5 0 5 0 7 10824.4402 -0.0006 0.002 108: 6 0 6 0 6 5 0 5 0 5 10829.2471 0.0014 0.002 109: 6 0 6 0 5 5 0 5 0 4 10829.6975 -0.0010 0.002 ! 110: 6 2 5 0 5 5 2 4 0 4 10919.7605 -0.0004 0.002 111: 6 2 5 0 8 5 2 4 0 7 10920.1435 -0.0004 0.002 112: 6 2 5 0 7 5 2 4 0 6 10933.0728 0.0018 0.002 113: 6 2 5 0 6 5 2 4 0 5 10933.3722 0.0003 0.002 ! 114: 6 2 4 0 5 5 2 3 0 4 11034.9807 0.0000 0.002 115: 6 2 4 0 8 5 2 3 0 7 11035.4120 0.0002 0.002 116: 6 2 4 0 7 5 2 3 0 6 11048.7226 0.0002 0.002 117: 6 2 4 0 6 5 2 3 0 5 11048.9666 -0.0001 0.002 ! 118: 6 1 5 0 8 5 1 4 0 7 11347.9234 0.0005 0.002 119: 6 1 5 0 7 5 1 4 0 6 11351.0258 -0.0032 0.002 120: 6 1 5 0 5 5 1 4 0 4 11351.8615 -0.0003 0.002 121: 6 1 5 0 6 5 1 4 0 5 11355.1280 -0.0007 0.002 ! 122: 7 1 7 0 9 6 1 6 0 8 12211.5450 -0.0008 0.002 123: 7 1 7 0 8 6 1 6 0 7 12213.4490 -0.0005 0.002 124: 7 1 7 0 6 6 1 6 0 5 12214.4019 -0.0007 0.002 125: 7 1 7 0 7 6 1 6 0 6 12216.4030 -0.0006 0.002 ! 126: 7 0 7 0 8 6 0 6 0 7 12581.2017 -0.0011 0.002 127: 7 0 7 0 9 6 0 6 0 8 12581.6535 -0.0009 0.002 128: 7 0 7 0 7 6 0 6 0 6 12584.9023 0.0021 0.002 129: 7 0 7 0 6 6 0 6 0 5 12585.3724 0.0015 0.002 ! ! Mirri+Caminati, CPL 12,127(1971) ! 130: 8 0 8 0 9 7 0 7 0 8 14319.3400 -0.0069 0.050 131: 8 0 8 0 10 7 0 7 0 9 14319.7600 -0.0636 0.050 132: 8 0 8 0 8 7 0 7 0 7 14322.1800 0.0183 0.050 133: 8 0 8 0 7 7 0 7 0 6 14322.5500 -0.0852 0.050 ! 134: 8 2 6 0 10 7 2 5 0 9 14812.1500 0.0488 0.050 135: 8 2 6 0 7 7 2 5 0 6 14813.1200 -0.0303 0.050 136: 8 2 6 0 9 7 2 5 0 8 14817.8500 -0.0368 0.050 137: 8 2 6 0 8 7 2 5 0 7 14819.1000 -0.0699 0.050 ! 138: 9 0 9 0 10 8 0 8 0 9 16038.7300 0.0067 0.050 139: 9 0 9 0 11 8 0 8 0 10 16039.1700 -0.0428 0.050 140: 9 0 9 0 9 8 0 8 0 8 16040.9500 0.0150 0.050 141: 9 0 9 0 8 8 0 8 0 7 16041.3300 -0.0708 0.050 ! 142: 9 2 7 0 11 8 2 6 0 10 16721.2300 -0.0330 0.050 143: 9 2 7 0 8 8 2 6 0 7 16722.3500 -0.0075 0.050 144: 9 2 7 0 10 8 2 6 0 9 16725.3900 -0.0336 0.050 145: 9 2 7 0 9 8 2 6 0 8 16726.6700 0.0020 0.050 ! 146: 10 0 10 0 11 9 0 9 0 10 17740.9200 0.0121 0.050 147: 10 0 10 0 12 9 0 9 0 11 17741.3800 -0.0238 0.050 148: 10 0 10 0 10 9 0 9 0 9 17742.7100 0.0047 0.050 149: 10 0 10 0 9 9 0 9 0 8 17743.1000 -0.0385 0.050 ! 150: 10 2 8 0 12 9 2 7 0 11 18642.1300 0.0000 0.050 151: 10 2 8 0 9 9 2 7 0 8 18643.1400 -0.0306 0.050 152: 10 2 8 0 11 9 2 7 0 10 18645.2100 -0.0255 0.050 153: 10 2 8 0 10 9 2 7 0 9 18646.3500 -0.0266 0.050 ! 154: 11 2 9 0 13 10 2 8 0 12 20571.3900 -0.0420 0.050 155: 11 2 9 0 10 10 2 8 0 9 20572.3700 -0.0183 0.050 156: 11 2 9 0 12 10 2 8 0 11 20573.7800 -0.0286 0.050 157: 11 2 9 0 11 10 2 8 0 10 20574.8200 -0.0148 0.050 ! 158: 12 2 10 0 14 11 2 9 0 13 22505.1800 0.0657 0.050 159: 12 2 10 0 11 11 2 9 0 10 22506.0900 0.1082 0.050 160: 12 2 10 0 13 11 2 9 0 12 22507.0200 0.0602 0.050 161: 12 2 10 0 12 11 2 9 0 11 22508.0200 0.1424 0.050 ! ! IFPAN MMW ! ! type-II bandheads ! 162:103 0103 1103 102 0102 1102 173558.7410 0.0124 0.050 163:102 1101 1102 101 1100 1101 173560.7283 0.0184 0.050 164:101 2 99 1101 100 2 98 1100 173566.4863 0.0055 0.050 165:100 3 97 1100 99 3 96 1 99 173580.1811 -0.0128 0.050 166: 99 4 95 1 99 98 4 94 1 98 173608.2688 -0.0025 0.050 167: 98 6 93 1 98 97 6 92 1 97 173661.1263 0.0546 0.050 -0.0247 0.50 168: 98 5 93 1 98 97 5 92 1 97 173661.1263 -0.1041 0.050 -0.0247 0.50 169: 97 6 91 1 97 96 6 90 1 96 173758.7023 0.0093 0.050 170: 97 7 91 1 97 96 7 90 1 96 173755.7491 -0.0059 0.050 171: 96 7 89 1 96 95 7 88 1 95 173953.0640 0.0134 0.050 172: 96 8 89 1 96 95 8 88 1 95 173913.6252 0.0151 0.050 ! 173:128 0128 1128 127 0127 1127 215421.9603 -0.0070 0.050 174:127 1126 1127 126 1125 1126 215423.3598 0.0034 0.050 175:126 2124 1126 125 2123 1125 215426.9061 -0.0051 0.050 176:125 3122 1125 124 3121 1124 215434.8930 -0.0009 0.050 177:124 4120 1124 123 4119 1123 215450.4596 0.0028 0.050 178:123 5118 1123 122 5117 1122 215478.1195 0.0152 0.050 179:122 7116 1122 121 7115 1121 215524.4965 0.0014 0.050 180:121 8114 1121 120 8113 1120 215599.9280 0.0187 0.050 -0.0244 0.50 181:121 7114 1121 120 7113 1120 215599.9280 -0.0676 0.050 -0.0244 0.50 182:120 9112 1120 119 9111 1119 215720.8261 -0.0057 0.050 183:120 8112 1120 119 8111 1119 215722.2737 0.0045 0.050 184:119 10110 1119 118 10109 1118 215911.4739 0.0822 0.050 185:118 10108 1118 117 10107 1117 216355.1155 0.0173 0.050 186:118 11108 1118 117 11107 1117 216176.8944 -0.0064 0.050 ! 187:129 0129 1129 128 0128 1128 217095.7346 -0.0192 0.050 188:128 1127 1128 127 1126 1127 217097.1141 -0.0121 0.050 189:127 2125 1127 126 2124 1126 217100.6190 -0.0015 0.050 190:126 3123 1126 125 3122 1125 217108.4543 0.0020 0.050 191:125 4121 1125 124 4120 1124 217123.7100 0.0112 0.050 192:124 5119 1124 123 5118 1123 217150.7486 0.0066 0.050 193:123 6117 1123 122 6116 1122 217196.0330 0.0001 0.050 194:122 7115 1122 121 7114 1121 217269.4861 -0.0444 0.050 -0.0112 0.50 195:122 8115 1122 121 8114 1121 217269.4861 0.0221 0.050 -0.0112 0.50 196:121 9113 1121 120 9112 1120 217386.8715 -0.0082 0.050 197:121 8113 1121 120 8112 1120 217388.0165 0.0119 0.050 198:119 10109 1119 118 10108 1118 217981.7595 0.0336 0.050 ! 199:130 0130 1130 129 0129 1129 218769.4817 0.0028 0.050 200:129 1128 1129 128 1127 1128 218770.8418 0.0068 0.050 201:128 2126 1128 127 2125 1127 218774.2925 0.0221 0.050 202:127 3124 1127 126 3123 1126 218781.9453 -0.0097 0.050 203:126 4122 1126 125 4121 1125 218796.9137 0.0192 0.050 204:125 5120 1125 124 5119 1124 218823.3515 -0.0010 0.050 205:124 6118 1124 123 6117 1123 218867.5806 0.0021 0.050 206:123 8116 1123 122 8115 1122 218939.1304 0.0231 0.050 -0.0024 0.50 207:123 7116 1123 122 7115 1122 218939.1304 -0.0280 0.050 -0.0024 0.50 208:122 9114 1122 121 9113 1121 219053.0935 -0.0614 0.050 209:122 8114 1122 121 8113 1121 219054.0340 0.0002 0.050 210:121 10112 1121 120 10111 1120 219232.8865 -0.0529 0.050 211:121 9112 1121 120 9111 1120 219244.7036 -0.0016 0.050 212:120 11110 1120 119 11109 1119 219493.6493 0.0236 0.050 ! ! High K-1 tails ! 213: 92 11 81 1 92 91 11 80 1 91 173654.0341 -0.0311 0.050 214: 94 10 85 1 94 93 10 84 1 93 173994.3105 0.0133 0.050 215: 94 14 81 1 94 93 14 80 1 93 173947.0156 -0.0105 0.050 216: 94 14 80 1 94 93 14 79 1 93 173969.8504 0.0029 0.050 217: 94 15 80 1 94 93 15 79 1 93 173565.6420 -0.0371 0.050 218: 94 15 79 1 94 93 15 78 1 93 173568.0769 0.0365 0.050 ! 219: 95 25 70 1 95 94 25 69 1 94 173943.8027 -0.0074 0.050 220: 95 26 69 1 95 94 26 68 1 94 173882.8268 -0.0116 0.050 221: 95 27 68 1 95 94 27 67 1 94 173828.4426 0.0453 0.050 222: 95 28 67 1 95 94 28 66 1 94 173779.5075 -0.0131 0.050 223: 95 29 66 1 95 94 29 65 1 94 173735.4128 -0.0031 0.050 224: 95 30 65 1 95 94 30 64 1 94 173695.4232 -0.0044 0.050 225: 95 31 64 1 95 94 31 63 1 94 173659.0275 0.0188 0.050 226: 95 32 63 1 95 94 32 62 1 94 173625.6925 -0.0071 0.050 227: 95 35 60 1 95 94 35 59 1 94 173540.8044 -0.0229 0.050 228: 95 36 59 1 95 94 36 58 1 94 173516.6241 0.0195 0.050 229: 95 37 58 1 95 94 37 57 1 94 173493.9750 -0.0621 0.050 230: 95 38 57 1 95 94 38 56 1 94 173472.9664 0.0233 0.050 231: 95 39 56 1 95 94 39 55 1 94 173453.1656 0.0020 0.050 232: 95 40 55 1 95 94 40 54 1 94 173434.5844 0.0246 0.050 ! 233:114 12102 1114 113 12101 1113 216111.8863 0.0195 0.050 234:115 12103 1115 114 12102 1114 217769.2702 0.0039 0.050 235:115 13102 1115 114 13101 1114 218347.1442 -0.0059 0.050 236:115 14101 1115 114 14100 1114 216144.5740 0.0338 0.050 ! 237:116 11105 1116 115 11104 1115 215981.9485 -0.0284 0.050 238:116 12104 1116 115 12103 1115 219386.2108 0.0101 0.050 239:116 13104 1116 115 13103 1115 215884.2904 0.0076 0.050 240:116 14102 1116 115 14101 1115 218309.5952 -0.0178 0.050 241:116 14103 1116 115 14102 1115 216199.0786 0.0084 0.050 242:116 15101 1116 115 15100 1115 216322.8585 0.0109 0.050 243:116 15102 1116 115 15101 1115 215819.8341 0.0056 0.050 244:116 16101 1116 115 16100 1115 215236.6318 -0.0191 0.050 245:116 16100 1116 115 16 99 1115 215317.9055 -0.0049 0.050 ! 246:117 11106 1117 116 11105 1116 217498.3243 0.0135 0.050 247:117 12106 1117 116 12105 1116 216350.5696 0.0184 0.050 248:117 13105 1117 116 13104 1116 217668.7753 -0.0540 0.050 249:117 14104 1117 116 14103 1116 218083.9427 0.0664 0.050 250:117 15102 1117 116 15101 1116 218363.0327 0.0725 0.050 251:117 15103 1117 116 15102 1116 217753.3265 -0.0155 0.050 252:117 16101 1117 116 16100 1116 217271.7322 -0.0519 0.050 253:117 16102 1117 116 16101 1116 217169.6556 -0.0153 0.050 254:117 17101 1117 116 17100 1116 216630.7045 0.0039 0.050 255:117 17100 1117 116 17 99 1116 216644.0504 -0.0156 0.050 256:117 18 99 1117 116 18 98 1116 216196.9209 0.0088 0.050 257:117 18100 1117 116 18 99 1116 216195.4672 0.0069 0.050 258:117 19 99 1117 116 19 98 1116 215846.4350 0.0548 0.050 -0.0125 0.50 259:117 19 98 1117 116 19 97 1116 215846.4350 -0.0798 0.050 -0.0125 0.50 260:117 20 97 1117 116 20 96 1116 215560.8632 -0.0294 0.050 261:117 21 96 1117 116 21 95 1116 215322.7920 -0.0092 0.050 262:117 22 95 1117 116 22 94 1116 215121.0834 -0.0338 0.050 ! 263:118 11107 1118 117 11106 1117 219025.3795 -0.0171 0.050 264:118 12107 1118 117 12106 1117 218039.6365 -0.0002 0.050 265:118 13106 1118 117 13105 1117 219441.5762 -0.0217 0.050 266:118 17101 1118 117 17100 1117 218567.7357 0.0803 0.050 267:118 17102 1118 117 17101 1117 218550.4421 -0.0151 0.050 268:118 18100 1118 117 18 99 1117 218102.0322 -0.0090 0.050 269:118 18101 1118 117 18100 1117 218100.1305 0.0022 0.050 270:118 19 99 1118 117 19 98 1117 217739.3177 -0.0837 0.050 0.0070 0.50 271:118 19100 1118 117 19 99 1117 217739.3177 0.0977 0.050 0.0070 0.50 272:118 20 99 1118 117 20 98 1117 217444.5605 0.0049 0.050 273:118 21 97 1118 117 21 96 1117 217199.1548 -0.0235 0.050 274:118 22 96 1118 117 22 95 1117 216991.5542 0.0236 0.050 275:118 23 95 1118 117 23 94 1117 216813.5322 0.0023 0.050 276:118 24 94 1118 117 24 93 1117 216659.2891 -0.0211 0.050 277:118 25 93 1118 117 25 92 1117 216524.4596 -0.0260 0.050 278:118 26 92 1118 117 26 91 1117 216405.7120 0.0169 0.050 279:118 27 91 1118 117 27 90 1117 216300.3325 0.0212 0.050 280:118 28 90 1118 117 28 89 1117 216206.2889 0.0423 0.050 281:118 30 88 1118 117 30 87 1117 216045.6195 -0.0366 0.050 282:118 33 85 1118 117 33 84 1117 215856.3742 0.0079 0.050 283:118 34 84 1118 117 34 83 1117 215803.6591 -0.0198 0.050 284:118 35 83 1118 117 35 82 1117 215755.1522 -0.0141 0.050 285:118 36 82 1118 117 36 81 1117 215710.3517 0.0073 0.050 286:118 41 77 1118 117 41 76 1117 215528.7895 -0.0346 0.050 287:118 42 76 1118 117 42 75 1117 215499.0503 -0.0467 0.050 288:118 43 75 1118 117 43 74 1117 215471.0346 -0.0324 0.050 289:118 44 74 1118 117 44 73 1117 215444.5969 0.0266 0.050 290:118 45 73 1118 117 45 72 1117 215419.4637 0.0021 0.050 291:118 46 72 1118 117 46 71 1117 215395.6066 -0.0051 0.050 292:118 47 71 1118 117 47 70 1117 215372.9047 -0.0004 0.050 293:118 48 70 1118 117 48 69 1117 215351.2576 0.0191 0.050 294:118 49 69 1118 117 49 68 1117 215330.5262 0.0073 0.050 295:118 50 68 1118 117 50 67 1117 215310.6891 0.0262 0.050 296:118 51 67 1118 117 51 66 1117 215291.5950 -0.0002 0.050 297:118 52 66 1118 117 52 65 1117 215273.2289 -0.0190 0.050 298:118 53 65 1118 117 53 64 1117 215255.5309 -0.0283 0.050 299:118 54 64 1118 117 54 63 1117 215238.4647 -0.0087 0.050 300:118 55 63 1118 117 55 62 1117 215221.9817 0.0422 0.050 301:118 56 62 1118 117 56 61 1117 215205.8837 -0.0273 0.050 302:118 58 60 1118 117 58 59 1117 215175.2167 0.0109 0.050 ! 303:119 20100 1119 118 20 99 1118 219329.4953 -0.0335 0.050 304:119 21 98 1119 118 21 97 1118 219076.6359 -0.0079 0.050 305:119 22 97 1119 118 22 96 1118 218862.8615 -0.0129 0.050 306:119 23 96 1119 118 23 95 1118 218679.7597 -0.0162 0.050 307:119 24 95 1119 118 24 94 1118 218521.2261 -0.0136 0.050 308:119 25 94 1119 118 25 93 1118 218382.6979 -0.0128 0.050 309:119 26 93 1119 118 26 92 1118 218260.7008 -0.0056 0.050 310:119 27 92 1119 118 27 91 1118 218152.5041 -0.0047 0.050 311:119 28 91 1119 118 28 90 1118 218055.9922 0.0310 0.050 312:119 30 89 1119 118 30 88 1118 217891.2695 0.0769 0.050 313:119 32 87 1119 118 32 86 1118 217755.9368 -0.0218 0.050 314:119 33 86 1119 118 33 85 1118 217697.0765 -0.0035 0.050 315:119 34 85 1119 118 34 84 1118 217643.0768 0.0049 0.050 316:119 37 82 1119 118 37 81 1118 217504.8366 -0.0214 0.050 317:119 38 81 1119 118 38 80 1118 217465.2836 -0.0025 0.050 318:119 40 79 1119 118 40 78 1118 217393.8742 -0.0067 0.050 319:119 43 76 1119 118 43 75 1118 217302.4347 0.0196 0.050 320:119 44 75 1119 118 44 74 1118 217275.2958 -0.0118 0.050 321:119 46 73 1119 118 46 72 1118 217225.2558 0.0180 0.050 322:119 48 71 1119 118 48 70 1118 217179.9075 0.0288 0.050 323:119 51 68 1119 118 51 67 1118 217118.9869 0.0386 0.050 324:119 53 66 1119 118 53 65 1118 217082.1796 0.0209 0.050 325:119 56 63 1119 118 56 62 1118 217031.4430 -0.0631 0.050 ! 326:120 10111 1120 119 10110 1119 217572.0042 -0.0084 0.050 327:120 9111 1120 119 9110 1119 217586.8080 0.0268 0.050 328:120 35 85 1120 119 35 84 1119 219431.8196 0.0304 0.050 329:120 36 84 1120 119 36 83 1119 219384.6430 -0.0914 0.050 330:120 37 83 1120 119 37 82 1119 219341.1263 -0.0071 0.050 331:120 39 81 1120 119 39 80 1119 219262.8035 -0.0204 0.050 332:120 40 80 1120 119 40 79 1119 219227.4914 -0.0071 0.050 333:120 41 79 1120 119 41 78 1119 219194.3859 0.0071 0.050 334:120 42 78 1120 119 42 77 1119 219163.2677 0.0241 0.050 335:120 43 77 1120 119 43 76 1119 219133.8918 -0.0063 0.050 336:120 45 75 1120 119 45 74 1119 219080.0061 0.0995 0.050 337:120 50 70 1120 119 50 69 1119 218966.2798 0.0202 0.050 338:120 51 69 1120 119 51 68 1119 218946.3820 0.0090 0.050 339:120 53 67 1120 119 53 66 1119 218908.7827 -0.0356 0.050 340:120 58 62 1120 119 58 61 1119 218825.2674 0.0336 0.050 341:120 59 61 1120 119 59 60 1119 218809.8798 -0.0353 0.050 -------------------------------------------------------------------------------- PARAMETERS IN FIT (values truncated and Nlines statistics): 10000 A /MHz 5667.735(14) 1 -10011 A /MHz 5667.735(14) = 1.00000 * 1 20000 B /MHz 984.709536(63) 2 -20011 B /MHz 984.709536(63) = 1.00000 * 2 30000 C /MHz 838.869263(56) 3 -30011 C /MHz 838.869263(56) = 1.00000 * 3 200 DJ /kHz 0.0295294(40) 4 -211 DJ /kHz 0.0295294(40) = 1.00000 * 4 1100 DJK /kHz 0.19196(17) 5 -1111 DJK /kHz 0.19196(17) = 1.00000 * 5 2000 DK /kHz 0.989(45) 6 -2011 DK /kHz 0.989(45) = 1.00000 * 6 40100 delJ /kHz 0.0048723(17) 7 -40111 delJ /kHz 0.0048723(17) = 1.00000 * 7 41000 delK /kHz 0.19828(47) 8 -41011 delK /kHz 0.19828(47) = 1.00000 * 8 300 HJ /Hz [ 0.] 9 -311 HJ /Hz [ 0.] = 1.00000 * 9 1200 HJK /Hz 0.0000123(67) 10 -1211 HJK /Hz 0.0000123(67) = 1.00000 * 10 2100 HKJ /Hz -0.000360(23) 11 -2111 HKJ /Hz -0.000360(23) = 1.00000 * 11 110010000 X.aa*3/2 /MHz 697.5707(39) 12 110040000 X(b-c)/4 /MHz -6.0596(25) 13 10010000 Maa /MHz 0.00184(88) 14 10020000 Mbb /MHz 0.00205(15) 15 -10030000 Mcc /MHz 0.00205(15) = 1.00000 * 15 MICROWAVE AVG = -0.000710 MHz, IR AVG = 0.00000 MICROWAVE RMS = 0.024533 MHz, IR RMS = 0.00000 END OF ITERATION 1 OLD, NEW RMS ERROR= 0.72330 0.72330 distinct frequency lines in fit: 335 distinct parameters of fit: 14 MICROWAVE lines fitted lines lines RMS RMS ERROR J range Ka range freq. range total dv=0 dv.ne.0 UNFITTD e>900 v"= 0 161 161 0 0 0 0.022090 0.87173 0 12 0 3 1710 22508 v"= 1 174 174 0 0 0 0.026549 0.53098 91 130 0 59 173435 219494 -------------------------------------------------------------------------------------------- total: 335 335 0 0 0 0.024507 0.71530 NOTE: the RMS values above are for Nlines statistics, but the 'total' values may differ slightly from those in the .FIT file since the o-c values for this evaluation are as rounded in the .FIT. PARAMETERS IN FIT WITH STANDARD ERRORS ON THOSE THAT ARE FITTED: (values rounded and degrees of freedom, Ndegf=Nlines-Nconst, statistics) 10000 A /MHz 5667.735(10) 1 -10011 A /MHz 5667.735(10) = 1.00000 * 1 20000 B /MHz 984.709536(46) 2 -20011 B /MHz 984.709536(46) = 1.00000 * 2 30000 C /MHz 838.869263(41) 3 -30011 C /MHz 838.869263(41) = 1.00000 * 3 200 DJ /kHz 0.0295294(29) 4 -211 DJ /kHz 0.0295294(29) = 1.00000 * 4 1100 DJK /kHz 0.19196(12) 5 -1111 DJK /kHz 0.19196(12) = 1.00000 * 5 2000 DK /kHz 0.989(33) 6 -2011 DK /kHz 0.989(33) = 1.00000 * 6 40100 delJ /kHz 0.0048723(12) 7 -40111 delJ /kHz 0.0048723(12) = 1.00000 * 7 41000 delK /kHz 0.19828(34) 8 -41011 delK /kHz 0.19828(34) = 1.00000 * 8 300 HJ /Hz [ 0.] 9 -311 HJ /Hz [ 0.] = 1.00000 * 9 1200 HJK /Hz 0.0000123(49) 10 -1211 HJK /Hz 0.0000123(49) = 1.00000 * 10 2100 HKJ /Hz -0.000361(17) 11 -2111 HKJ /Hz -0.000361(17) = 1.00000 * 11 110010000 X.aa*3/2 /MHz 697.5707(28) 12 110040000 X(b-c)/4 /MHz -6.0597(19) 13 10010000 Maa /MHz 0.00184(65) 14 10020000 Mbb /MHz 0.00206(11) 15 -10030000 Mcc /MHz 0.00206(11) = 1.00000 * 15 ------------------------------------------------------------------------------------------ Worst fitted constants, with greater than 20% uncertainty: % 1200 HJK /Hz 0.0000123(49) 10 40.2 -1211 HJK /Hz 0.0000123(49) = 1.00000 * 10 40.2 10010000 Maa /MHz 0.00184(65) 14 35.3 ------------------------------------------------------------------------------------------ CORRELATION COEFFICIENTS, C.ij: A B C -DJ -DJK -DK -delJ -delK A 1.0000 B 0.3666 1.0000 C -0.5483 -0.7916 1.0000 -DJ 0.7158 0.0408 -0.2926 1.0000 -DJK -0.0427 -0.0785 0.0120 -0.0246 1.0000 -DK -0.8258 -0.2206 0.3875 -0.3955 -0.0789 1.0000 -delJ 0.6432 -0.3108 0.1067 0.6558 0.0374 -0.5835 1.0000 -delK 0.2164 0.0079 -0.0504 0.7150 -0.0801 0.2771 0.2028 1.0000 HJK -0.0029 0.0759 -0.0020 -0.1223 -0.9254 0.0843 -0.1408 0.0062 HKJ -0.1210 -0.0496 0.0652 0.0535 0.0181 0.0944 0.0681 -0.0647 X.aa*3/2 0.0166 -0.0002 0.0124 0.0102 -0.0033 -0.0150 0.0196 0.0048 X(b-c)/4 -0.0094 0.0154 0.0237 -0.0171 -0.0052 0.0083 -0.0087 -0.0018 Maa 0.0714 -0.0845 -0.0806 0.0995 0.0155 -0.0647 0.0812 0.0175 Mbb 0.0012 0.0373 -0.1109 0.0071 0.0085 0.0065 -0.0475 -0.0063 HJK HKJ X.aa*3/2 X(b-c)/4 Maa Mbb HJK 1.0000 HKJ -0.3635 1.0000 X.aa*3/2 0.0022 -0.0022 1.0000 X(b-c)/4 0.0054 0.0007 0.3010 1.0000 Maa -0.0190 -0.0067 0.0147 -0.0938 1.0000 Mbb -0.0067 0.0005 -0.1882 -0.1326 0.5166 1.0000 Mean value of |C.ij|, i.ne.j = 0.1447 Mean value of C.ij, i.ne.j = -0.0096 No correlations with absolute value greater than 0.9950 Worst fitted lines (obs-calc/error): 161: 2.8 94: 2.6 61: 2.6 59: -2.6 66: -2.4 57: -2.4 97: 2.2 159: 2.2 64: -2.1 336: 2.0 69: -1.9 62: 1.9 329: -1.8 133: -1.7 88: 1.7 184: 1.6 266: 1.6 86: 1.6 119: -1.6 89: -1.5 312: 1.5 2: 1.4 250: 1.4 141: -1.4 73: 1.4 137: -1.4 101: -1.4 249: 1.3 158: 1.3 131: -1.3 325: -1.3 35: -1.2 229: -1.2 208: -1.2 160: 1.2 71: 1.1 248: -1.1 210: -1.1 100: -1.0 128: 1.0 252: -1.0 134: 1.0 37: 0.9 287: -0.9 221: 0.9 6: 0.9 79: -0.9 90: 0.9 112: 0.9 139: -0.9 161: 12 2 10 0 12 11 2 9 0 11 22508.0200 0.1424 0.050 94: 5 3 3 0 4 4 3 2 0 3 9091.6980 0.0053 0.002 61: 4 0 4 0 4 3 0 3 0 3 7270.2956 0.0053 0.002 59: 4 0 4 0 5 3 0 3 0 4 7257.2493 -0.0053 0.002 66: 4 1 3 0 4 3 1 2 0 3 7590.0989 -0.0049 0.002 57: 4 1 4 0 5 3 1 3 0 4 7000.6395 -0.0047 0.002 97: 5 3 3 0 6 4 3 2 0 5 9161.7765 0.0045 0.002 159: 12 2 10 0 11 11 2 9 0 10 22506.0900 0.1082 0.050 64: 4 1 3 0 3 3 1 2 0 2 7578.1496 -0.0041 0.002 336:120 45 75 1120 119 45 74 1119 219080.0061 0.0995 0.050 _____________________________________ __________________________________________/ SPFIT output reformatted with PIFORM