Deuterated bromoform, 3x81Br (atom in ac plane) Thu Aug 23 09:11:21 2018 -------------------------------------------------------------------------------------========= obs o-c error blends Notes o-c wt / instead of : below denotes (o-c)>3*err -------------------------------------------------------------------------------------========= 1: 1 0 3 3 6 0 0 2 3 5 2449.6398 0.0079 0.010 2: 1 0 1 3 4 0 0 2 3 5 2508.2378 -0.0088 0.010 -0.0130 0.76 3: 1 0 1 3 4 0 0 2 1 3 2508.2378 -0.0257 0.010 -0.0130 0.24 4: 1 0 3 2 3 0 0 2 2 2 2413.7544 0.0066 0.010 ! ! 5: 2 -1 3 2 3 1 1 3 0 3 4652.4593 -0.0094 0.010 6: 2 -1 3 2 5 1 1 3 2 5 4671.7414 -0.0098 0.010 7: 2 1 2 2 4 1 -1 2 2 4 4676.3332 0.0128 0.010 8: 2 -1 2 2 3 1 1 1 2 3 4697.2107 -0.0003 0.010 9: 2 -1 2 2 4 1 1 1 2 3 4700.7912 0.0036 0.010 10: 2 -1 4 2 2 1 1 3 2 2 4710.1995 0.0010 0.010 11: 2 0 3 1 3 1 0 3 1 3 4751.9241 -0.0062 0.010 12: 2 0 2 3 4 1 0 1 3 4 4761.2839 0.0153 0.010 13: 2 0 3 3 6 1 0 3 3 6 4770.4333 -0.0007 0.010 14: 2 0 2 1 3 1 0 1 1 2 4770.5968 0.0003 0.010 15: 2 0 2 1 1 1 0 1 1 1 4775.7226 -0.0001 0.010 16: 2 0 4 1 5 1 0 1 3 4 4779.3459 0.0016 0.010 17: 2 1 3 1 2 1 1 3 2 1 4790.2665 0.0090 0.010 18: 2 1 3 2 5 1 -1 2 2 4 4790.3749 0.0009 0.010 19: 2 1 4 0 4 1 1 2 3 3 4797.0224 0.0092 0.010 20: 2 0 2 3 4 1 0 3 1 3 4800.0995 -0.0069 0.010 21: 2 0 3 3 5 1 0 2 3 4 4801.4117 0.0271 0.010 22: 2 0 3 1 4 1 0 2 3 4 4803.4403 0.0081 0.010 23: 2 0 2 0 2 1 0 3 2 2 4804.9706 -0.0053 0.010 24: 2 -1 2 2 4 1 1 3 0 3 4806.1588 0.0006 0.010 25: 2 1 3 3 3 1 1 2 0 2 4808.9512 -0.0011 0.010 26: 2 1 3 0 3 1 -1 2 0 2 4811.0509 0.0022 0.010 27: 2 -1 3 2 5 1 1 2 2 4 4824.4929 0.0017 0.010 28: 2 0 4 1 4 1 0 1 3 4 4825.9273 0.0010 0.010 29: 2 0 3 1 4 1 0 2 1 3 4826.7680 -0.0060 0.010 30: 2 1 3 3 4 1 1 3 0 3 4832.1205 -0.0048 0.010 31: 2 1 4 2 5 1 -1 3 2 4 4834.4191 -0.0067 0.010 32: 2 1 4 2 5 1 -1 3 2 5 4835.0306 0.0133 0.010 33: 2 1 4 2 6 1 -1 3 2 5 4835.6737 0.0077 0.010 34: 2 0 1 1 2 1 0 1 1 2 4840.7272 0.0083 0.010 35: 2 0 4 2 4 1 0 3 2 3 4841.6229 -0.0001 0.010 36: 2 0 4 2 3 1 0 3 2 2 4843.3514 -0.0139 0.010 37: 2 -1 2 3 3 1 -1 3 2 2 4845.1711 0.0011 0.010 38: 2 0 1 1 1 1 0 1 1 2 4846.7355 0.0088 0.010 39: 2 0 1 3 3 1 0 1 3 4 4849.7471 -0.0022 0.010 40: 2 -1 4 2 3 1 1 1 2 3 4851.0734 -0.0005 0.010 41: 2 0 3 2 1 1 0 2 2 1 4851.9850 -0.0013 0.010 42: 2 0 4 3 7 1 0 3 3 6 4853.2867 0.0065 0.010 43: 2 0 3 3 5 1 0 2 3 5 4855.7500 0.0006 0.010 44: 2 -1 1 2 3 1 1 1 2 2 4857.5800 -0.0001 0.010 45: 2 1 3 2 4 1 1 3 1 3 4860.7563 0.0078 0.010 46: 2 0 4 1 4 1 0 3 1 3 4864.7625 -0.0016 0.010 47: 2 1 3 2 3 1 1 3 1 3 4869.2460 0.0046 0.010 48: 2 -1 4 2 6 1 1 3 2 5 4869.8126 -0.0025 0.010 49: 2 -1 1 1 1 1 1 1 1 2 4871.1283 -0.0227 0.010 50: 2 -1 4 2 5 1 1 3 2 5 4871.2531 0.0045 0.010 51: 2 0 2 3 4 1 0 2 3 4 4871.5202 0.0056 0.010 52: 2 -1 1 3 3 1 1 1 1 2 4872.7738 0.0069 0.010 53: 2 -1 4 2 5 1 1 3 2 4 4874.1874 -0.0029 0.010 54: 2 -1 1 2 2 1 1 1 2 3 4880.7175 -0.0043 0.010 55: 2 0 4 1 5 1 0 2 3 4 4889.6016 0.0113 0.010 56: 2 -1 2 2 3 1 1 2 0 2 4890.8160 -0.0027 0.010 57: 2 0 2 0 2 1 0 2 2 1 4891.9508 0.0110 0.010 58: 2 1 4 1 4 1 1 2 2 4 4892.8059 -0.0028 0.010 59: 2 0 2 3 4 1 0 2 1 3 4894.8458 -0.0106 0.010 60: 2 -1 4 2 2 1 1 3 2 1 4895.5738 0.0001 0.010 61: 2 -1 2 3 3 1 -1 1 2 3 4897.1618 0.0027 0.010 62: 2 0 2 1 3 1 0 2 1 3 4899.1489 -0.0073 0.010 63: 2 1 3 0 3 1 1 2 3 3 4917.5275 0.0049 0.010 64: 2 1 3 2 2 1 -1 3 2 1 4956.9658 -0.0049 0.010 65: 2 0 1 3 3 1 0 2 3 4 4960.0037 0.0083 0.010 66: 2 -1 2 2 3 1 -1 2 3 3 4975.3865 0.0006 0.010 67: 2 -1 2 2 4 1 -1 2 3 3 4978.9756 0.0132 0.010 68: 2 1 3 2 5 1 -1 3 2 5 4992.8227 -0.0088 0.010 69: 2 1 3 2 3 1 -1 3 2 4 4995.0008 -0.0083 0.010 70: 2 1 3 3 4 1 -1 2 3 3 5004.9345 0.0051 0.010 71: 2 1 4 3 1 1 1 3 2 1 5009.1358 0.0075 0.010 72: 2 1 2 2 4 1 -1 1 2 3 5029.5899 0.0054 0.010 ! ! 73: 3 1 4 2 6 2 -1 4 2 6 7062.7949 0.0019 0.010 74: 3 -1 5 1 4 2 1 3 3 4 7141.8230 0.0012 0.010 75: 3 3 4 3 3 2 1 2 0 2 7142.1780 -0.0085 0.010 76: 3 3 5 3 5 2 1 3 2 5 7173.2216 0.0037 0.010 77: 3 -2 4 0 4 2 2 3 0 3 7182.0317 -0.0122 0.010 78: 3 -2 2 0 2 2 2 3 2 2 7184.4348 0.0023 0.010 79: 3 2 4 3 4 2 2 3 0 3 7189.5101 -0.0023 0.010 80: 3 3 2 1 3 2 1 3 2 3 7190.8501 -0.0011 0.010 81: 3 0 4 2 3 2 2 3 2 2 7191.9830 -0.0004 0.010 82: 3 0 4 3 7 2 0 4 3 7 7193.0559 0.0080 0.010 83: 3 -1 2 2 2 2 1 1 0 1 7193.7497 0.0065 0.010 84: 3 -1 4 0 4 2 1 3 0 3 7194.2322 -0.0081 0.010 85: 3 -2 3 2 5 2 2 3 2 4 7196.4617 -0.0137 0.010 86: 3 -1 2 3 2 2 1 2 1 1 7197.5103 0.0295 0.010 0.0151 0.25 87: 3 2 5 3 5 2 2 3 2 4 7197.5103 0.0102 0.010 0.0151 0.75 88: 3 2 3 2 4 2 -2 3 2 4 7198.1051 -0.0015 0.010 89: 3 -2 4 1 5 2 -2 3 2 4 7199.4153 0.0031 0.010 90: 3 2 4 3 4 2 2 3 2 4 7201.6796 0.0085 0.010 91: 3 0 2 3 4 2 0 1 3 3 7202.7236 0.0098 0.010 0.0027 0.73 92: 3 2 3 3 2 2 2 3 2 1 7202.7236 -0.0168 0.010 0.0027 0.27 93: 3 2 4 2 5 2 -2 3 2 4 7204.1555 -0.0109 0.010 94: 3 1 4 2 4 2 1 4 1 4 7204.3427 -0.0117 0.010 95: 3 0 2 1 1 2 0 1 1 1 7206.7270 -0.0121 0.010 96: 3 2 5 0 5 2 -2 3 2 4 7207.7820 -0.0052 0.010 97: 3 0 3 3 4 2 0 2 1 3 7210.7472 -0.0012 0.010 98: 3 1 2 2 3 2 -1 1 2 2 7215.1890 0.0079 0.010 99: 3 -1 3 2 2 2 1 3 2 2 7215.4319 0.0000 0.010 100: 3 2 3 2 4 2 -2 3 2 5 7216.4097 0.0267 0.010 0.0065 0.22 101: 3 1 3 2 4 2 -1 2 2 4 7216.4097 0.0008 0.010 0.0065 0.78 102: 3 3 5 2 5 2 -1 4 2 5 7217.0950 0.0083 0.010 103: 3 0 3 3 5 2 0 4 1 5 7217.2005 0.0141 0.010 0.0037 0.77 104: 3 1 3 2 2 2 1 2 3 2 7217.2005 -0.0306 0.010 0.0037 0.23 105: 3 -1 5 0 5 2 1 4 2 5 7220.3876 -0.0064 0.010 106: 3 1 4 2 5 2 1 4 1 5 7221.6221 0.0005 0.010 107: 3 2 4 2 5 2 -2 3 2 5 7222.4343 -0.0084 0.010 108: 3 2 5 3 6 2 2 3 2 5 7224.0307 0.0150 0.010 0.0097 0.79 109: 3 2 5 3 5 2 2 3 2 5 7224.0307 -0.0099 0.010 0.0097 0.21 110: 3 -2 5 3 6 2 -2 3 2 5 7224.1368 0.0000 0.010 111: 3 -2 4 2 3 2 -2 4 1 3 7224.5885 0.0393 0.010 0.0146 0.50 112: 3 -2 5 2 6 2 2 3 2 5 7224.5885 -0.0102 0.010 0.0146 0.50 113: 3 0 2 2 2 2 0 1 2 3 7225.0343 0.0137 0.010 114: 3 0 4 1 4 2 0 2 3 3 7225.0342 -0.0046 0.010 115: 3 0 3 3 3 2 0 1 1 2 7225.1475 -0.0045 0.010 116: 3 -2 3 2 4 2 2 3 2 3 7226.0981 0.0268 0.010 117: 3 0 2 3 4 2 0 4 1 4 7226.5380 0.0010 0.010 118: 3 -2 4 3 5 2 0 3 3 6 7226.9079 -0.0083 0.010 119: 3 0 4 2 2 2 0 2 0 2 7227.1282 0.0133 0.010 0.0065 0.77 120: 3 2 4 3 1 2 -2 3 3 1 7227.1282 -0.0160 0.010 0.0065 0.23 121: 3 0 3 2 3 2 0 4 2 3 7231.4319 -0.0078 0.010 122: 3 -1 4 1 4 2 -1 4 2 3 7231.9412 -0.0056 0.010 123: 3 1 2 2 2 2 -1 1 2 2 7232.1865 0.0210 0.010 0.0034 0.25 124: 3 1 5 2 5 2 -1 4 2 4 7232.1865 -0.0026 0.010 0.0034 0.75 125: 3 1 3 0 3 2 -1 2 0 2 7232.8235 0.0139 0.010 126: 3 3 3 0 3 2 -1 4 2 2 7235.1777 -0.0061 0.010 127: 3 0 3 3 5 2 0 2 3 4 7235.2653 0.0032 0.010 128: 3 2 3 2 1 2 -2 2 2 1 7235.5880 0.0409 0.010 0.0021 0.15 129: 3 0 3 1 4 2 0 2 1 3 7235.5880 -0.0045 0.010 0.0021 0.85 130: 3 -2 2 0 2 2 2 2 2 1 7236.0089 -0.0063 0.010 131: 3 -1 5 3 3 2 1 4 3 2 7237.4546 -0.0099 0.010 132: 3 0 4 3 6 2 0 3 3 6 7237.5437 0.0037 0.010 133: 3 0 2 3 3 2 0 1 3 3 7237.7367 -0.0087 0.010 134: 3 0 3 1 2 2 0 2 1 1 7238.0040 -0.0034 0.010 -0.0064 0.95 135: 3 0 5 3 5 2 0 2 3 5 7238.0040 -0.0611 0.010 -0.0064 0.05 136: 3 -2 4 1 4 2 -2 4 2 4 7240.5328 0.0030 0.010 137: 3 1 2 2 1 2 -1 1 2 2 7241.2891 0.0055 0.010 138: 3 -2 2 2 2 2 -2 2 3 2 7242.4174 0.0100 0.010 139: 3 1 4 2 3 2 1 3 1 2 7242.6517 0.0042 0.010 -0.0027 0.78 140: 3 2 2 1 1 2 -2 2 1 1 7242.6517 -0.0274 0.010 -0.0027 0.22 141: 3 -1 5 0 5 2 1 4 0 4 7243.0867 -0.0020 0.010 -0.0038 0.91 142: 3 -2 3 2 1 2 2 2 2 1 7243.0867 -0.0220 0.010 -0.0038 0.09 143: 3 -2 5 2 5 2 2 4 2 4 7244.1525 0.0204 0.010 -0.0024 0.19 144: 3 -1 4 2 6 2 1 3 2 5 7244.1525 -0.0078 0.010 -0.0024 0.81 145: 3 -2 4 3 5 2 0 3 1 4 7245.5527 0.0035 0.010 146: 3 -1 3 2 1 2 1 2 2 1 7245.6781 0.0011 0.010 147: 3 -2 4 3 5 2 0 3 3 5 7247.5949 -0.0018 0.010 -0.0124 0.73 148: 3 2 3 2 5 2 2 4 3 4 7247.5949 -0.0413 0.010 -0.0124 0.27 149: 3 -1 5 1 4 2 1 3 3 3 7253.2214 -0.0103 0.010 -0.0152 0.76 150: 3 2 5 2 5 2 2 4 3 4 7253.2214 -0.0306 0.010 -0.0152 0.24 151: 3 0 2 1 2 2 0 1 1 1 7253.7866 -0.0102 0.010 152: 3 -2 3 2 5 2 2 2 2 4 7253.8858 -0.0052 0.010 153: 3 0 5 1 5 2 0 4 1 4 7254.4811 -0.0064 0.010 -0.0119 0.68 154: 3 -2 4 1 5 2 -2 2 2 4 7254.4811 -0.0232 0.010 -0.0119 0.32 155: 3 -1 3 2 4 2 1 3 0 3 7255.6309 -0.0032 0.010 156: 3 -1 2 2 3 2 1 4 2 2 7256.3925 -0.0082 0.010 -0.0081 0.94 157: 3 -2 2 2 3 2 2 2 2 4 7256.3925 -0.0047 0.010 -0.0081 0.06 158: 3 -1 4 2 3 2 1 3 2 2 7256.5206 -0.0112 0.010 159: 3 0 5 1 6 2 0 4 1 5 7256.9710 0.0032 0.010 160: 3 0 2 2 3 2 0 4 0 4 7257.0537 0.0205 0.010 161: 3 2 4 1 4 2 2 2 2 4 7257.2667 0.0180 0.010 -0.0034 0.13 162: 3 2 3 2 4 2 -2 2 2 3 7257.2667 -0.0065 0.010 -0.0034 0.87 163: 3 0 5 2 4 2 0 4 2 3 7257.3641 -0.0125 0.010 -0.0117 0.76 164: 3 0 5 3 3 2 0 4 3 3 7257.3641 -0.0090 0.010 -0.0117 0.24 165: 3 1 4 2 6 2 -1 3 2 5 7260.8483 -0.0085 0.010 166: 3 -2 5 3 4 2 2 2 3 3 7261.4477 0.0253 0.010 0.0059 0.07 167: 3 -1 4 2 4 2 1 3 2 3 7261.4477 0.0045 0.010 0.0059 0.93 168: 3 0 5 3 6 2 0 4 3 5 7262.2060 0.0116 0.010 0.0108 0.89 169: 3 -3 4 3 3 2 -1 2 2 3 7262.2060 0.0040 0.010 0.0108 0.11 170: 3 0 3 3 4 2 0 3 1 3 7263.2270 0.0027 0.010 171: 3 -3 4 1 5 2 1 3 3 4 7264.0457 -0.0171 0.010 0.0000 0.65 172: 3 0 2 3 2 2 0 1 3 3 7264.0457 0.0288 0.010 0.0000 0.26 173: 3 0 3 2 1 2 0 2 2 1 7264.0457 0.0417 0.010 0.0000 0.09 174: 3 -1 2 1 2 2 1 2 1 1 7265.6923 -0.0217 0.010 175: 3 -2 5 2 6 2 -2 2 3 5 7266.0960 0.0197 0.010 176: 3 0 4 2 2 2 0 3 2 1 7267.0727 0.0044 0.010 177: 3 1 4 2 4 2 -1 3 2 3 7268.9330 -0.0024 0.010 178: 3 -1 2 2 2 2 -1 2 3 3 7269.6261 0.0034 0.010 -0.0071 0.34 179: 3 0 5 2 5 2 -2 2 3 5 7269.6261 -0.0125 0.010 -0.0071 0.66 180: 3 -2 5 1 6 2 -2 4 2 5 7270.0505 0.0162 0.010 0.0040 0.27 181: 3 -2 5 2 7 2 -2 4 3 6 7270.0505 -0.0004 0.010 0.0040 0.73 182: 3 1 5 2 6 2 -1 4 2 5 7274.6651 -0.0008 0.010 183: 3 1 5 2 7 2 -1 4 2 6 7275.6716 0.0004 0.010 184: 3 0 4 3 7 2 0 3 3 6 7275.8873 -0.0067 0.010 185: 3 1 4 2 3 2 -1 3 2 3 7276.8097 0.0032 0.010 186: 3 0 2 3 4 2 0 2 1 3 7286.8993 0.0044 0.010 187: 3 3 5 3 5 2 1 2 2 4 7287.2607 -0.0107 0.010 188: 3 3 4 1 4 2 -1 2 3 3 7287.3262 -0.0067 0.010 189: 3 3 4 3 3 2 1 1 2 2 7287.9732 0.0085 0.010 190: 3 0 3 1 4 2 0 3 1 3 7288.0652 -0.0032 0.010 191: 3 0 2 3 4 2 0 2 3 4 7291.2073 0.0127 0.010 192: 3 3 3 2 2 2 1 3 1 2 7293.0829 0.0056 0.010 193: 3 1 3 3 2 2 1 1 0 1 7303.6505 -0.0086 0.010 194: 3 0 3 3 5 2 0 3 3 5 7305.3889 -0.0030 0.010 195: 3 -1 4 0 4 2 1 4 0 4 7314.7504 0.0006 0.010 196: 3 0 2 1 1 2 0 2 1 1 7316.2720 -0.0070 0.010 197: 3 -1 5 3 5 2 -1 3 2 5 7317.7129 -0.0002 0.010 -0.0106 0.40 198: 3 0 5 2 5 2 2 4 0 4 7317.7129 -0.0174 0.010 -0.0106 0.60 199: 3 -2 2 0 2 2 2 1 0 1 7335.5116 0.0112 0.010 200: 3 0 2 3 4 2 0 3 3 5 7361.3160 -0.0084 0.010 201: 3 -1 5 3 5 2 1 4 1 4 7249.3973 0.0018 0.010 -------------------------------------------------------------------------------- PARAMETERS IN FIT (values truncated and Nlines statistics): 10000 A /MHz 1209.60495(16) 1 -20000 B /MHz 1209.60495(16) = 1.00000 * 1 30000 C /MHz 618.127(34) 2 200 DJ /kHz [ 0.2359] 3 1100 DJK /kHz [-0.3928] 4 2000 DK /kHz [ 0.1784] 5 40100 d1 /kHz [ 0.] 6 50000 d2 /kHz [ 0.] 7 300 HJ /Hz [ 0.] 8 1200 HJJK /Hz [ 0.] 9 2100 HJKK /Hz [ 0.] 10 3000 HK /Hz [ 0.] 11 110030000 chi.cc*3/2 /MHz -291.4213(68) 12 -220030000 chi.cc*3 /MHz -291.4213(68) = 1.00000 * 12 -330030000 . /MHz -291.4213(68) = 1.00000 * 12 110040000 chi(b-a)/4 /MHz -178.7891(27) 13 -220040000 chi(a-b) /MHz 89.3945(13) = -0.50000 * 13 -330040000 . /MHz 89.3945(13) = -0.50000 * 13 -220610000 chi.ab /MHz -309.6718(48) = 1.73205 * 13 -330610000 . /MHz 309.6718(48) = -1.73205 * 13 110410000 chi.ac /MHz -215.101(23) 14 -220410000 chi.ac /MHz 107.550(11) = -0.50000 * 14 -330410000 . /MHz 107.550(11) = -0.50000 * 14 -220210000 chi.bc /MHz -186.283(20) = 0.86603 * 14 -330210000 . /MHz 186.283(20) = -0.86603 * 14 10010000 M.aa {+IMJ /MHz [ 0.] 15 -20010000 M.aa /MHz [ 0.] = 0.25000 * 15 -20020000 M.bb /MHz [ 0.] = 0.75000 * 15 -30010000 M.aa /MHz [ 0.] = 0.25000 * 15 -30020000 M.bb /MHz [ 0.] = 0.75000 * 15 10020000 M.bb {+IMJ /MHz 0.00226(57) 16 -20010000 M.aa /MHz 0.00169(42) = 0.75000 * 16 -20020000 M.bb /MHz 0.00056(14) = 0.25000 * 16 -30010000 M.aa /MHz 0.00169(42) = 0.75000 * 16 -30020000 M.bb /MHz 0.00056(14) = 0.25000 * 16 10030000 M.cc {+IMJ /MHz 0.0018(13) 17 -20030000 M.cc /MHz 0.0018(13) = 1.00000 * 17 -30030000 M.cc /MHz 0.0018(13) = 1.00000 * 17 MICROWAVE AVG = 0.000170 MHz, IR AVG = 0.00000 MICROWAVE RMS = 0.008266 MHz, IR RMS = 0.00000 END OF ITERATION 1 OLD, NEW RMS ERROR= 0.82661 0.82661 distinct frequency lines in fit: 174 distinct parameters of fit: 7 upper state lower state overall limits of quantum number 1: 1 3 0 2 0 3 limits of quantum number 2: -3 3 -2 2 -3 3 limits of quantum number 3: 1 5 1 4 1 5 limits of quantum number 4: 0 3 0 3 0 3 limits of quantum number 5: 1 7 1 7 1 7 frequency range: 2413 7361 PARAMETERS IN FIT WITH STANDARD ERRORS ON THOSE THAT ARE FITTED: (values rounded and degrees of freedom, Ndegf=Nlines-Nconst, statistics) 10000 A /MHz 1209.60495(13) 1 -20000 B /MHz 1209.60495(13) = 1.00000 * 1 30000 C /MHz 618.127(28) 2 200 DJ /kHz [ 0.2359] 3 1100 DJK /kHz [-0.3928] 4 2000 DK /kHz [ 0.1784] 5 40100 d1 /kHz [ 0.] 6 50000 d2 /kHz [ 0.] 7 300 HJ /Hz [ 0.] 8 1200 HJJK /Hz [ 0.] 9 2100 HJKK /Hz [ 0.] 10 3000 HK /Hz [ 0.] 11 110030000 chi.cc*3/2 /MHz -291.4213(57) 12 -220030000 chi.cc*3 /MHz -291.4213(57) = 1.00000 * 12 -330030000 . /MHz -291.4213(57) = 1.00000 * 12 110040000 chi(b-a)/4 /MHz -178.7891(23) 13 -220040000 chi(a-b) /MHz 89.3946(11) = -0.50000 * 13 -330040000 . /MHz 89.3946(11) = -0.50000 * 13 -220610000 chi.ab /MHz -309.6718(40) = 1.73205 * 13 -330610000 . /MHz 309.6718(40) = -1.73205 * 13 110410000 chi.ac /MHz -215.101(19) 14 -220410000 chi.ac /MHz 107.5506(99) = -0.50000 * 14 -330410000 . /MHz 107.5506(99) = -0.50000 * 14 -220210000 chi.bc /MHz -186.283(17) = 0.86603 * 14 -330210000 . /MHz 186.283(17) = -0.86603 * 14 10010000 M.aa {+IMJ /MHz [ 0.] 15 -20010000 M.aa /MHz [ 0.] = 0.25000 * 15 -20020000 M.bb /MHz [ 0.] = 0.75000 * 15 -30010000 M.aa /MHz [ 0.] = 0.25000 * 15 -30020000 M.bb /MHz [ 0.] = 0.75000 * 15 10020000 M.bb {+IMJ /MHz 0.00226(48) 16 -20010000 M.aa /MHz 0.00170(36) = 0.75000 * 16 -20020000 M.bb /MHz 0.00057(12) = 0.25000 * 16 -30010000 M.aa /MHz 0.00170(36) = 0.75000 * 16 -30020000 M.bb /MHz 0.00057(12) = 0.25000 * 16 10030000 M.cc {+IMJ /MHz 0.0019(11) 17 -20030000 M.cc /MHz 0.0019(11) = 1.00000 * 17 -30030000 M.cc /MHz 0.0019(11) = 1.00000 * 17 ------------------------------------------------------------------------------------------ Worst fitted constants, with greater than 20% uncertainty: % 10020000 M.bb {+IMJ /MHz 0.00226(48) 16 21.3 -20010000 M.aa /MHz 0.00170(36) = 0.75000 * 16 21.2 -20020000 M.bb /MHz 0.00057(12) = 0.25000 * 16 21.1 -30010000 M.aa /MHz 0.00170(36) = 0.75000 * 16 21.2 -30020000 M.bb /MHz 0.00057(12) = 0.25000 * 16 21.1 10030000 M.cc {+IMJ /MHz 0.0019(11) 17 58.2 -20030000 M.cc /MHz 0.0019(11) = 1.00000 * 17 58.2 -30030000 M.cc /MHz 0.0019(11) = 1.00000 * 17 58.2 ------------------------------------------------------------------------------------------ CORRELATION COEFFICIENTS, C.ij: A C chi.cc*3 chi(b-a) chi.ac M.bb {+I M.cc {+I A 1.0000 C -0.1627 1.0000 chi.cc*3/2 -0.2477 -0.0473 1.0000 chi(b-a)/4 -0.0032 0.0226 -0.0856 1.0000 chi.ac 0.1360 0.3805 -0.1201 0.1066 1.0000 M.bb {+IMJ 0.3386 0.1247 -0.1275 -0.0148 0.1070 1.0000 M.cc {+IMJ -0.0981 0.0005 0.0253 0.0197 -0.0040 -0.1002 1.0000 Mean value of |C.ij|, i.ne.j = 0.1082 Mean value of C.ij, i.ne.j = 0.0119 No correlations with absolute value greater than 0.9950 Worst fitted lines (obs-calc/error): 21: 2.7 116: 2.7 49: -2.3 174: -2.2 160: 2.0 175: 2.0 12: 1.5 149: -1.5 86: 1.5 111: 1.5 125: 1.4 36: -1.4 113: 1.4 85: -1.4 32: 1.3 67: 1.3 2: -1.3 7: 1.3 191: 1.3 147: -1.2 77: -1.2 95: -1.2 153: -1.2 163: -1.2 94: -1.2 55: 1.1 199: 1.1 158: -1.1 57: 1.1 93: -1.1 168: 1.1 187: -1.1 59: -1.1 197: -1.1 151: -1.0 138: 1.0 131: -1.0 6: -1.0 108: 1.0 5: -0.9 19: 0.9 17: 0.9 68: -0.9 38: 0.9 133: -0.9 193: -0.9 189: 0.9 75: -0.9 165: -0.9 90: 0.9 21: 2 0 3 3 5 1 0 2 3 4 4801.4117 0.0271 0.010 116: 3 -2 3 2 4 2 2 3 2 3 7226.0981 0.0268 0.010 49: 2 -1 1 1 1 1 1 1 1 2 4871.1283 -0.0227 0.010 174: 3 -1 2 1 2 2 1 2 1 1 7265.6923 -0.0217 0.010 160: 3 0 2 2 3 2 0 4 0 4 7257.0537 0.0205 0.010 175: 3 -2 5 2 6 2 -2 2 3 5 7266.0960 0.0197 0.010 12: 2 0 2 3 4 1 0 1 3 4 4761.2839 0.0153 0.010 149: 3 -1 5 1 4 2 1 3 3 3 7253.2214 -0.0103 0.010 -0.0152 0.76 86: 3 -1 2 3 2 2 1 2 1 1 7197.5103 0.0295 0.010 0.0151 0.25 111: 3 -2 4 2 3 2 -2 4 1 3 7224.5885 0.0393 0.010 0.0146 0.50 _____________________________________ __________________________________________/ SPFIT output reformatted with PIFORM