1,2-dichlorobenzene, d4 Sat Mar 21 23:46:13 2020 -------------------------------------------------------------------------------------========= obs o-c error blends Notes o-c wt / instead of : below denotes (o-c)>3*err -------------------------------------------------------------------------------------========= 1: 3 1 2 1 2 2 1 1 1 1 7191.5809 -0.0006 0.002 2: 3 1 2 3 5 2 1 1 3 4 7191.7267 0.0016 0.002 3: 3 1 2 2 4 2 1 1 2 3 7192.5977 0.0031 0.002 4: 3 1 2 2 5 2 1 1 2 4 7192.8332 0.0039 0.002 5: 3 1 2 3 3 2 1 1 3 3 7193.1086 0.0010 0.002 6: 3 1 2 1 4 2 1 1 1 3 7193.1708 0.0033 0.002 7: 3 1 2 3 6 2 1 1 3 5 7194.8094 -0.0037 0.002 8: 3 1 2 1 3 2 1 1 0 2 7195.1721 0.0027 0.002 ! 9: 4 1 4 0 4 3 1 3 0 3 7216.4758 0.0012 0.002 10: 4 1 4 1 3 3 1 3 1 2 7216.6831 -0.0031 0.002 11: 4 1 4 1 5 3 1 3 1 4 7217.1106 0.0013 0.002 12: 4 1 4 2 6 3 1 3 2 5 7217.5791 0.0024 0.002 13: 4 1 4 1 4 3 1 3 1 3 7218.5694 -0.0003 0.002 14: 4 1 4 2 4 3 1 3 2 3 7218.6450 0.0014 0.002 15: 4 1 4 3 7 3 1 3 3 6 7219.1131 0.0002 0.002 ! 16: 4 0 4 3 5 3 0 3 3 4 7271.3100 0.0009 0.002 17: 4 0 4 0 4 3 0 3 0 3 7271.5976 -0.0027 0.002 18: 4 0 4 1 3 3 0 3 1 2 7271.6909 -0.0008 0.002 19: 4 0 4 1 5 3 0 3 1 4 7271.7594 0.0003 0.002 20: 4 0 4 1 4 3 0 3 1 3 7272.8220 -0.0024 0.002 21: 4 2 2 0 4 3 2 1 0 3 7272.9906 -0.0036 0.002 labels 22: 4 0 4 3 6 3 0 3 3 5 7273.2361 0.0024 0.002 23: 4 0 4 3 7 3 0 3 3 6 7273.5694 -0.0031 0.002 ! 24: 3 2 1 3 4 2 2 0 3 3 7415.6318 0.0040 0.002 25: 3 2 1 1 4 2 2 0 2 3 7425.8141 -0.0017 0.002 ! 26: 4 2 3 3 5 3 2 2 1 4 8521.3932 0.0027 0.002 27: 4 2 3 2 4 3 2 2 0 3 8522.1514 -0.0032 0.002 28: 4 2 3 2 4 3 2 2 2 3 8522.1813 -0.0017 0.002 29: 4 2 3 1 3 3 2 2 1 2 8523.4084 -0.0009 0.002 30: 4 2 3 3 4 3 2 2 3 4 8523.5164 -0.0017 0.002 31: 4 2 3 3 6 3 2 2 3 5 8524.0836 -0.0022 0.002 32: 4 2 3 3 6 3 2 2 3 6 8524.1370 -0.0004 0.002 33: 4 2 3 2 5 3 2 2 2 4 8526.3288 -0.0027 0.002 34: 4 2 3 2 6 3 2 2 2 5 8526.4621 -0.0007 0.002 35: 4 2 3 1 5 3 2 2 3 4 8526.9003 -0.0020 0.002 36: 4 2 3 3 7 3 2 2 3 6 8529.4438 -0.0015 0.002 37: 4 2 3 3 2 3 2 2 3 2 8529.9819 0.0009 0.002 38: 4 2 3 3 2 3 2 2 3 1 8530.0111 0.0029 0.002 39: 4 2 3 0 4 3 2 2 1 3 8530.5683 -0.0008 0.002 ! 40: 5 1 5 3 3 4 1 4 3 2 8843.5370 0.0006 0.002 41: 5 1 5 3 5 4 1 4 3 4 8843.5968 0.0031 0.002 42: 5 1 5 3 4 4 1 4 3 3 8843.9962 -0.0017 0.002 43: 5 1 5 1 4 4 1 4 1 3 8844.5283 -0.0007 0.002 44: 5 1 5 3 6 4 1 4 3 5 8844.6833 -0.0006 0.002 45: 5 1 5 1 6 4 1 4 1 5 8845.0843 -0.0007 0.002 46: 5 1 5 3 2 4 1 4 3 1 8845.1567 -0.0030 0.002 47: 5 1 5 2 6 4 1 4 2 5 8845.3621 0.0015 0.002 48: 5 1 5 1 5 4 1 4 1 4 8845.9869 -0.0019 0.002 49: 5 3 3 0 5 4 1 4 2 4 8846.0270 0.0000 0.002 50: 5 1 5 3 7 4 1 4 3 6 8846.0431 -0.0033 0.002 51: 5 1 5 3 8 4 1 4 3 7 8846.4403 0.0007 0.002 ! 52: 5 0 5 3 3 4 0 4 3 2 8857.8904 -0.0002 0.002 53: 5 0 5 3 5 4 0 4 3 4 8858.0588 0.0020 0.002 54: 5 0 5 3 4 4 0 4 3 3 8858.3791 -0.0026 0.002 55: 5 0 5 1 4 4 0 4 1 3 8858.9996 -0.0009 0.002 56: 5 0 5 3 6 4 0 4 3 5 8859.1967 -0.0007 0.002 57: 5 0 5 1 6 4 0 4 1 5 8859.4868 -0.0013 0.002 58: 5 0 5 2 6 4 0 4 2 5 8859.7810 0.0007 0.002 59: 5 0 5 1 5 4 0 4 1 4 8860.3191 -0.0019 0.002 60: 5 2 3 0 5 4 2 2 0 4 8860.3753 -0.0016 0.002 labels 61: 5 0 5 3 7 4 0 4 3 6 8860.5034 -0.0012 0.002 62: 5 0 5 3 8 4 0 4 3 7 8860.7991 0.0006 0.002 ! 63: 4 1 3 3 4 3 1 2 3 3 9060.8489 -0.0006 0.002 64: 4 1 3 3 5 3 1 2 3 4 9061.2259 -0.0005 0.002 65: 4 1 3 2 4 3 1 2 2 3 9061.5418 -0.0008 0.002 66: 4 1 3 1 3 3 1 2 1 2 9061.8788 -0.0003 0.002 67: 4 1 3 1 5 3 1 2 1 4 9062.4489 -0.0007 0.002 68: 4 1 3 2 6 3 1 2 2 5 9062.5126 -0.0006 0.002 69: 4 1 3 2 5 3 1 2 2 4 9062.6405 -0.0011 0.002 70: 4 1 3 3 6 3 1 2 3 5 9062.7012 -0.0013 0.002 71: 4 1 3 1 4 3 1 2 1 3 9063.4802 -0.0006 0.002 72: 4 1 3 3 7 3 1 2 3 6 9063.7481 0.0000 0.002 73: 4 1 3 0 4 3 1 2 0 3 9063.9436 -0.0008 0.002 ! 74: 4 3 2 3 5 3 3 1 3 4 9128.6890 0.0025 0.002 75: 4 3 2 0 4 3 3 1 2 3 9130.2427 -0.0014 0.002 76: 4 3 2 3 6 3 3 1 3 5 9133.0285 -0.0017 0.002 77: 4 3 2 2 3 3 3 1 2 2 9139.4433 0.0018 0.002 78: 4 3 2 2 5 3 3 1 2 4 9139.5094 -0.0017 0.002 79: 4 3 2 2 2 3 3 1 2 1 9139.6301 0.0012 0.002 80: 4 3 2 2 6 3 3 1 2 5 9139.7941 -0.0031 0.002 81: 4 3 2 1 5 3 3 1 1 4 9141.4243 -0.0001 0.002 82: 4 3 2 3 7 3 3 1 3 6 9145.5009 -0.0026 0.002 83: 4 3 2 1 4 3 3 1 1 3 9149.6843 -0.0003 0.002 ! 84: 4 3 1 3 5 3 3 0 3 4 9606.3086 0.0022 0.002 85: 4 3 1 2 4 3 3 0 2 3 9607.8800 -0.0023 0.002 86: 4 3 1 3 6 3 3 0 3 5 9610.7300 -0.0017 0.002 87: 4 3 1 2 3 3 3 0 2 2 9617.2115 0.0027 0.002 88: 4 3 1 1 5 3 3 0 1 4 9618.9654 0.0000 0.002 89: 4 3 1 3 7 3 3 0 3 6 9623.1937 -0.0026 0.002 90: 4 3 1 1 4 3 3 0 0 3 9626.2351 -0.0009 0.002 91: 4 3 1 0 4 3 3 0 1 3 9627.4681 0.0000 0.002 ! 92: 4 2 2 3 5 3 2 1 3 4 9981.0279 0.0001 0.002 93: 4 0 4 2 4 3 2 1 2 3 9981.3639 0.0005 0.002 labels 94: 4 2 2 3 6 3 2 1 3 5 9982.0649 0.0007 0.002 95: 4 0 4 2 4 3 2 1 3 3 9982.1814 0.0002 0.002 labels 96: 4 2 2 3 4 3 2 1 3 4 9982.2536 -0.0024 0.002 97: 4 2 2 3 4 3 2 1 2 3 9982.3464 -0.0009 0.002 98: 4 2 2 1 3 3 2 1 2 2 9982.9144 0.0008 0.002 99: 4 2 2 3 4 3 2 1 3 3 9983.1651 0.0000 0.002 100: 4 2 2 3 6 3 2 1 2 5 9983.7168 -0.0004 0.002 101: 4 2 2 3 6 3 2 1 3 6 9983.9649 -0.0017 0.002 102: 4 2 2 2 6 3 2 1 3 5 9984.5803 0.0012 0.002 103: 4 2 2 1 5 3 2 1 3 5 9984.8093 0.0000 0.002 104: 4 2 2 2 5 3 2 1 1 4 9985.0053 -0.0007 0.002 105: 4 2 2 3 3 3 2 1 3 2 9985.5523 0.0016 0.002 106: 4 2 2 1 5 3 2 1 2 4 9985.6865 0.0011 0.002 107: 4 2 2 3 2 3 2 1 2 2 9987.1296 0.0014 0.002 108: 4 2 2 3 2 3 2 1 2 1 9987.2873 0.0013 0.002 109: 4 2 2 3 7 3 2 1 3 6 9987.4561 -0.0014 9.002 110: 4 2 2 1 4 3 0 3 2 3 9988.5905 0.0019 0.002 labels 111: 4 2 2 2 4 3 2 1 1 3 9988.6531 -0.0001 0.002 ! 112: 5 2 4 3 6 4 2 3 3 5 10332.4630 0.0001 0.002 113: 5 2 4 0 5 4 2 3 2 4 10332.8193 0.0024 0.002 114: 5 2 4 3 5 4 2 3 3 4 10332.8316 -0.0007 0.002 115: 5 2 4 1 4 4 2 3 1 3 10333.2814 -0.0009 0.002 116: 5 2 4 3 7 4 2 3 3 6 10334.3274 0.0001 0.002 117: 5 2 4 3 5 4 2 3 3 5 10334.8913 0.0029 0.002 118: 5 2 4 3 4 4 2 3 3 3 10334.9087 0.0001 0.002 119: 5 2 4 2 6 4 2 3 2 5 10334.9818 -0.0008 0.002 120: 5 2 4 2 7 4 2 3 2 6 10335.0349 0.0010 0.002 121: 5 2 4 1 6 4 2 3 1 5 10335.0941 0.0002 0.002 122: 5 2 4 3 8 4 2 3 3 7 10336.8846 0.0011 0.002 123: 5 2 4 1 5 4 2 3 1 4 10337.1829 -0.0006 0.002 124: 5 4 2 0 5 4 2 3 0 4 10337.2080 -0.0014 0.002 labels 125: 5 2 4 3 2 4 2 3 3 1 10337.5160 0.0001 0.002 ! 126: 6 1 6 3 4 5 1 5 3 3 10457.9283 -0.0009 0.002 127: 6 1 6 3 6 5 1 5 3 5 10458.0635 -0.0003 0.002 128: 6 1 6 3 5 5 1 5 3 4 10458.4648 0.0026 0.002 129: 6 1 6 0 6 5 1 5 0 5 10458.7452 0.0011 0.002 130: 6 1 6 3 7 5 1 5 3 6 10458.8342 -0.0003 0.002 131: 6 1 6 1 7 5 1 5 1 6 10459.0273 0.0013 0.002 132: 6 1 6 3 3 5 1 5 3 2 10459.0656 -0.0003 0.002 133: 6 1 6 2 5 5 1 5 2 4 10459.2080 -0.0007 0.002 134: 6 1 6 1 6 5 1 5 1 5 10459.6582 0.0005 0.002 135: 6 1 6 2 6 5 3 3 0 5 10459.6802 0.0004 0.002 labels 136: 6 1 6 3 8 5 1 5 3 7 10459.8015 -0.0004 0.002 137: 6 1 6 3 9 5 1 5 3 8 10460.0191 0.0028 0.002 ! 138: 6 0 6 3 4 5 0 5 3 3 10461.2775 -0.0013 0.002 139: 6 0 6 3 6 5 0 5 3 5 10461.4331 -0.0009 0.002 140: 6 0 6 3 5 5 0 5 3 4 10461.8189 0.0006 0.002 141: 6 0 6 1 5 5 0 5 1 4 10461.8405 0.0008 0.002 142: 6 0 6 0 6 5 0 5 0 5 10462.1213 0.0011 0.002 143: 6 0 6 3 7 5 0 5 3 6 10462.2150 -0.0006 0.002 144: 6 0 6 1 7 5 0 5 1 6 10462.3842 0.0015 0.002 145: 6 0 6 3 3 5 0 5 3 2 10462.4145 -0.0016 0.002 146: 6 0 6 2 5 5 0 5 2 4 10462.5710 -0.0016 0.002 147: 6 0 6 1 6 5 0 5 1 5 10463.0063 0.0018 0.002 148: 6 2 4 0 6 5 2 3 0 5 10463.0309 0.0008 0.002 labels 149: 6 0 6 3 9 5 0 5 3 8 10463.3670 0.0028 0.002 ! 150: 5 1 4 3 5 4 1 3 3 4 10625.6307 -0.0008 0.002 151: 5 1 4 3 6 4 1 3 3 5 10625.8685 -0.0001 0.002 152: 5 1 4 2 5 4 1 3 2 4 10626.0408 -0.0004 0.002 153: 5 1 4 1 4 4 1 3 1 3 10626.1555 0.0009 0.002 154: 5 1 4 3 4 4 1 3 3 3 10626.3576 0.0001 0.002 155: 5 1 4 3 3 4 1 3 3 2 10626.5516 0.0002 0.002 156: 5 1 4 1 6 4 1 3 1 5 10626.8608 0.0006 0.002 157: 5 1 4 2 7 4 1 3 2 6 10626.9427 0.0024 0.002 158: 5 1 4 2 3 4 1 3 2 2 10627.0579 -0.0003 0.002 159: 5 1 4 2 6 4 1 3 2 5 10627.1463 0.0003 0.002 160: 5 1 4 3 7 4 1 3 3 6 10627.1693 -0.0001 0.002 161: 5 1 4 3 2 4 1 3 3 1 10627.7346 0.0001 0.002 162: 5 1 4 1 5 4 1 3 1 4 10627.8621 -0.0005 0.002 163: 5 1 4 3 8 4 1 3 3 7 10628.0775 0.0004 0.002 164: 5 1 4 0 5 4 1 3 0 4 10628.1146 0.0000 0.002 165: 5 1 4 3 5 4 1 3 3 5 10628.5260 -0.0011 0.002 ! 166: 5 3 3 3 6 4 3 2 3 5 11302.1632 0.0005 0.002 167: 5 1 5 2 5 4 3 2 0 4 11302.9511 -0.0023 0.002 labels 168: 5 3 3 1 4 4 3 2 1 3 11304.2718 0.0005 0.002 169: 5 3 3 3 5 4 3 2 3 4 11304.3423 -0.0008 0.002 170: 5 3 3 3 4 4 3 2 3 4 11304.4976 -0.0024 0.002 171: 5 3 3 3 6 4 3 2 3 6 11304.7262 -0.0013 0.002 172: 5 3 3 3 7 4 3 2 3 6 11304.9307 -0.0006 0.002 173: 5 3 3 3 7 4 3 2 2 6 11307.1063 -0.0018 0.002 174: 5 3 3 3 4 4 3 2 2 3 11307.1958 -0.0018 0.002 175: 5 3 3 2 6 4 3 2 2 5 11307.2968 -0.0021 0.002 176: 5 3 3 2 3 4 3 2 2 2 11307.3940 0.0011 0.002 177: 5 3 3 2 7 4 3 2 2 6 11307.7201 -0.0011 0.002 178: 5 3 3 1 6 4 3 2 1 5 11308.1443 -0.0014 0.002 179: 5 3 3 3 8 4 3 2 3 7 11310.7790 0.0025 0.002 180: 5 3 3 3 3 4 3 2 3 2 11311.3576 0.0025 0.002 181: 5 3 3 3 2 4 3 2 3 2 11311.6168 -0.0002 0.002 182: 5 3 3 1 5 4 3 2 2 4 11311.9289 -0.0020 0.002 183: 5 3 3 2 5 4 3 2 1 4 11312.1978 -0.002 UNFITTD 11312.2005 ! 184: 6 2 5 3 6 5 2 4 3 5 12032.0318 0.0001 0.002 185: 6 2 5 3 7 5 2 4 3 6 12032.0577 -0.0017 0.002 186: 6 2 5 2 6 5 2 4 0 5 12032.2075 -0.0010 0.002 187: 6 2 5 1 5 5 2 4 1 4 12032.3321 -0.0015 0.002 188: 6 2 5 3 8 5 2 4 3 7 12033.4499 -0.0002 0.002 189: 6 2 5 1 7 5 2 4 1 6 12033.5497 0.0004 0.002 190: 6 2 5 2 8 5 2 4 2 7 12033.5724 -0.0012 0.002 191: 6 2 5 3 9 5 2 4 3 8 12034.8843 -0.0004 0.002 192: 6 2 5 1 6 5 2 4 1 5 12034.9495 -0.0003 0.002 193: 6 2 5 3 3 5 2 4 3 2 12034.9744 -0.0010 0.002 ! 194: 7 1 7 3 5 6 1 6 3 4 12068.3167 -0.0004 0.002 195: 7 1 7 3 7 6 1 6 3 6 12068.4640 -0.0008 0.002 196: 7 1 7 1 6 6 1 6 1 5 12068.6320 0.0008 0.002 197: 7 1 7 3 6 6 1 6 3 5 12068.8171 -0.0010 0.002 198: 7 1 7 0 7 6 1 6 0 6 12068.9121 0.0023 0.002 199: 7 1 7 3 8 6 1 6 3 7 12069.0333 0.0001 0.002 200: 7 0 7 3 5 6 0 6 3 4 12069.0448 0.0010 0.002 201: 7 1 7 1 8 6 1 6 1 7 12069.1369 0.0027 0.002 202: 7 0 7 3 7 6 0 6 3 6 12069.1961 0.0009 0.002 203: 7 2 5 1 6 6 0 6 1 5 12069.3630 0.0017 0.002 204: 7 0 7 3 6 6 0 6 3 5 12069.5447 -0.0008 0.002 205: 7 0 7 0 7 6 0 6 0 6 12069.6424 0.0012 0.002 206: 7 0 7 1 8 6 0 6 1 7 12069.8637 0.0020 0.002 207: 7 1 7 3 10 6 1 6 3 9 12069.8963 0.0032 0.002 208: 7 0 7 2 9 6 0 6 2 8 12069.9944 0.0002 0.002 209: 7 2 5 0 7 6 2 4 0 6 12070.3431 -0.0018 0.002 labels 210: 7 0 7 3 9 6 0 6 3 8 12070.4890 0.0014 0.002 211: 7 0 7 3 10 6 0 6 3 9 12070.6218 0.0028 0.002 ! 212: 6 1 5 3 6 5 1 4 3 5 12141.3258 -0.0006 0.002 213: 6 1 5 3 7 5 1 4 3 6 12141.6188 -0.0011 0.002 214: 6 1 5 0 6 5 1 4 2 5 12141.6475 -0.0004 0.002 215: 6 1 5 3 5 5 1 4 3 4 12142.2294 -0.0006 0.002 216: 6 1 5 3 4 5 1 4 3 3 12142.3045 -0.0011 0.002 217: 6 1 5 1 7 5 1 4 1 6 12142.4529 0.0012 0.002 218: 6 1 5 2 4 5 1 4 2 3 12142.7236 0.0015 0.002 219: 6 1 5 2 5 5 1 4 2 4 12142.7393 -0.0043 0.002 220: 6 1 5 3 9 5 1 4 3 8 12143.5936 -0.0014 0.002 221: 6 1 5 3 3 5 1 4 3 2 12143.6635 -0.0023 0.002 222: 6 3 3 0 6 5 1 4 0 5 12143.7235 -0.0009 0.002 223: 6 1 5 3 6 5 1 4 3 6 12143.9853 0.0003 0.002 ! 224: 5 2 3 3 6 4 2 2 3 5 12226.1262 -0.0008 0.002 225: 5 2 3 3 5 4 2 2 3 4 12226.3614 0.0006 0.002 226: 5 0 5 2 5 4 0 4 2 4 12226.4166 -0.0004 0.002 labels 227: 5 2 3 1 4 4 2 2 1 3 12226.8264 0.0001 0.002 228: 5 2 3 3 7 4 2 2 3 6 12227.4256 0.0002 0.002 229: 5 2 3 2 7 4 2 2 2 6 12227.6273 0.0004 0.002 230: 5 2 3 2 6 4 2 2 2 5 12227.7072 -0.0006 0.002 231: 7 0 7 1 6 4 2 2 1 5 12227.8006 0.0000 0.002 labels 232: 5 2 3 2 3 4 2 2 2 2 12227.8240 -0.0026 0.002 233: 5 2 3 3 8 4 2 2 3 7 12228.9183 0.0007 0.002 234: 5 2 3 2 5 4 2 2 2 4 12229.0360 0.0002 0.002 235: 5 2 3 1 5 4 2 2 1 4 12229.2214 -0.0002 0.002 ! 236: 5 3 2 3 6 4 3 1 3 5 12416.9624 0.0001 0.002 237: 5 3 2 3 7 4 3 1 3 6 12418.7765 0.0013 0.002 238: 5 3 2 1 4 4 3 1 1 3 12418.9350 -0.0006 0.002 239: 5 3 2 1 6 4 3 1 1 5 12421.6251 0.0037 0.002 240: 5 3 2 2 6 4 3 1 2 5 12422.5653 0.0004 0.002 241: 5 3 2 3 8 4 3 1 3 7 12424.9539 -0.0011 0.002 ! 242: 6 3 4 3 7 5 3 3 3 6 13308.4874 -0.0005 0.002 243: 6 3 4 3 6 5 3 3 3 5 13309.2108 -0.0012 0.002 244: 6 3 4 1 5 5 3 3 1 4 13309.4894 0.0005 0.002 245: 6 3 4 3 8 5 3 3 3 7 13310.5030 0.0024 0.002 246: 6 3 4 2 7 5 3 3 2 6 13311.3408 -0.0017 0.002 247: 6 3 4 2 8 5 3 3 2 7 13311.3823 -0.0005 0.002 248: 6 3 4 2 4 5 3 3 2 3 13311.4646 -0.0025 0.002 249: 6 3 4 1 7 5 3 3 1 6 13311.6224 -0.0006 0.002 250: 6 3 4 3 5 5 3 3 2 4 13311.7623 -0.0009 0.002 251: 6 3 4 3 9 5 3 3 3 8 13313.4537 0.0011 0.002 252: 6 3 4 0 6 5 3 3 2 5 13313.9767 -0.0016 0.002 ! 253: 7 2 6 3 7 6 2 5 3 6 13672.4198 -0.0007 0.002 254: 7 2 6 3 8 6 2 5 3 7 13672.5395 -0.0016 0.002 255: 7 2 6 0 7 6 2 5 2 6 13672.5899 -0.0033 0.002 256: 7 2 6 3 6 6 2 5 3 5 13673.3741 -0.0041 0.002 257: 7 2 6 3 5 6 2 5 3 4 13673.3867 -0.0040 0.002 258: 7 2 6 1 8 6 2 5 1 7 13673.5501 0.0030 0.002 259: 7 2 6 2 9 6 2 5 2 8 13673.5936 0.0004 0.002 260: 7 2 6 1 7 6 2 5 1 6 13674.5598 -0.0034 0.002 ! 261: 8 1 8 3 6 7 1 7 3 5 13677.7392 -0.0015 0.002 262: 8 0 8 3 8 7 0 7 3 7 13678.0339 0.0001 0.002 263: 8 1 8 1 9 7 1 7 1 8 13678.3764 0.0024 0.002 264: 8 0 8 1 9 7 0 7 1 8 13678.5239 -0.0003 0.002 265: 8 0 8 2 10 7 0 7 2 9 13678.6209 0.0010 0.002 266: 8 1 8 1 8 7 1 7 1 7 13678.7408 0.0029 0.002 267: 8 0 8 1 8 7 0 7 1 7 13678.8885 0.0005 0.002 268: 8 1 8 3 11 7 1 7 3 10 13678.9763 0.0016 0.002 269: 8 0 8 3 10 7 0 7 3 9 13679.0389 0.0030 0.002 270: 8 0 8 3 11 7 0 7 3 10 13679.1264 0.0017 0.002 ! 271: 7 1 6 3 9 6 1 5 3 8 13706.1558 0.0019 0.002 272: 7 1 6 3 4 6 1 5 3 3 13706.7258 -0.0023 0.002 273: 7 1 6 1 7 6 1 5 1 6 13706.9014 0.0004 0.002 274: 7 1 6 0 7 6 3 3 0 6 13706.9466 0.0001 0.002 labels 275: 7 1 6 3 10 6 1 5 3 9 13707.0347 0.0008 0.002 ! 276: 6 2 4 3 6 5 2 3 3 5 14045.7861 0.0025 0.002 277: 6 2 4 3 7 5 2 3 3 6 14045.9381 0.0018 0.002 278: 6 2 4 1 5 5 2 3 1 4 14046.0207 0.0017 0.002 279: 6 2 4 3 5 5 2 3 3 4 14046.3137 0.0001 0.002 280: 6 2 4 2 7 5 2 3 2 6 14046.7852 -0.0004 0.002 281: 6 2 4 2 4 5 2 3 2 3 14046.9008 0.0025 0.002 282: 6 2 4 2 5 5 2 3 2 4 14046.9619 0.0013 0.002 283: 6 2 4 3 9 5 2 3 3 8 14047.3647 0.0028 0.002 284: 6 2 4 3 3 5 2 3 3 2 14047.5291 0.0006 0.002 285: 6 2 4 1 5 5 2 3 3 6 14047.5663 0.0049 0.002 ! 286: 6 3 3 3 7 5 3 2 3 6 15044.1484 -0.0020 0.002 287: 6 3 3 3 7 5 3 2 1 6 15044.5146 0.0004 0.002 288: 6 1 5 2 6 5 3 2 3 5 15044.6475 -0.0015 0.002 labels 289: 6 3 3 3 6 5 3 2 0 5 15044.7625 0.0032 0.002 290: 6 3 3 1 5 5 3 2 1 4 15044.8586 0.0026 0.002 291: 6 3 3 3 8 5 3 2 3 7 15045.7689 0.0000 0.002 292: 6 3 3 2 7 5 3 2 3 6 15045.9646 -0.0007 0.002 293: 6 3 3 2 7 5 3 2 1 6 15046.3305 0.0014 0.002 294: 6 3 3 2 8 5 3 2 2 7 15046.3878 -0.0011 0.002 295: 6 3 3 2 4 5 3 2 2 3 15046.5627 -0.0003 0.002 296: 7 4 3 0 7 5 3 2 2 6 15046.7001 -0.0017 0.002 labels 297: 6 3 3 2 5 5 3 2 3 4 15046.7959 -0.0011 0.002 298: 6 3 3 2 4 5 3 2 2 4 15046.9636 0.0029 0.002 299: 6 3 3 3 4 5 3 2 3 3 15047.3422 0.0008 0.002 300: 6 3 3 3 9 5 3 2 3 8 15048.0065 0.0031 0.002 ! 301: 9 1 9 3 7 8 1 8 3 6 15286.9524 -0.0001 0.002 302: 9 0 9 3 7 8 0 8 3 6 15286.9811 -0.0013 0.002 303: 9 1 9 3 9 8 1 8 3 8 15287.0845 0.0005 0.002 304: 9 0 9 3 9 8 0 8 3 8 15287.1138 -0.0002 0.002 305: 9 1 9 0 9 8 1 8 0 8 15287.3069 0.0026 0.002 306: 9 1 9 3 8 8 1 8 3 7 15287.3368 -0.0015 0.002 307: 9 1 9 3 10 8 1 8 3 9 15287.4304 0.0034 0.002 308: 9 1 9 1 10 8 1 8 1 9 15287.4603 0.0016 0.002 309: 9 1 9 3 6 8 1 8 3 5 15287.4750 0.0007 0.002 310: 9 0 9 1 10 8 0 8 1 9 15287.4903 0.0015 0.002 311: 9 1 9 2 11 8 1 8 2 10 15287.5324 0.0023 0.002 312: 9 0 9 2 11 8 0 8 2 10 15287.5609 0.0007 0.002 313: 9 1 9 3 11 8 1 8 3 10 15287.8868 0.0029 0.002 314: 9 0 9 3 11 8 0 8 3 10 15287.9168 0.0029 0.002 315: 9 1 9 3 12 8 1 8 3 11 15287.9471 0.0014 0.002 316: 9 0 9 3 12 8 0 8 3 11 15287.9775 0.0019 0.002 ! 317: 8 2 7 3 8 7 2 6 3 7 15289.7365 0.0003 0.002 318: 8 2 7 1 7 7 2 6 1 6 15289.8322 -0.0005 0.002 319: 8 2 7 0 8 7 2 6 0 7 15289.8848 0.0022 0.002 320: 8 2 7 3 7 7 2 6 3 6 15290.5041 -0.0017 0.002 321: 8 2 7 1 9 7 2 6 1 8 15290.6163 0.0040 0.002 322: 8 2 7 2 10 7 2 6 2 9 15290.6577 -0.0002 0.002 323: 8 2 7 3 10 7 2 6 3 9 15290.7437 -0.0005 0.002 324: 8 2 7 3 5 7 2 6 3 4 15291.3286 -0.0013 0.002 325: 8 4 5 0 8 7 4 4 0 7 15291.4486 -0.0006 0.002 labels 326: 8 2 7 3 11 7 2 6 3 10 15291.4897 0.0020 0.002 ! 327: 10 1 10 0 10 9 1 9 0 9 16896.3980 -0.0038 0.002 328: 10 1 10 3 9 9 1 9 3 8 16896.4493 -0.0036 0.002 329: 10 1 10 3 11 9 1 9 3 10 16896.5134 -0.0019 0.002 330: 10 1 10 1 11 9 1 9 1 10 16896.5289 -0.0041 0.002 331: 10 1 10 3 12 9 1 9 3 11 16896.8884 -0.0031 0.002 332: 10 1 10 3 13 9 1 9 3 12 16896.9330 -0.0025 0.002 ! 333: 9 2 8 3 9 8 2 7 3 8 16900.0609 0.0003 0.002 334: 9 2 8 1 8 8 2 7 1 7 16900.1054 -0.0032 0.002 335: 9 2 8 0 9 8 2 7 0 8 16900.1775 -0.0014 0.002 336: 9 2 8 3 10 8 2 7 3 9 16900.1980 -0.0013 0.002 337: 9 2 8 3 7 8 2 7 3 6 16900.5836 0.0005 0.002 338: 9 2 8 1 10 8 2 7 1 9 16900.7689 -0.0004 0.002 339: 9 2 8 3 11 8 2 7 3 10 16900.9197 -0.0006 0.002 340: 9 2 8 3 6 8 2 7 3 5 16901.3353 0.0016 0.002 341: 9 2 8 3 12 8 2 7 3 11 16901.5057 0.0013 0.002 -------------------------------------------------------------------------------------========= 1 Lines rejected from fit PARAMETERS IN FIT (values truncated and Nlines statistics): 10000 A /MHz 1920.02421(26) 1 20000 B /MHz 1385.253677(78) 2 30000 C /MHz 804.576102(43) 3 200 DJ /kHz 0.03766(58) 4 1100 DJK /kHz [-0.0175] 5 2000 DK /kHz [ 0.4361] 6 40100 dJ /kHz 0.01322(38) 7 41000 dK /kHz [ 0.02015] 8 110010000 chi.aa*3/2 /MHz -67.9607(67) 9 110040000 chi(b-c)/4 /MHz -5.0569(16) 10 110610000 chi.ab /MHz [49.41] 11 220010000 chi.aa*3/2 /MHz -55.1299(76) 12 220040000 chi(b-c)/4 /MHz -7.2011(16) 13 220610000 chi.ab /MHz [-53.51] 14 MICROWAVE AVG = -0.000023 MHz, IR AVG = 0.00000 MICROWAVE RMS = 0.001749 MHz, IR RMS = 0.00000 END OF ITERATION 1 OLD, NEW RMS ERROR= 0.87342 0.87342 distinct frequency lines in fit: 340 distinct parameters of fit: 9 lines rejected from fit: 1 (ERRTST = 6.00E+01) upper state lower state overall limits of quantum number 1: 3 10 2 9 2 10 limits of quantum number 2: 0 4 0 4 0 4 limits of quantum number 3: 1 10 0 9 0 10 limits of quantum number 4: 0 3 0 3 0 3 limits of quantum number 5: 2 13 1 12 1 13 frequency range: 7191 16901 PARAMETERS IN FIT WITH STANDARD ERRORS ON THOSE THAT ARE FITTED: (values rounded and degrees of freedom, Ndegf=Nlines-Nconst, statistics) 10000 A /MHz 1920.02422(23) 1 20000 B /MHz 1385.253677(69) 2 30000 C /MHz 804.576102(38) 3 200 DJ /kHz 0.03766(51) 4 1100 DJK /kHz [-0.0175] 5 2000 DK /kHz [ 0.4361] 6 40100 dJ /kHz 0.01322(34) 7 41000 dK /kHz [ 0.02015] 8 110010000 chi.aa*3/2 /MHz -67.9607(59) 9 110040000 chi(b-c)/4 /MHz -5.0569(14) 10 110610000 chi.ab /MHz [49.41] 11 220010000 chi.aa*3/2 /MHz -55.1299(67) 12 220040000 chi(b-c)/4 /MHz -7.2012(14) 13 220610000 chi.ab /MHz [-53.51] 14 CORRELATION COEFFICIENTS, C.ij: A B C -DJ -dJ chi.aa*3 chi(b-c) chi.aa*3 A 1.0000 B 0.6611 1.0000 C -0.6472 -0.4831 1.0000 -DJ -0.5618 -0.8490 0.1129 1.0000 -dJ -0.6970 -0.9239 0.4835 0.9082 1.0000 chi.aa*3/2 0.0125 -0.0600 0.0055 0.0357 0.0305 1.0000 chi(b-c)/4 -0.0217 0.0137 -0.0020 -0.0009 -0.0066 0.4626 1.0000 chi.aa*3/2 0.0016 -0.0095 -0.0327 0.0046 -0.0031 -0.6210 -0.2719 1.0000 chi(b-c)/4 -0.0154 -0.0783 -0.0285 0.0644 0.0519 -0.1468 -0.1283 0.3669 chi(b-c) chi(b-c)/4 1.0000 Mean value of |C.ij|, i.ne.j = 0.2446 Mean value of C.ij, i.ne.j = -0.0659 No correlations with absolute value greater than 0.9950 Worst fitted lines (obs-calc/error): 285: 2.4 219: -2.1 256: -2.1 330: -2.1 24: 2.0 321: 2.0 257: -2.0 4: 1.9 327: -1.9 239: 1.9 7: -1.9 328: -1.8 21: -1.8 307: 1.7 260: -1.7 50: -1.6 6: 1.6 255: -1.6 289: 1.6 207: 1.6 27: -1.6 334: -1.6 41: 1.5 23: -1.5 331: -1.5 3: 1.5 300: 1.5 80: -1.5 10: -1.5 46: -1.5 258: 1.5 269: 1.5 38: 1.4 266: 1.4 117: 1.4 314: 1.4 313: 1.4 298: 1.4 211: 1.4 283: 1.4 149: 1.4 137: 1.4 26: 1.4 201: 1.4 87: 1.4 33: -1.4 8: 1.4 17: -1.4 290: 1.3 89: -1.3 285: 6 2 4 1 5 5 2 3 3 6 14047.5663 0.0049 0.002 219: 6 1 5 2 5 5 1 4 2 4 12142.7393 -0.0043 0.002 256: 7 2 6 3 6 6 2 5 3 5 13673.3741 -0.0041 0.002 330: 10 1 10 1 11 9 1 9 1 10 16896.5289 -0.0041 0.002 24: 3 2 1 3 4 2 2 0 3 3 7415.6318 0.0040 0.002 321: 8 2 7 1 9 7 2 6 1 8 15290.6163 0.0040 0.002 257: 7 2 6 3 5 6 2 5 3 4 13673.3867 -0.0040 0.002 4: 3 1 2 2 5 2 1 1 2 4 7192.8332 0.0039 0.002 327: 10 1 10 0 10 9 1 9 0 9 16896.3980 -0.0038 0.002 239: 5 3 2 1 6 4 3 1 1 5 12421.6251 0.0037 0.002 _____________________________________ __________________________________________/ SPFIT output reformatted with PIFORM