H2N(13)CN Mon Jan 31 19:04:07 2011 -------------------------------------------------------------------------------------========= obs o-c error blends Notes o-c wt / instead of : below denotes (o-c)>3*err -------------------------------------------------------------------------------------========= ! ! 0+ ! 1: 6 0 6 0 5 0 5 0 119916.1841 0.0367 0.050 2: 7 0 7 0 6 0 6 0 139898.1182 -0.0702 0.050 3: 29 0 29 0 28 0 28 0 578579.9326 0.0264 0.050 4: 30 0 30 0 29 0 29 0 598455.0137 0.0625 0.050 5: 32 0 32 0 31 0 31 0 638182.2802 0.0317 0.050 ! ! 6: 6 1 6 0 5 1 5 0 119124.3596 0.0330 0.050 7: 8 1 8 0 7 1 7 0 158827.5950 -0.0014 0.050 8: 7 1 7 0 6 1 6 0 138976.4263 0.0116 0.050 9: 30 1 30 0 29 1 29 0 595068.2630 -0.0219 0.050 10: 31 1 31 0 30 1 30 0 614864.0147 -0.0342 0.050 11: 32 1 32 0 31 1 31 0 634655.9065 -0.0605 0.050 ! ! 12: 6 1 5 0 5 1 4 0 120705.3722 0.0501 0.050 13: 7 1 6 0 6 1 5 0 140820.8211 0.0245 0.050 14: 8 1 7 0 7 1 6 0 160935.3239 0.0134 0.050 15: 29 1 28 0 28 1 27 0 582870.4381 -0.0555 0.050 16: 30 1 29 0 29 1 28 0 602928.2155 0.0043 0.050 17: 32 1 31 0 31 1 30 0 643030.6338 -0.0759 0.050 ! ! 18: 6 2 4 0 5 2 3 0 119900.4878 0.0546 0.050 19: 7 2 5 0 6 2 4 0 139884.6375 -0.0197 0.050 20: 8 2 6 0 7 2 5 0 159869.2470 -0.0117 0.050 21: 29 2 27 0 28 2 26 0 579720.9000 -0.0279 0.050 22: 30 2 28 0 29 2 27 0 599725.5716 -0.0468 0.050 23: 31 2 29 0 30 2 28 0 619731.5207 -0.0371 0.050 24/ 32 2 30 0 31 2 29 0 639738.8924 0.1507 0.050 ! 25: 6 2 5 0 5 2 4 0 119894.3179 -0.0165 0.050 26: 7 2 6 0 6 2 5 0 139874.9243 0.0241 0.050 27: 8 2 7 0 7 2 6 0 159854.5889 -0.0350 0.050 28: 29 2 28 0 28 2 27 0 579020.1726 -0.0353 0.050 29: 31 2 30 0 30 2 29 0 618877.6739 0.0646 0.050 30: 32 2 31 0 31 2 30 0 638800.7324 0.0247 0.050 ! ! 31: 6 3 4 0 5 3 3 0 120037.7609 -0.0153 0.050 -0.0487 0.50 32: 6 3 3 0 5 3 2 0 120037.7609 -0.0819 0.050 -0.0487 0.50 33: 7 3 5 0 6 3 4 0 140041.4161 0.0689 0.050 -0.0048 0.50 34: 7 3 4 0 6 3 3 0 140041.4161 -0.0785 0.050 -0.0048 0.50 35: 8 3 6 0 7 3 5 0 160043.8716 0.1653 0.050 0.0205 0.50 36: 8 3 5 0 7 3 4 0 160043.8716 -0.1242 0.050 0.0205 0.50 37: 30 3 28 0 29 3 27 0 599582.8781 0.0510 0.050 38: 31 3 29 0 30 3 28 0 619532.0569 -0.0313 0.050 39: 32 3 30 0 31 3 29 0 639478.3613 0.0699 0.050 ! 40: 29 3 26 0 28 3 25 0 579734.6864 -0.0161 0.050 41: 30 3 27 0 29 3 26 0 599702.2949 -0.0280 0.050 42: 31 3 28 0 30 3 27 0 619668.5794 0.0911 0.050 43: 32 3 29 0 31 3 28 0 639633.1678 -0.0613 0.050 ! 44: 6 4 2 0 5 4 1 0 119863.0567 0.0144 0.050 45: 7 4 3 0 6 4 2 0 139839.0364 0.0011 0.050 46: 8 4 4 0 7 4 3 0 159814.4766 -0.0067 0.050 47: 29 4 25 0 28 4 24 0 579034.8381 -0.0919 0.050 -0.0465 0.50 48: 29 4 26 0 28 4 25 0 579034.8381 -0.0010 0.050 -0.0465 0.50 49: 31 4 27 0 30 4 26 0 618919.9083 -0.1330 0.050 -0.0605 0.50 50: 31 4 28 0 30 4 27 0 618919.9083 0.0119 0.050 -0.0605 0.50 ! 51: 6 5 1 0 5 5 0 0 119812.1249 0.0188 0.050 52: 7 5 2 0 6 5 1 0 139779.5569 0.0054 0.050 53: 8 5 3 0 7 5 2 0 159746.4106 -0.0143 0.050 54: 29 5 24 0 28 5 23 0 578773.8153 0.0501 0.050 55: 30 5 25 0 29 5 24 0 598707.3258 -0.0192 0.050 ! ! 0- ! 56: 6 0 6 1 5 0 5 1 119819.2590 0.0239 0.050 57: 7 0 7 1 6 0 6 1 139785.4083 0.0035 0.050 58: 8 0 8 1 7 0 7 1 159749.9560 0.0899 0.050 59: 29 0 29 1 28 0 28 1 578182.4993 0.0586 0.050 60: 30 0 30 1 29 0 29 1 598048.9963 -0.0130 0.050 61: 31 0 31 1 30 0 30 1 617908.5386 -0.0108 0.050 62: 32 0 32 1 31 0 31 1 637760.8498 -0.0145 0.050 ! ! 63: 7 1 7 1 6 1 6 1 138932.6573 0.0101 0.050 64: 8 1 8 1 7 1 7 1 158777.6827 -0.0099 0.050 65: 6 1 6 1 5 1 5 1 119086.7147 -0.0214 0.050 66: 30 1 30 1 29 1 29 1 594906.3446 -0.0104 0.050 67: 31 1 31 1 30 1 30 1 614698.7309 0.0103 0.050 68: 32 1 32 1 31 1 31 1 634487.4601 0.0042 0.050 ! 69: 6 1 5 1 5 1 4 1 120561.7170 -0.0016 0.050 70: 7 1 6 1 6 1 5 1 140653.3204 -0.0040 0.050 71: 8 1 7 1 7 1 6 1 160744.0009 0.0006 0.050 ! ! 72: 6 2 4 1 5 2 3 1 119650.9847 0.0037 0.050 73: 7 2 5 1 6 2 4 1 139594.9520 -0.0481 0.050 74: 8 2 6 1 7 2 5 1 159539.9089 -0.0461 0.050 75: 29 2 27 1 28 2 26 1 578640.8742 -0.0426 0.050 76: 30 2 28 1 29 2 27 1 598607.8844 0.0912 0.050 77: 32 2 30 1 31 2 29 1 638542.6328 0.0138 0.050 ! 78: 6 2 5 1 5 2 4 1 119645.6706 -0.0226 0.050 79: 7 2 6 1 6 2 5 1 139586.5463 -0.0324 0.050 80: 8 2 7 1 7 2 6 1 159527.3806 -0.0073 0.050 81: 29 2 28 1 28 2 27 1 578118.9078 0.0923 0.050 82: 30 2 29 1 29 2 28 1 598033.9637 0.0940 0.050 83: 31 2 30 1 30 2 29 1 617946.2235 -0.0363 0.050 84: 32 2 31 1 31 2 30 1 637855.7628 -0.0825 0.050 ! ! 85: 6 3 3 1 5 3 2 1 119765.9584 0.0507 0.050 0.0524 0.50 86: 6 3 4 1 5 3 3 1 119765.9584 0.0540 0.050 0.0524 0.50 87: 7 3 4 1 6 3 3 1 139725.7841 -0.0307 0.050 -0.0271 0.50 88: 7 3 5 1 6 3 4 1 139725.7841 -0.0233 0.050 -0.0271 0.50 89: 8 3 6 1 7 3 5 1 159685.1874 -0.0235 0.050 -0.0309 0.50 90: 8 3 5 1 7 3 4 1 159685.1874 -0.0382 0.050 -0.0309 0.50 91: 29 3 27 1 28 3 26 1 578586.4557 -0.0276 0.050 92: 30 3 28 1 29 3 27 1 598515.9222 -0.0460 0.050 93: 31 3 29 1 30 3 28 1 618443.0791 -0.1032 0.050 94: 32 3 30 1 31 3 29 1 638368.0611 0.0202 0.050 95: 31 3 28 1 30 3 27 1 618457.0320 0.0326 0.050 ! ! 96: 6 4 2 1 5 4 1 1 119741.3300 0.0049 0.050 97: 7 4 4 1 6 4 3 1 139696.9887 -0.0115 0.050 98: 8 4 5 1 7 4 4 1 159652.1189 0.0030 0.050 99: 29 4 26 1 28 4 25 1 578438.4838 -0.0174 0.050 -0.0481 0.50 100: 29 4 25 1 28 4 24 1 578438.4838 -0.0787 0.050 -0.0481 0.50 101: 30 4 27 1 29 4 26 1 598360.9867 -0.0512 0.050 -0.0902 0.50 102: 30 4 26 1 29 4 25 1 598360.9867 -0.1291 0.050 -0.0902 0.50 103: 31 4 28 1 30 4 27 1 618281.1560 -0.0135 0.050 -0.0625 0.50 104: 31 4 27 1 30 4 26 1 618281.1560 -0.1115 0.050 -0.0625 0.50 ! 105: 7 5 2 1 6 5 1 1 139653.6752 0.0384 0.050 106: 8 5 3 1 7 5 2 1 159602.5204 0.0323 0.050 107/ 31 5 26 1 30 5 25 1 618073.0161 0.1555 0.050 108: 32 5 27 1 31 5 26 1 637982.7639 0.1269 0.050 ! 109: 7 6 1 1 6 6 0 1 139597.6614 0.0084 0.050 110: 8 6 2 1 7 6 1 1 159538.5118 0.0354 0.050 111: 29 6 24 1 28 6 23 1 578007.8944 -0.0290 0.050 112: 30 6 25 1 29 6 24 1 597914.1252 -0.0329 0.050 113: 31 6 26 1 30 6 25 1 617817.7882 -0.0529 0.050 -------------------------------------------------------------------------------- PARAMETERS IN FIT: 10000 A /MHz 312098.(18) 1 20000 B /MHz 10126.2428(63) 2 30000 C /MHz 9861.3964(58) 3 200 DJ /kHz 3.80725(79) 4 1100 DJK /kHz 393.96(18) 5 2000 DK /kHz [44151.] 6 40100 dJ /kHz 0.14048(78) 7 41000 dK /kHz 300.6(26) 8 300 HJ /Hz [-0.001079] 9 1200 HJK /Hz 1.706(54) 10 2100 HKJ /Hz -372.3(57) 11 3000 HK /Hz [18616.] 12 40200 hJ /Hz [ 0.] 13 41100 hJK /Hz [ 0.] 14 42000 hK /Hz [ 0.] 15 1300 LJK /mHz [ 0.] 16 2200 LKJ /mHz [13.73] 17 3100 LKKJ /mHz [-4071.] 18 4000 LK /mHz [ 0.] 19 10011 A /MHz 304496.(15) 20 20011 B /MHz 10108.9156(64) 21 30011 C /MHz 9862.2956(62) 22 211 DJ /kHz 3.82192(72) 23 1111 DJK /kHz 357.97(10) 24 2011 DK /kHz [27931.] 25 40111 dJ /kHz 0.12001(86) 26 41011 dK /kHz 201.1(27) 27 311 HJ /Hz [-0.0007103] 28 1211 HJK /Hz 1.121(37) 29 2111 HKJ /Hz -228.7(20) 30 3011 HK /Hz [4273.] 31 40211 hJ /Hz [ 0.] 32 41111 hJK /Hz [ 0.] 33 42011 hK /Hz [ 0.] 34 1311 LJK /mHz [ 0.] 35 2211 LKJ /mHz [12.08] 36 3111 LKKJ /mHz [-3241.] 37 4011 LK /mHz [ 0.] 38 11 E /MHz 1486407.(169) 39 410001 Fca /MHz 346.441(39) 40 410101 Fca.J /MHz [ 0.001397] 41 411001 Fca.K /MHz [-1.515] 42 410201 Fca.JJ /MHz [ 0.00000001177] 43 411101 Fca.JK /MHz [-0.00005592] 44 412001 Fca.KK /MHz [ 0.] 45 413001 Fca.KKK /MHz [ 0.] 46 MICROWAVE AVG = 0.000871 MHz, IR AVG = 0.00000 MICROWAVE RMS = 0.048676 MHz, IR RMS = 0.00000 END OF ITERATION 1 OLD, NEW RMS ERROR= 0.97352 0.97352 distinct frequency lines in fit: 102 distinct parameters of fit: 20 maximum J: 32 maximum Ka: 6 for standard parameter errors previous errors are multiplied by: 1.085770 MICROWAVE lines fitted lines lines RMS RMS ERROR total dv=0 dv.ne.0 UNFITTD e>900 v=0: 50 50 0 0 0 0.045423 0.90846 v=1: 52 52 0 0 0 0.051549 1.03098 PARAMETERS IN FIT WITH STANDARD ERRORS ON THOSE THAT ARE FITTED: 10000 A /MHz 312098.(20) 1 20000 B /MHz 10126.2428(68) 2 30000 C /MHz 9861.3964(62) 3 200 DJ /kHz 3.80725(85) 4 1100 DJK /kHz 393.96(20) 5 2000 DK /kHz [44151.] 6 40100 dJ /kHz 0.14048(84) 7 41000 dK /kHz 300.6(29) 8 300 HJ /Hz [-0.001079] 9 1200 HJK /Hz 1.706(58) 10 2100 HKJ /Hz -372.3(61) 11 3000 HK /Hz [18616.] 12 40200 hJ /Hz [ 0.] 13 41100 hJK /Hz [ 0.] 14 42000 hK /Hz [ 0.] 15 1300 LJK /mHz [ 0.] 16 2200 LKJ /mHz [13.73] 17 3100 LKKJ /mHz [-4071.] 18 4000 LK /mHz [ 0.] 19 10011 A /MHz 304496.(16) 20 20011 B /MHz 10108.9156(69) 21 30011 C /MHz 9862.2956(67) 22 211 DJ /kHz 3.82192(78) 23 1111 DJK /kHz 357.97(11) 24 2011 DK /kHz [27931.] 25 40111 dJ /kHz 0.12001(93) 26 41011 dK /kHz 201.1(29) 27 311 HJ /Hz [-0.0007103] 28 1211 HJK /Hz 1.121(40) 29 2111 HKJ /Hz -228.7(21) 30 3011 HK /Hz [4273.] 31 40211 hJ /Hz [ 0.] 32 41111 hJK /Hz [ 0.] 33 42011 hK /Hz [ 0.] 34 1311 LJK /mHz [ 0.] 35 2211 LKJ /mHz [12.08] 36 3111 LKKJ /mHz [-3241.] 37 4011 LK /mHz [ 0.] 38 11 E /MHz 1486407.(183) 39 410001 Fca /MHz 346.441(42) 40 410101 Fca.J /MHz [ 0.001397] 41 411001 Fca.K /MHz [-1.515] 42 410201 Fca.JJ /MHz [ 0.00000001177] 43 411101 Fca.JK /MHz [-0.00005592] 44 412001 Fca.KK /MHz [ 0.] 45 413001 Fca.KKK /MHz [ 0.] 46 CORRELATION COEFFICIENTS, C.ij: A B C -DJ -DJK -dJ -dK HJK A 1.0000 B -0.6464 1.0000 C 0.5715 -0.9340 1.0000 -DJ 0.5553 -0.7304 0.4710 1.0000 -DJK 0.6772 -0.5611 0.3535 0.6387 1.0000 -dJ -0.1783 -0.4187 0.4662 -0.0056 -0.0428 1.0000 -dK 0.8113 -0.8749 0.8431 0.7025 0.5537 -0.0278 1.0000 HJK 0.0330 0.1091 0.1096 -0.4819 -0.5103 -0.0141 -0.0030 1.0000 HKJ -0.7439 0.5718 -0.4686 -0.4426 -0.8626 0.0371 -0.6156 0.0452 A 0.2304 -0.1631 0.1220 0.1383 0.2844 -0.0106 0.1694 0.0091 B -0.2413 0.1955 -0.1505 -0.1504 -0.2878 -0.0035 -0.1934 0.0045 C 0.2505 -0.2101 0.1619 0.1640 0.2814 0.0052 0.2068 -0.0009 -DJ 0.0200 -0.0070 -0.0020 0.0000 0.0581 0.0055 -0.0014 -0.0235 -DJK -0.2718 0.1890 -0.1661 -0.1674 -0.1153 0.0488 -0.2338 -0.0190 -dJ -0.2278 0.1606 -0.1299 -0.1388 -0.1978 0.0240 -0.1812 -0.0186 -dK 0.2745 -0.2210 0.1674 0.1755 0.3109 0.0024 0.2181 -0.0024 HJK 0.1168 -0.0865 0.0651 0.0731 0.1146 -0.0059 0.0899 0.0172 HKJ 0.1813 -0.1182 0.1102 0.1091 0.0222 -0.0454 0.1595 0.0127 E 0.9433 -0.6108 0.5441 0.5252 0.6016 -0.1732 0.7718 0.0336 Fca -0.3968 0.3226 -0.2338 -0.2713 -0.4149 -0.0037 -0.3122 -0.0483 HKJ A B C -DJ -DJK -dJ -dK HKJ 1.0000 A -0.3966 1.0000 B 0.3315 -0.4210 0.0000 C -0.3146 0.3789 -0.9471 0.0000 -DJ -0.0769 0.3110 -0.6503 0.4246 0.0000 -DJK 0.0729 0.3591 -0.1499 -0.0533 0.3882 0.0000 -dJ 0.2356 -0.2692 -0.2885 0.2815 0.0444 0.0043 0.0000 -dK -0.3627 0.5889 -0.8652 0.8655 0.6104 0.0706 -0.1560 0.0000 HJK -0.1291 0.0802 0.0566 0.1396 -0.5015 -0.6265 -0.1172 0.0575 HKJ 0.0386 -0.5134 0.2219 -0.1246 -0.1566 -0.7699 0.0823 -0.2172 E -0.6300 -0.0974 -0.1322 0.1630 -0.0782 -0.4179 -0.1509 0.1166 Fca 0.4617 -0.4572 0.6087 -0.6666 -0.2376 0.1611 0.2575 -0.7430 HJK HKJ E Fca HJK 0.0000 HKJ 0.0227 0.0000 E 0.1044 0.3701 0.0000 Fca -0.1952 0.0042 -0.3137 0.0000 Mean value of |C.ij|, i.ne.j = 0.2695 Mean value of C.ij, i.ne.j = -0.0152 Worst fitting lines (obs-calc/error): 107: 3.1 24: 3.0 108: 2.5 93: -2.1 82: 1.9 81: 1.8 76: 1.8 42: 1.8 101: -1.8 58: 1.8 84: -1.6 17: -1.5 2: -1.4 39: 1.4 29: 1.3 103: -1.3 4: 1.2 43: -1.2 49: -1.2 11: -1.2 59: 1.2 15: -1.1 18: 1.1 113: -1.1 85: 1.0 37: 1.0 54: 1.0 12: 1.0 31: -1.0 99: -1.0 73: -1.0 22: -0.9 47: -0.9 74: -0.9 92: -0.9 75: -0.9 105: 0.8 23: -0.7 1: 0.7 83: -0.7 110: 0.7 28: -0.7 27: -0.7 10: -0.7 6: 0.7 112: -0.7 95: 0.7 79: -0.6 106: 0.6 5: 0.6 _____________________________________ __________________________________________/ SPFIT output reformatted with PIFORM