ASFIT version 3a.XII.2004 _______________________________________________________________________________ Lactic acid, v_30 = 3 _______________________________________________________________________________ Fit of Watson's Hamiltonian --> reduction-A, representation-I.r : A = 5140.8447372521331999451 +- 0.0004314354152530487 B = 3251.5005627021578220592 +- 0.0002589302608365048 C = 2262.8334561293736442167 +- 0.0002781682310519144 DJ = 0.0014931660069603607 +- 0.0000001292744202966 DJK = -0.0026133098012634929 +- 0.0000003361403722991 DK = 0.0026511663308932758 +- 0.0000008189375887921 dJ = 0.0003948674327762327 +- 0.0000000444564826293 dK = 0.0048808180695821051 +- 0.0000004878350621738 HJ = -0.0000000039822779252 +- 0.0000000000233020560 HJK = -0.0000000231803418369 +- 0.0000000001106536916 HKJ = 0.0000001002119014365 +- 0.0000000003214512503 HK = -0.0000000727082494253 +- 0.0000000005912659833 hJ = -0.0000000032051459273 +- 0.0000000000093612917 hJK = -0.0000000147820343657 +- 0.0000000002205341591 hK = -0.0000001516298743849 +- 0.0000000003062809675 LJK = -0.0000000000020970688 +- 0.0000000000001883890 LKKJ= 0.0000000000063893227 +- 0.0000000000005552215 LK = -0.0000000000041979739 +- 0.0000000000003993667 lJK = -0.0000000000001982563 +- 0.0000000000000319559 lKJ = -0.0000000000003647141 +- 0.0000000000000647976 lK = -0.0000000000085175377 +- 0.0000000000004253234 Deviation of fit = 0.043217 Weighted deviation of fit = 0.864336 ------------------------------------------------------------------------------------------------------ TRANSITION Observed Obs-Calc Error Note Blend components ------------------------------------------------------------------------------------------------------ ! ! band lines (unresolved bR+aR quartets, for which only the central ! aR line is declared) ! 1. 38 0 38 37 0 37 173517.6810 0.0001 0.0500 2. 39 0 39 38 0 38 178031.4363 -0.0075 0.0500 3. 43 0 43 42 0 42 196080.0267 -0.0143 0.0500 4. 45 0 45 44 0 44 205100.2241 -0.0256 0.0500 5. 46 0 46 45 0 45 209609.2660 -0.0119 0.0500 6. 47 0 47 46 0 46 214117.5500 -0.0183 0.0500 7. 51 0 51 50 0 50 232143.0124 -0.0393 0.0500 8. 69 0 69 68 0 68 313083.6973 0.0030 0.0500 9. 70 0 70 69 0 69 317570.9991 -0.0346 0.0500 ! 10. 37 1 36 36 1 35 172391.3340 -0.0193 0.0500 11. 38 1 37 37 1 36 176906.4732 -0.0118 0.0500 12. 42 1 41 41 1 40 194960.9548 -0.0152 0.0500 13. 44 1 43 43 1 42 203984.3390 -0.0230 0.0500 14. 45 1 44 44 1 43 208495.0150 -0.0247 0.0500 15. 46 1 45 45 1 44 213005.0010 -0.0168 0.0500 16. 62 1 61 61 1 60 285057.1329 0.0024 0.0500 17. 63 1 62 62 1 61 289552.9057 -0.0105 0.0500 ! 18. 36 2 34 35 2 33 171262.6484 0.0100 0.0500 19. 37 2 35 36 2 34 175778.8266 -0.0084 0.0500 20. 41 2 39 40 2 38 193838.1095 -0.0230 0.0500 21. 43 2 41 42 2 40 202864.2160 -0.0191 0.0500 22. 44 2 42 43 2 41 207376.3258 -0.0132 0.0500 23. 45 2 43 44 2 42 211887.7530 -0.0357 0.0500 24. 50 2 48 49 2 47 234434.6230 -0.0272 0.0500 25. 61 2 59 60 2 58 283968.9867 0.0253 0.0500 26. 62 2 60 61 2 59 288466.8825 0.0065 0.0500 27. 68 2 66 67 2 65 315434.2215 -0.1048 0.0500 ! 28. 36 3 33 35 3 32 174651.7977 0.0155 0.0500 29. 40 3 37 39 3 36 192714.0712 -0.0020 0.0500 30. 43 3 40 42 3 39 206255.3043 -0.0250 0.0500 31. 44 3 41 43 3 40 210767.8990 -0.0274 0.0500 32. 49 3 46 48 3 45 233321.3651 -0.0175 0.0500 33. 60 3 57 59 3 56 282874.4151 0.0084 0.0500 34. 61 3 58 60 3 57 287374.2710 0.0002 0.0500 ! 35. 35 4 31 34 4 30 173530.5670 0.0249 0.0500 36. 36 4 32 35 4 31 178046.5185 0.0038 0.0500 37. 40 4 36 39 4 35 196107.1934 -0.0105 0.0500 38. 42 4 38 41 4 37 205135.1192 0.0122 0.0500 39. 43 4 39 42 4 38 209648.3590 0.0206 0.0500 40. 44 4 40 43 4 39 214160.9220 -0.1315 0.0500 41. 48 4 44 47 4 43 232206.1942 -0.0698 0.0500 42. 60 4 56 59 4 55 286276.4331 0.0202 0.0500 43. 66 4 62 65 4 61 313267.5844 0.0164 0.0500 ! 44. 34 5 29 33 5 28 172423.7980 0.0242 0.0500 45. 35 5 30 34 5 29 176937.6826 0.0263 0.0500 46. 39 5 34 38 5 33 194993.3820 0.0184 0.0500 47. 41 5 36 40 5 35 204020.2510 -0.0229 0.0500 48. 42 5 37 41 5 36 208533.2698 -0.0221 0.0500 49. 43 5 38 42 5 37 213045.9170 -0.0408 0.0500 50. 59 5 54 58 5 53 285174.9257 -0.0427 0.0500 51. 66 5 61 65 5 60 316672.9053 0.0196 0.0500 ! 52. 33 6 27 32 6 26 171346.7166 0.0108 0.0500 53. 34 6 28 33 6 27 175854.9147 0.0049 0.0500 54. 38 6 32 37 6 31 193895.4487 -0.0168 0.0500 55. 40 6 34 39 6 33 202917.9430 0.0134 0.0500 56. 41 6 35 40 6 34 207429.2244 -0.0518 0.0500 57. 42 6 36 41 6 35 211940.5640 -0.0159 0.0500 58. 47 6 41 46 6 40 234494.0570 -0.0388 0.0500 59. 58 6 52 57 6 51 284072.2248 0.1319 0.0500 60. 59 6 53 58 6 52 288575.3729 -0.0274 0.0500 61. 65 6 59 64 6 58 315579.1039 0.0299 0.0500 ! 62. 33 7 26 32 7 25 174823.0744 -0.0414 0.0500 63. 40 7 33 39 7 32 206346.5551 -0.0283 0.0500 64. 41 7 34 40 7 33 210854.2020 -0.0114 0.0500 65. 46 7 39 45 7 38 233396.1301 -0.0159 0.0500 66. 57 7 50 56 7 49 282970.5928 -0.0417 0.0500 67. 58 7 51 57 7 50 287474.4735 -0.0211 0.0500 ! 68. 39 8 31 38 8 30 205302.4140 -0.0131 0.0500 69. 40 8 32 39 8 31 209802.0930 -0.0037 0.0500 70. 41 8 33 40 8 32 214303.2740 -0.0078 0.0500 71. 45 8 37 44 8 36 232317.8293 -0.0043 0.0500 72. 57 8 49 56 8 48 286378.0587 -0.0245 0.0500 73. 63 8 55 62 8 54 313388.6398 -0.0027 0.0500 ! 74. 31 9 22 30 9 21 173266.2395 -0.0410 0.0500 75. 32 9 23 31 9 22 177625.4486 -0.0735 0.0500 76. 36 9 27 35 9 26 195378.3019 -0.0029 0.0500 77. 39 9 30 38 9 29 208810.9271 -0.0332 0.0500 78. 40 9 31 39 9 30 213298.1420 0.0898 0.0500 79. 56 9 47 55 9 46 285291.0797 -0.0501 0.0500 80. 63 9 54 62 9 53 316797.5790 0.0233 0.0500 ! 81. 30 10 20 29 10 19 174071.3202 -0.0250 0.0500 82. 31 10 22 30 10 21 173115.8007 0.0367 0.0500 83. 31 10 21 30 10 20 177826.1376 -0.0287 0.0500 84. 35 10 25 34 10 24 194659.0775 0.0493 0.0500 85. 36 10 27 35 10 26 195376.2560 -0.0139 0.0500 86. 38 10 28 37 10 27 207933.9998 -0.0364 0.0500 87. 39 10 29 38 10 28 212390.4884 -0.0043 0.0500 88. 39 10 30 38 10 29 208810.9280 0.0876 0.0500 89. 44 10 34 43 10 33 234771.6490 -0.0202 0.0500 90. 55 10 45 54 10 44 284220.5803 -0.0575 0.0500 91. 56 10 46 55 10 45 288720.0211 0.0088 0.0500 ! 92. 29 11 18 28 11 17 175762.1065 0.0033 0.0500 93. 30 11 20 29 11 19 172159.9487 0.0253 0.0500 94. 31 11 21 30 11 20 176780.0738 0.0149 0.0500 95. 33 11 23 32 11 22 185747.6007 -0.0069 0.0500 96. 34 11 23 33 11 22 194772.3250 -0.0023 0.0500 97. 35 11 25 34 11 24 194606.1238 -0.0282 0.0500 98. 37 11 26 36 11 25 207328.3117 -0.0180 0.0500 99. 38 11 28 37 11 27 207929.9121 -0.1041 0.0500 100. 38 11 27 37 11 26 211691.0795 -0.0237 0.0500 101. 39 11 29 38 11 28 212388.9495 0.0888 0.0500 102. 54 11 43 53 11 42 283176.7858 -0.0263 0.0500 103. 55 11 44 54 11 43 287671.0562 -0.0067 0.0500 104. 61 11 50 60 11 49 314645.3577 -0.0137 0.0500 ! 105. 29 13 16 28 13 15 171296.6668 0.0550 0.0500 106. 29 12 17 28 12 16 175365.2218 0.0785 0.0500 107. 30 12 19 29 12 18 174622.1923 0.0469 0.0500 108. 32 12 20 31 12 19 193422.2935 -0.0425 0.0500 109. 35 12 23 34 12 22 204248.1023 0.0379 0.0500 110. 37 12 25 36 12 24 211729.2671 -0.0666 0.0500 111. 37 12 26 36 12 25 207235.8194 0.0500 0.0500 112. 38 12 27 37 12 26 211649.7898 0.0116 0.0500 113. 42 12 30 41 12 29 233116.0539 0.0136 0.0500 114. 54 12 42 53 12 41 286660.2544 -0.0432 0.0500 115.? 60 12 48 59 12 47 313597.9558 0.1526 0.0500 >3*Err 116. 61 12 49 60 12 48 318089.8674 -0.0563 0.0500 ! 117. 30 13 18 29 13 17 175314.0133 -0.0379 0.0500 118. 32 13 19 31 13 18 194222.8314 -0.0456 0.0500 119. 33 13 21 32 13 20 192139.6238 -0.0473 0.0500 120. 34 13 21 33 13 20 206385.0654 0.0273 0.0500 121. 35 13 22 34 13 21 210812.2618 -0.0569 0.0500 122. 36 13 24 35 13 23 206570.4898 0.0516 0.0500 123. 36 13 23 35 13 22 214413.8826 0.0066 0.0500 124. 37 13 25 36 13 24 211061.4860 -0.0460 0.0500 125. 41 13 28 40 13 27 232823.8466 0.0532 0.0500 126. 42 13 30 41 13 29 233102.0776 0.0437 0.0500 127. 59 13 46 58 13 45 312583.7224 -0.0029 0.0500 128. 60 13 47 59 13 46 317068.9208 -0.0029 0.0500 ! 129. 30 14 16 29 14 15 175431.1510 -0.0066 0.0500 130. 30 14 17 29 14 16 174634.7840 0.0175 0.0500 131. 33 14 20 32 14 19 193156.2212 -0.0351 0.0500 132. 34 14 20 33 14 19 205767.6779 -0.0221 0.0500 133. 35 14 22 34 14 21 204419.8220 -0.0119 0.0500 134. 36 14 23 35 14 22 209602.0468 -0.0058 0.0500 135. 37 14 24 36 14 23 214509.1008 0.0285 0.0500 136. 40 14 26 39 14 25 234471.7818 -0.0077 0.0500 137.B 53 14 39 52 14 38 289303.9616 B -0.0038 0.0500 2.0E-04 289304.0177 138.B 53 15 39 52 15 38 289303.9616 B -0.0038 0.0500 2.0E-04 289303.9131 ! ! aR ! 139. 30 15 15 29 15 14 173678.2258 0.0242 0.0500 140. 33 15 18 32 15 17 193832.3866 -0.0042 0.0500 141. 33 15 19 32 15 18 192599.6616 0.0196 0.0500 142. 35 15 21 34 15 20 205034.9446 0.0067 0.0500 143. 35 15 20 34 15 19 209070.4439 -0.0186 0.0500 144. 36 15 22 35 15 21 210965.9666 0.0259 0.0500 145. 51 15 36 50 15 35 284168.7662 -0.0052 0.0500 146. 52 15 37 51 15 36 288569.7337 0.0102 0.0500 147. 58 15 43 57 15 42 315191.2756 0.0204 0.0500 ! 148. 30 16 14 29 16 13 172639.5285 0.0509 0.0500 149. 30 16 15 29 16 14 172628.2226 0.0085 0.0500 150. 32 16 17 31 16 16 185125.1793 0.0326 0.0500 151. 32 16 16 31 16 15 185204.0231 -0.0336 0.0500 152. 35 16 20 34 16 19 204229.8428 -0.0171 0.0500 153. 35 16 19 34 16 18 205156.0083 -0.0163 0.0500 154. 36 16 21 35 16 20 210587.5407 0.0163 0.0500 155. 36 16 20 35 16 19 212414.8181 -0.0108 0.0500 156. 40 16 25 39 16 24 234243.5292 0.0220 0.0500 157. 52 16 37 51 16 36 288567.0171 0.0995 0.0500 ! 158. 30 17 14 29 17 13 171882.0409 0.0106 0.0500 159. 30 17 13 29 17 12 171882.9484 0.0102 0.0500 160. 31 17 14 30 17 13 178002.1267 -0.0296 0.0500 161. 34 17 18 33 17 17 196673.7313 -0.0436 0.0500 162. 34 17 17 33 17 16 196730.1140 -0.0234 0.0500 163. 35 17 19 34 17 18 203014.7588 0.0148 0.0500 164. 35 17 18 34 17 17 203152.2115 0.0281 0.0500 165. 36 17 20 35 17 19 209406.4356 -0.0212 0.0500 166. 36 17 19 35 17 18 209723.1362 0.0059 0.0500 167. 40 17 24 39 17 23 234778.9818 0.0036 0.0500 168. 50 17 33 49 17 32 288558.4098 0.0020 0.0500 169. 51 17 35 50 17 34 288062.8026 -0.0690 0.0500 ! 170.B 30 18 13 29 18 12 171286.2942 B -0.0022 0.0500 1.6E-04 171286.2669 171.B 30 18 12 29 18 11 171286.2942 B -0.0022 0.0500 1.6E-04 171286.3260 172.B 31 18 14 30 18 13 177325.4271 B 0.0257 0.0500 8.0E-05 177325.3003 173.B 31 18 13 30 18 12 177325.4271 B 0.0257 0.0500 8.0E-05 177325.5026 174. 34 18 17 33 18 16 195702.9968 0.0127 0.0500 175. 34 18 16 33 18 15 195708.6865 0.0139 0.0500 176. 36 18 18 35 18 17 208254.8936 -0.0527 0.0500 177. 37 18 19 36 18 18 214657.2224 -0.0658 0.0500 178. 37 18 20 36 18 19 214558.9990 -0.0026 0.0500 179.? 40 18 22 39 18 21 234896.4322 -0.1657 0.0500 >3*Err 180. 47 18 29 46 18 28 285270.4979 0.0657 0.0500 181. 48 18 30 47 18 29 289076.8141 0.0517 0.0500 182. 49 18 32 48 18 31 283394.4224 -0.0909 0.0500 ! 183. 31 19 13 30 19 12 176778.4533 0.0499 0.0500 184. 34 19 15 33 19 14 194926.2792 -0.0539 0.0500 185. 36 19 18 35 19 17 207234.0597 0.1109 0.0500 186. 37 19 19 36 19 18 213463.3432 -0.0274 0.0500 187. 37 19 18 36 19 17 213474.3568 0.0569 0.0500 188. 40 19 21 39 19 20 232660.7161 0.0061 0.0500 189. 40 19 22 39 19 21 232496.4379 -0.0836 0.0500 190. 47 19 28 46 19 27 285531.7193 -0.0189 0.0500 191. 49 19 31 48 19 30 286725.0185 -0.0010 0.0500 ! 192. 31 20 11 30 20 10 176325.3343 -0.0005 0.0500 193. 34 20 14 33 20 13 194293.7672 -0.0111 0.0500 194.B 36 20 16 35 20 15 206444.0196 B 0.0200 0.0500 1.0E-04 206444.1645 195.B 36 20 17 35 20 16 206444.0196 B 0.0200 0.0500 1.0E-04 206443.8346 196. 37 20 17 36 20 16 212580.3100 0.0129 0.0500 197. 37 20 18 36 20 17 212579.2860 -0.0223 0.0500 198. 48 20 29 47 20 28 282455.1996 0.0274 0.0500 199. 48 20 28 47 20 27 288471.4910 -0.0438 0.0500 200. 54 20 35 53 20 34 313245.9635 0.0437 0.0500 ! 201. 31 21 10 30 21 9 175943.7196 -0.0204 0.0500 202. 34 21 14 33 21 13 193768.6968 -0.0039 0.0500 203. 36 21 16 35 21 15 205795.6514 -0.0213 0.0500 204.B 37 21 16 36 21 15 211858.7474 B -0.0069 0.0500 1.1E-04 211858.7915 205.B 37 21 17 36 21 16 211858.7474 B -0.0069 0.0500 1.1E-04 211858.7171 206. 48 21 27 47 21 26 283209.5027 0.0778 0.0500 ! 207. 31 22 9 30 22 8 175618.1050 -0.0137 0.0500 208. 34 22 12 33 22 11 193325.1894 0.0509 0.0500 209. 36 22 14 35 22 13 205253.2590 0.0070 0.0500 210. 37 22 15 36 22 14 211259.1454 0.0214 0.0500 211. 49 22 28 48 22 27 286554.5509 0.0556 0.0500 ! 212. 31 23 8 30 23 7 175337.2967 0.0110 0.0500 213. 34 23 11 33 23 10 192945.4039 0.0090 0.0500 214. 36 23 13 35 23 12 204792.0487 0.0058 0.0500 215. 37 23 14 36 23 13 210751.4192 -0.0114 0.0500 216.B 41 23 18 40 23 17 234866.9372 B 0.0030 0.0500 1.2E-04 234866.9528 217.B 41 23 19 40 23 18 234866.9372 B 0.0030 0.0500 1.2E-04 234866.9156 218. 49 23 27 48 23 26 284988.1611 0.0400 0.0500 219. 53 23 30 52 23 29 312952.1352 -0.0176 0.0500 220. 54 23 32 53 23 31 317676.3831 0.0762 0.0500 ! 221. 31 24 7 30 24 6 175092.9266 0.0173 0.0500 222. 34 24 10 33 24 9 192616.8000 0.0216 0.0500 223. 36 24 12 35 24 11 204394.8868 -0.0621 0.0500 224. 37 24 13 36 24 12 210315.6749 0.0178 0.0500 225. 41 24 18 40 24 17 234238.1164 0.0151 0.0500 226. 49 24 26 48 24 25 283644.3258 0.1187 0.0500 ! 227. 34 25 9 33 25 8 192329.8441 -0.0134 0.0500 228. 36 25 11 35 25 10 204049.5394 -0.0313 0.0500 229. 37 25 12 36 25 11 209937.5428 0.0334 0.0500 230. 41 25 16 40 25 15 233699.3449 0.0107 0.0500 231. 49 25 24 48 25 23 282538.5572 0.0012 0.0500 232. 49 25 25 48 25 24 282537.2923 -0.0251 0.0500 233. 50 25 25 49 25 24 288813.0442 0.0413 0.0500 234. 50 25 26 49 25 25 288809.7296 -0.0317 0.0500 ! 235. 31 26 5 30 26 4 174689.4197 -0.0496 0.0500 236. 34 26 8 33 26 7 192077.4254 -0.0086 0.0500 237. 36 26 10 35 26 9 203746.6018 -0.0220 0.0500 238. 37 26 11 36 26 10 209606.3581 -0.0476 0.0500 239. 41 26 15 40 26 14 233232.1125 0.0234 0.0500 240. 54 26 29 53 26 28 312977.7221 -0.0140 0.0500 ! 241. 31 27 4 30 27 3 174521.5542 0.0453 0.0500 242. 36 27 9 35 27 8 203478.8893 -0.0854 0.0500 243. 37 27 10 36 27 9 209314.2394 -0.0469 0.0500 244. 41 27 14 40 27 13 232822.8414 -0.0490 0.0500 245.B 50 27 23 49 27 22 286949.0641 B 0.0423 0.0500 1.0E-04 286949.0350 246.B 50 27 24 49 27 23 286949.0641 B 0.0423 0.0500 1.0E-04 286949.0087 ! 247. 37 28 9 36 28 8 209054.9055 0.0329 0.0500 248. 41 28 13 40 28 12 232461.6088 -0.0010 0.0500 249. 50 28 23 49 28 22 286217.6032 0.0289 0.0500 ! 250. 31 29 2 30 29 1 174237.1329 0.0277 0.0500 251. 33 29 4 32 29 3 185718.6953 -0.0096 0.0500 252. 36 29 7 35 29 6 203028.3663 0.0447 0.0500 253. 37 29 8 36 29 7 208823.1618 -0.0209 0.0500 254. 38 29 9 37 29 8 214631.2812 -0.0316 0.0500 255. 41 29 12 40 29 11 232140.4984 0.0635 0.0500 256. 50 29 21 49 29 20 285581.0033 -0.0155 0.0500 ! 257. 36 30 6 35 30 5 202837.2504 0.0094 0.0500 258. 37 30 7 36 30 6 208615.1938 -0.0084 0.0500 259. 38 30 8 37 30 7 214405.3057 -0.0299 0.0500 ! 260. 33 31 2 32 31 1 185439.9605 -0.0478 0.0500 261. 35 31 4 34 31 3 196912.8160 -0.0308 0.0500 262. 38 31 7 37 31 6 214201.6728 -0.0231 0.0500 263. 50 31 19 49 31 18 284524.4156 -0.0190 0.0500 264. 55 31 24 54 31 23 314538.9336 0.0191 0.0500 ! 265. 35 32 3 34 32 2 196769.4286 -0.0406 0.0500 266. 37 32 5 36 32 4 208257.8189 -0.0159 0.0500 267. 38 32 6 37 32 5 214017.4743 0.0652 0.0500 ! 268. 38 33 5 37 33 4 213849.9981 0.0037 0.0500 269. 50 33 17 49 33 16 283681.7173 0.0548 0.0500 270. 51 33 18 50 33 17 289585.8419 -0.0381 0.0500 271. 55 33 22 54 33 21 313362.4347 -0.0356 0.0500 ! 272. 38 34 4 37 34 3 213697.4129 0.0418 0.0500 273. 55 34 21 54 34 20 312865.1610 -0.0322 0.0500 ! 274. 38 35 3 37 35 2 213557.8380 0.0576 0.0500 275. 51 35 16 50 35 15 288851.9069 -0.0507 0.0500 ! 276. 50 36 14 49 36 13 282695.4275 0.0165 0.0500 277. 51 36 15 50 36 14 288533.9838 -0.0446 0.0500 ! 278. 50 37 13 49 37 12 282422.5267 0.1199 0.0500 279. 51 37 14 50 37 13 288243.3838 0.0348 0.0500 280. 56 37 19 55 37 18 317516.7925 0.0193 0.0500 ! 281. 56 38 18 55 38 17 317157.0292 0.0126 0.0500 ! 282. 51 39 12 50 39 11 287731.2242 -0.0282 0.0500 ! ! resolved quartets (bR+aR+aR+bR) ! 283. 32 8 24 31 9 23 173885.6530 0.0081 0.0500 284. 32 9 24 31 9 23 173889.8320 0.0860 0.0500 285. 32 8 24 31 8 23 173896.0760 0.0507 0.0500 286. 32 9 24 31 8 23 173900.0480 -0.0785 0.0500 287. 33 8 25 32 9 24 178361.5698 0.0386 0.0500 288. 33 9 25 32 9 24 178363.1721 0.0501 0.0500 289. 33 8 25 32 8 24 178365.5917 -0.0406 0.0500 290. 33 9 25 32 8 24 178367.2024 -0.0208 0.0500 291. 36 11 25 35 12 24 202658.7320 0.0066 0.0500 292. 36 12 25 35 12 24 202823.5160 -0.0314 0.0500 293. 36 11 25 35 11 24 203024.5370 -0.0358 0.0500 294. 37 10 27 36 11 26 203472.9570 0.0143 0.0500 295. 37 11 27 36 11 26 203479.7080 0.0479 0.0500 296. 37 10 27 36 10 26 203489.2910 -0.0788 0.0500 297. 37 11 27 36 10 26 203496.0880 0.0008 0.0500 298.B 38 9 29 37 10 28 204327.4810 B 0.0097 0.0500 1.6E-04 204327.3811 299.B 38 10 29 37 10 28 204327.4810 B 0.0097 0.0500 1.4E-04 204327.5730 300.B 38 9 29 37 9 28 204328.0011 B 0.0132 0.0500 1.4E-04 204327.8862 301.B 38 10 29 37 9 28 204328.0011 B 0.0132 0.0500 1.6E-04 204328.0780 302.B 43 12 32 42 12 31 233859.3374 B -0.0749 0.0500 1.8E-04 233859.5806 303.B 43 11 32 42 12 31 233859.3374 B -0.0749 0.0500 1.8E-04 233859.2439 304.B 43 11 32 42 11 31 233860.3382 B 0.0677 0.0500 1.8E-04 233860.1021 305.B 43 12 32 42 11 31 233860.3382 B 0.0677 0.0500 1.8E-04 233860.4388 ! ! bR ! ! 306. 17 17 1 16 16 0 172427.2210 0.0455 0.0500 307. 19 19 1 18 18 0 192978.7980 0.0172 0.0500 308. 20 20 1 19 19 0 203253.5600 0.0032 0.0500 309. 21 21 1 20 20 0 213527.5920 -0.0079 0.0500 310. 23 23 1 22 22 0 234073.3850 0.0434 0.0500 311.? 28 28 1 27 27 0 285422.4675 0.1506 0.0500 >3*Err ! 312. 18 17 2 17 16 1 178039.5943 0.0106 0.0500 313. 21 20 2 20 19 1 208864.4760 -0.0053 0.0500 ! 314. 18 16 3 17 15 2 173373.2280 0.0322 0.0500 315. 20 18 3 19 17 2 193924.8740 -0.0043 0.0500 316. 21 19 3 20 18 2 204199.5440 0.0143 0.0500 317. 22 20 3 21 19 2 214473.3480 -0.0152 0.0500 318. 24 22 3 23 21 2 235018.4800 0.0046 0.0500 319. 29 27 3 28 26 2 286364.9536 -0.0015 0.0500 320. 32 30 3 31 29 2 317160.3389 -0.0050 0.0500 ! 321. 22 19 4 21 18 3 209805.4680 0.0368 0.0500 322. 32 29 4 31 28 3 312497.1116 -0.0114 0.0500 ! 323. 19 15 5 18 14 4 174298.0553 -0.0006 0.0500 324. 21 17 5 20 16 4 194855.0693 0.0250 0.0500 325. 22 18 5 21 17 4 205131.4702 0.0205 0.0500 326. 30 26 5 29 25 4 287300.8503 0.0200 0.0500 ! 327. 23 18 6 22 17 5 210725.1780 -0.0149 0.0500 328. 30 25 6 29 24 5 282630.4603 0.0026 0.0500 329. 33 28 6 32 27 5 313427.4294 -0.0155 0.0500 330. 33 29 4 32 28 5 318095.3254 -0.0439 0.0500 ! 331.B 20 14 7 19 13 6 175166.6129 B 0.0595 0.0500 1.1E-04 175166.5140 332.B 20 14 6 19 13 7 175166.6129 B 0.0595 0.0500 1.1E-04 175166.5929 333. 21 15 7 20 14 6 185458.1490 0.0162 0.0500 334. 22 16 7 21 15 6 195745.3679 0.0205 0.0500 335. 23 17 7 22 16 6 206029.1448 0.0193 0.0500 336. 31 25 7 30 24 6 288222.6394 -0.0219 0.0500 ! 337. 24 17 8 23 16 7 211598.6190 0.0304 0.0500 338. 26 19 8 25 18 7 232166.0899 -0.0574 0.0500 339. 31 24 8 30 23 7 283540.2806 -0.0107 0.0500 ! 340.B 23 15 9 22 14 8 196548.9613 B -0.0102 0.0500 1.3E-04 196548.8288 341.B 23 15 8 22 14 9 196548.9613 B -0.0102 0.0500 1.3E-04 196549.1141 342.B 24 16 9 23 15 8 206854.6757 B -0.0012 0.0500 1.5E-04 206854.6500 343.B 24 16 8 23 15 9 206854.6757 B -0.0012 0.0500 1.5E-04 206854.7038 344. 32 24 9 31 23 8 289119.2500 -0.0213 0.0500 ! 345. 21 13 8 20 12 9 175905.3883 0.0032 0.0500 346.B 25 16 10 24 15 9 212378.2561 B 0.0339 0.0500 1.5E-04 212378.1108 347.B 25 16 9 24 15 10 212378.2561 B 0.0339 0.0500 1.5E-04 212378.3335 348. 27 18 10 26 17 9 232989.0391 0.0132 0.0500 349. 32 23 10 31 22 9 284415.3613 0.0046 0.0500 350. 35 26 10 34 25 9 315231.7041 -0.0135 0.0500 ! 351. 21 12 9 20 11 10 171016.5443 0.0117 0.0500 352. 22 12 11 21 11 10 176159.5500 0.0026 0.0500 353. 25 15 11 24 14 10 207530.3639 -0.0699 0.0500 ! 354. 22 12 10 21 11 11 176456.6646 0.0203 0.0500 355. 25 15 10 24 14 11 207534.4335 0.0165 0.0500 356. 25 14 12 24 13 11 202533.1780 0.0603 0.0500 357. 26 15 12 25 14 11 212960.7090 -0.0062 0.0500 358. 33 22 12 32 21 11 285232.1324 0.0004 0.0500 ! 359. 22 11 11 21 10 12 172141.3924 0.0389 0.0500 360. 24 12 13 23 11 12 185677.1396 -0.0275 0.0500 361. 24 13 11 23 12 12 192209.7542 0.0296 0.0500 362. 25 14 11 24 13 12 202588.4870 -0.0959 0.0500 363. 26 15 11 25 14 12 212973.8666 -0.0073 0.0500 364. 26 14 13 25 13 12 207808.9637 0.0195 0.0500 365. 28 17 11 27 16 12 233686.5047 -0.1271 0.0500 ! 366. 26 14 12 25 13 13 207968.6774 0.0305 0.0500 367. 27 14 14 26 13 13 212915.7546 -0.0031 0.0500 368. 29 16 14 28 15 13 234123.9367 0.0624 0.0500 369. 37 24 14 36 23 13 316862.8940 -0.0337 0.0500 ! 370. 25 11 15 24 10 14 175665.9286 -0.0836 0.0500 371. 26 13 13 25 12 14 203182.0422 -0.0312 0.0500 372. 27 13 15 26 12 14 205738.0729 -0.0113 0.0500 373. 27 14 13 26 13 14 213343.9065 -0.0055 0.0500 374. 29 16 13 28 15 14 234153.0743 -0.0203 0.0500 ! 375. 23 9 14 22 8 15 196141.2762 0.0387 0.0500 376. 24 10 14 23 9 15 194419.1127 0.0634 0.0500 377. 25 11 14 24 10 15 195626.0490 -0.0182 0.0500 378. 26 11 16 25 10 15 175302.6669 0.0144 0.0500 379. 27 13 14 26 12 15 209065.3441 -0.0268 0.0500 380. 28 13 16 27 12 15 208663.2808 0.0042 0.0500 381. 30 15 16 29 14 15 233656.3345 -0.0114 0.0500 382. 35 20 16 34 19 15 286507.0029 -0.0022 0.0500 383. 38 23 16 37 22 15 317543.1680 -0.0531 0.0500 ! 384. 27 11 17 26 10 16 174523.2066 0.0127 0.0500 385. 27 12 15 26 11 16 209433.3734 0.0076 0.0500 386. 28 12 17 27 11 16 192581.6866 -0.0265 0.0500 387. 29 13 17 28 12 16 210131.5497 -0.0466 0.0500 388. 30 15 15 29 14 16 234437.8982 -0.0282 0.0500 389. 35 20 15 34 19 16 286507.8941 0.0710 0.0500 390.B 38 22 17 37 21 16 312651.1226 B -0.0234 0.0500 2.8E-04 312651.0817 391.B 38 22 16 37 21 17 312651.1226 B -0.0234 0.0500 2.8E-04 312651.2102 ! 392. 28 11 18 27 10 17 174045.4753 0.0100 0.0500 393. 30 13 18 29 12 17 210080.4997 -0.0045 0.0500 394. 36 19 18 35 18 17 286753.5749 -0.0089 0.0500 ! 395. 29 11 19 28 10 18 174483.6022 0.0497 0.0500 396. 30 13 17 29 12 18 233308.7043 0.0197 0.0500 397. 36 19 17 35 18 18 286783.7286 -0.0388 0.0500 398. 39 21 19 38 20 18 312998.1063 -0.0499 0.0500 ! 399. 31 11 20 30 12 19 173862.9299 0.0314 0.0500 400. 32 13 20 31 12 19 207258.5637 0.0026 0.0500 401. 39 21 18 38 20 19 313003.4800 0.0027 0.0500 ! 402. 33 13 21 32 12 20 205976.0086 0.1123 0.0500 403. 37 18 19 36 17 20 286785.6623 -0.0105 0.0500 404. 40 20 21 39 19 20 312846.8072 0.0473 0.0500 ! 405. 31 9 22 30 10 21 172998.7865 0.0405 0.0500 406. 31 10 22 30 9 21 173383.2637 -0.0348 0.0500 407. 33 12 22 32 11 21 192585.5689 -0.0055 0.0500 408. 34 13 22 33 12 21 205721.2837 0.0190 0.0500 409. 35 13 22 34 14 21 192509.2103 0.0172 0.0500 410. 40 20 20 39 19 21 312993.8811 -0.0125 0.0500 411. 41 20 22 40 19 21 317805.6288 0.0787 0.0500 ! 412. 32 9 23 31 10 22 177508.5227 0.0185 0.0500 413. 32 10 23 31 9 22 177675.3267 0.0333 0.0500 414. 33 10 23 32 11 22 185536.9750 0.0210 0.0500 415. 34 11 23 33 12 22 193145.5435 0.0122 0.0500 416. 34 12 23 33 11 22 195558.8511 -0.0185 0.0500 417. 35 13 23 34 12 22 206811.9435 0.0007 0.0500 418. 38 15 23 37 16 22 193675.1641 -0.0400 0.0500 419. 36 13 24 35 12 23 209134.2149 -0.1018 0.0500 420. 36 12 24 35 13 23 205287.2193 0.0117 0.0500 421. 38 14 24 37 15 23 211905.1999 0.0125 0.0500 ! 422. 35 11 25 34 10 24 194698.3926 -0.0055 0.0500 423. 36 12 25 35 11 24 203189.3758 -0.0190 0.0500 424. 37 13 25 36 12 24 212344.8021 0.0395 0.0500 425. 42 17 25 41 18 24 204434.1969 0.0593 0.0500 ! 426.B 33 7 26 32 8 25 174823.0744 B 0.0429 0.0500 1.3E-04 174822.8499 427.B 33 8 26 32 7 25 174823.0744 B 0.0429 0.0500 1.3E-04 174823.2131 428. 37 11 26 36 12 25 207163.4683 -0.0394 0.0500 ! 429. 36 10 27 35 9 26 195379.6260 0.0111 0.0500 430. 36 9 27 35 10 26 195374.9604 0.0005 0.0500 431. 38 11 27 37 12 26 211618.8487 0.0072 0.0500 432. 38 12 27 37 11 26 211722.0405 0.0006 0.0500 ! 433. 38 11 28 37 10 27 207936.6650 -0.0686 0.0500 434. 38 10 28 37 11 27 207927.3073 -0.0115 0.0500 435. 41 13 28 40 14 27 232344.6551 0.0956 0.0500 436. 41 14 28 40 13 27 233045.1557 -0.0070 0.0500 ! 437. 37 8 29 36 9 28 196309.1749 0.0626 0.0500 438. 39 10 29 38 11 28 212387.7573 -0.0380 0.0500 439. 39 11 29 38 10 28 212391.5482 -0.0100 0.0500 ! 440. 37 7 30 36 8 29 192827.9176 -0.0034 0.0500 441.B 39 10 30 38 9 29 208810.9271 B 0.0267 0.0500 1.7E-04 208811.0322 442.B 39 9 30 38 10 29 208810.9271 B 0.0267 0.0500 1.7E-04 208810.7684 443. 42 12 30 41 13 29 233091.8565 0.0045 0.0500 444. 42 13 30 41 12 29 233126.2597 0.0375 0.0500 ! 445. 48 18 31 47 17 30 284430.7957 0.0483 0.0500 ! 446. 49 18 32 48 17 31 286374.5834 -0.0279 0.0500 ! 447. 50 18 33 49 17 32 289318.2352 -0.0118 0.0500 448. 50 17 33 49 18 32 287026.1273 0.0057 0.0500 ! 449. 50 16 34 49 17 33 283621.6492 0.0297 0.0500 450. 50 17 34 49 16 33 283946.2357 0.1255 0.0500 ! 451. 51 16 35 50 17 34 288016.9279 -0.0049 0.0500 452. 51 17 35 50 16 34 288164.9965 -0.0171 0.0500 ! 453. 51 16 36 50 15 35 284173.6066 0.0050 0.0500 454. 51 15 36 50 16 35 284157.4769 0.0558 0.0500 ! 455. 52 16 37 51 15 36 288571.7352 -0.0126 0.0500 456. 52 15 37 51 16 36 288564.9124 0.0191 0.0500 457. 55 18 37 54 19 36 313335.6998 0.0174 0.0500 ! 458. 56 18 38 55 19 37 317713.4604 0.0753 0.0500 ! 459.B 53 14 39 52 15 38 289303.9616 B -0.0038 0.0500 2.1E-04 289303.8446 460.B 53 15 39 52 14 38 289303.9616 B -0.0038 0.0500 2.1E-04 289304.0862 ! ! bR-1,3 ! 461. 42 18 25 41 19 22 173641.8090 -0.0621 0.0500 462. 46 22 25 45 23 22 172668.3529 0.0237 0.0500 463. 48 24 25 47 25 22 172361.7573 0.0501 0.0500 ! 464. 49 21 29 48 22 26 204437.4445 -0.0356 0.0500 465. 50 22 29 49 23 26 204182.2903 -0.0418 0.0500 466. 51 23 29 50 24 26 203431.5202 -0.0223 0.0500 ! ! bQ ! 467. 54 3 51 54 2 52 172412.3280 0.0215 0.0500 468. 55 3 52 55 2 53 175811.8473 0.0550 0.0500 469. 60 3 57 60 2 58 192823.3817 0.0469 0.0500 470. 61 3 58 61 2 59 196228.7086 0.0645 0.0500 471. 63 3 60 63 2 61 203042.5041 0.0484 0.0500 472. 64 3 61 64 2 62 206451.0456 0.0422 0.0500 473. 63 3 61 63 2 62 207130.4439 -0.0004 0.0500 ! 474. 55 4 51 55 3 52 171713.3044 -0.0226 0.0500 475. 56 4 52 56 3 53 175112.1269 -0.0219 0.0500 476. 59 4 55 59 3 56 185313.2445 0.0147 0.0500 477. 62 4 58 62 3 59 195521.9470 0.0485 0.0500 478. 66 4 62 66 3 63 209146.6160 0.0134 0.0500 479. 67 4 63 67 3 64 212555.2640 -0.0379 0.0500 ! 480. 58 5 53 58 4 54 177771.8659 -0.0166 0.0500 481. 61 5 57 61 4 58 192118.0702 -0.0458 0.0500 482. 63 5 58 63 4 59 194779.2000 -0.0753 0.0500 483. 66 5 61 66 4 62 204992.7161 -0.0202 0.0500 484. 67 5 62 67 4 63 208398.9150 -0.0107 0.0500 485. 68 5 63 68 4 64 211805.9866 -0.0298 0.0500 ! 486. 59 6 53 59 5 54 176990.4865 -0.0078 0.0500 487. 63 6 58 63 5 59 194779.2034 -0.0720 0.0500 488. 66 6 61 66 5 62 204992.7175 -0.0189 0.0500 489. 67 6 61 67 5 62 204210.7853 -0.0021 0.0500 490. 68 6 63 68 5 64 211805.9866 -0.0298 0.0500 491. 70 6 64 70 5 65 214428.9395 -0.0088 0.0500 ! 492. 58 7 52 58 6 53 173590.0456 -0.0168 0.0500 493. 59 7 52 59 6 53 172762.8916 0.0197 0.0500 494. 65 7 58 65 6 59 193179.0187 -0.0692 0.0500 495. 66 7 59 66 6 60 196582.7130 -0.0342 0.0500 496. 67 7 61 67 6 62 204210.7853 -0.0021 0.0500 497. 68 7 61 68 6 62 203391.3253 -0.0424 0.0500 498. 69 7 62 69 6 63 206796.3845 -0.0383 0.0500 499. 69 7 63 69 6 64 211022.0623 -0.0668 0.0500 500. 70 7 64 70 6 65 214428.9395 -0.0088 0.0500 501. 77 7 70 77 6 71 234060.1184 -0.0320 0.0500 ! 502. 61 8 53 61 7 54 175293.4097 0.0055 0.0500 503. 64 8 56 64 7 57 185508.0182 -0.0464 0.0500 504. 66 8 58 66 7 59 192317.5493 0.0249 0.0500 505. 67 8 59 67 7 60 195722.4352 0.0610 0.0500 506. 70 8 63 70 7 64 210201.9841 -0.0493 0.0500 507. 78 8 70 78 7 71 233198.5006 0.0855 0.0500 ! 508. 62 9 53 62 8 54 174372.3111 -0.0269 0.0500 509. 63 9 54 63 8 55 177781.2240 -0.0272 0.0500 510. 68 9 59 68 8 60 194819.0047 0.0010 0.0500 511. 71 9 62 71 8 63 205039.3830 0.0172 0.0500 512. 73 9 64 73 8 65 211853.2111 -0.0068 0.0500 ! 513. 63 10 53 63 9 54 173398.8576 -0.0710 0.0500 514. 64 10 54 64 9 55 176813.0388 -0.0056 0.0500 515. 68 10 59 68 9 60 194819.0047 0.0010 0.0500 516. 69 10 59 69 9 60 193870.3243 0.0134 0.0500 517. 72 10 62 72 9 63 204098.0644 0.0604 0.0500 518. 73 10 63 73 9 64 207506.6932 0.0094 0.0500 519. 75 10 65 75 9 66 214323.6898 0.0043 0.0500 ! 520. 63 11 53 63 10 54 173398.8576 -0.0710 0.0500 521. 64 11 53 64 10 54 172369.8011 -0.0065 0.0500 522. 64 11 54 64 10 55 176813.0388 -0.0056 0.0500 523. 65 11 54 65 10 55 175790.6293 -0.0078 0.0500 524. 70 11 59 70 10 60 192873.8043 0.0327 0.0500 525. 71 11 60 71 10 61 196287.2386 0.0356 0.0500 526. 73 11 62 73 10 63 203111.8813 0.0356 0.0500 527. 73 11 63 73 10 64 207506.6927 0.0089 0.0500 528. 75 11 65 75 10 66 214323.6898 0.0043 0.0500 ! 529. 65 12 53 65 11 54 171281.3407 0.0877 0.0500 530. 66 12 54 66 11 55 174710.5556 0.0512 0.0500 531. 67 12 55 67 11 56 178137.4874 0.0055 0.0500 532. 71 12 60 71 11 61 196287.2386 0.0356 0.0500 533. 72 12 60 72 11 61 195245.0824 -0.0195 0.0500 534. 75 12 63 75 11 64 205493.6789 0.0215 0.0500 535. 77 12 65 77 11 66 212321.5291 -0.0184 0.0500 ! 536. 65 13 53 65 12 54 171281.3407 0.0877 0.0500 537. 68 13 55 68 12 56 177005.3085 0.0151 0.0500 538. 76 13 64 76 12 65 208907.9976 0.0217 0.0500 539. 77 13 65 77 12 66 212321.5291 -0.0184 0.0500 540. 79 13 66 79 12 67 214668.2083 -0.0559 0.0500 ! 541. 68 14 54 68 13 55 172360.9233 -0.0834 0.0500 542. 68 14 55 68 13 56 177005.3085 0.0151 0.0500 543. 69 14 55 69 13 56 175809.1312 -0.0599 0.0500 544. 73 14 60 73 13 61 194150.7740 0.0419 0.0500 545. 74 14 60 74 13 61 193001.0035 0.0506 0.0500 546. 75 14 61 75 13 62 196431.3803 0.0969 0.0500 547. 77 14 63 77 13 64 203285.6721 0.0324 0.0500 548. 78 14 64 78 13 65 206709.9040 -0.1202 0.0500 549. 79 14 66 79 13 67 214668.2083 -0.0559 0.0500 ! 550. 69 15 54 69 14 55 171082.4293 -0.0022 0.0500 551. 70 15 55 70 14 56 174544.6027 0.0011 0.0500 552. 71 15 56 71 14 57 178002.1269 0.0422 0.0500 553. 75 15 61 75 14 62 196431.3803 0.0969 0.0500 554. 76 15 61 76 14 62 195231.5364 0.0665 0.0500 555. 78 15 64 78 14 65 206709.9040 -0.1202 0.0500 556. 79 15 64 79 14 65 205532.8678 0.0087 0.0500 557. 79 15 65 79 14 66 210132.8402 0.0757 0.0500 558. 80 15 65 80 14 66 208961.9844 -0.0103 0.0500 559. 80 15 66 80 14 67 213554.0238 0.0136 0.0500 ! 560. 70 16 55 70 15 56 174544.6027 0.0011 0.0500 561. 71 16 55 71 15 56 173206.3472 -0.0447 0.0500 562. 72 16 56 72 15 57 176679.3160 -0.0232 0.0500 563. 80 16 64 80 15 65 204299.4482 -0.0611 0.0500 ! 564. 72 17 55 72 16 56 171788.6967 -0.0662 0.0500 565. 73 17 56 73 16 57 175279.9814 -0.0746 0.0500 566. 72 17 56 72 16 57 176679.3160 -0.0232 0.0500 567. 76 17 59 76 16 60 185715.4123 -0.0393 0.0500 568. 78 17 61 78 16 62 192645.2000 0.0785 0.0500 569. 77 17 61 77 16 62 193970.6494 -0.1027 0.0500 570. 81 17 64 81 16 65 203006.5159 -0.0400 0.0500 571. 81 17 65 81 16 66 207736.5167 0.0827 0.0500 572. 83 17 66 83 16 67 209895.8275 0.0309 0.0500 573. 82 17 66 82 16 67 211170.7342 -0.0080 0.0500 ! 574. 42 38 4 42 37 5 174199.5174 0.0305 0.0500 575. 43 38 5 43 37 6 174041.8300 -0.0361 0.0500 576. 44 38 6 44 37 7 173872.8009 -0.0443 0.0500 577. 45 38 7 45 37 8 173691.8292 -0.0097 0.0500 578. 46 38 8 46 37 9 173498.2434 0.0054 0.0500 579. 48 38 10 48 37 11 173070.5831 -0.1012 0.0500 580. 50 38 12 50 37 13 172584.7686 0.0038 0.0500 581. 51 38 13 51 37 14 172318.0599 -0.0279 0.0500 582. 52 38 14 52 37 15 172034.5584 0.0056 0.0500 583. 53 38 15 53 37 16 171733.3862 0.0599 0.0500 584. 54 38 16 54 37 17 171413.5523 0.0213 0.0500 585. 55 38 17 55 37 18 171074.2098 -0.0332 0.0500 ! 586. 49 39 10 49 38 11 177749.7052 0.0267 0.0500 587. 50 39 11 50 38 12 177518.9262 0.0043 0.0500 588. 51 39 12 51 38 13 177273.4705 -0.0318 0.0500 589. 52 39 13 52 38 14 177012.6792 -0.0356 0.0500 590. 54 39 15 54 38 16 176442.0130 -0.0359 0.0500 591. 55 39 16 55 38 17 176130.6431 0.0576 0.0500 592. 56 39 17 56 38 18 175800.6476 0.0698 0.0500 593. 57 39 18 57 38 19 175451.2052 0.0782 0.0500 594. 58 39 19 58 38 20 175081.2834 -0.0019 0.0500 595. 60 39 21 60 38 22 174276.4353 0.0752 0.0500 596. 61 39 22 61 38 23 173839.0375 -0.0514 0.0500 597. 62 39 23 62 38 24 173377.0462 0.0081 0.0500 598. 63 39 24 63 38 25 172889.0392 0.1093 0.0500 599. 64 39 25 64 38 26 172373.3663 -0.0326 0.0500 600. 65 39 26 65 38 27 171828.9230 -0.0587 0.0500 ! 601. 65 40 25 65 39 26 177204.8383 -0.0746 0.0500 602. 68 40 28 68 39 29 175545.7354 -0.0206 0.0500 603. 70 40 30 70 39 31 174283.7419 -0.0385 0.0500 604. 71 40 31 71 39 32 173600.7253 -0.0003 0.0500 605. 72 40 32 72 39 33 172880.1819 -0.0684 0.0500 ! 606. 58 41 17 58 40 18 185239.7090 0.0388 0.0500 607. 74 41 33 74 40 34 177146.8164 -0.0152 0.0500 608. 75 41 34 75 40 35 176382.5089 0.0142 0.0500 ! 609. 45 42 3 45 41 4 192990.1064 -0.0234 0.0500 610. 46 42 4 46 41 5 192847.8484 -0.0592 0.0500 611. 47 42 5 47 41 6 192696.1284 -0.0416 0.0500 612. 50 42 8 50 41 9 192179.3679 0.0387 0.0500 ! 613. 51 43 8 51 42 9 196847.5264 0.0246 0.0500 614. 52 43 9 52 42 10 196655.7144 -0.0290 0.0500 615. 53 43 10 53 42 11 196452.5354 0.0428 0.0500 616. 54 43 11 54 42 12 196237.2791 0.0322 0.0500 617. 55 43 12 55 42 13 196009.4642 -0.0212 0.0500 618. 56 43 13 56 42 14 195768.6144 -0.0520 0.0500 619. 57 43 14 57 42 15 195514.2110 -0.0163 0.0500 620. 58 43 15 58 42 16 195245.6115 0.0296 0.0500 621. 59 43 16 59 42 17 194962.2234 0.1041 0.0500 622. 60 43 17 60 42 18 194663.2255 0.0230 0.0500 623. 61 43 18 61 42 19 194348.1693 0.0036 0.0500 624. 62 43 19 62 42 20 194016.2894 -0.0232 0.0500 625. 63 43 20 63 42 21 193666.8938 -0.0201 0.0500 626. 65 43 22 65 42 23 192912.4386 0.0588 0.0500 ! 627. 68 44 24 68 43 25 196852.4030 0.0066 0.0500 628. 69 44 25 69 43 26 196416.4510 -0.0382 0.0500 629. 70 44 26 70 43 27 195958.9490 -0.0248 0.0500 630. 71 44 27 71 43 28 195478.9208 0.0362 0.0500 ! 631. 48 45 3 48 44 4 206969.7483 0.1209 0.0500 632. 50 45 5 50 44 6 206682.0221 -0.0743 0.0500 633. 51 45 6 51 44 7 206524.8580 -0.0302 0.0500 634. 52 45 7 52 44 8 206358.2137 0.0138 0.0500 635. 53 45 8 53 44 9 206181.6869 0.0598 0.0500 636. 54 45 9 54 44 10 205994.6764 -0.0751 0.0500 637. 56 45 11 56 44 12 205588.4205 0.0712 0.0500 638. 57 45 12 57 44 13 205367.9767 0.0642 0.0500 639. 59 45 14 59 44 15 204890.1302 -0.0388 0.0500 640. 78 45 33 78 44 34 196988.9308 0.0022 0.0500 641. 80 45 35 80 44 36 195668.5127 0.0682 0.0500 ! 642. 52 46 6 52 45 7 211187.3704 0.0107 0.0500 643. 54 46 8 54 45 9 210847.6107 -0.0367 0.0500 644. 60 46 14 60 45 15 209575.3590 -0.0048 0.0500 645. 63 46 17 63 45 18 208774.4800 -0.0591 0.0500 646. 64 46 18 64 45 19 208479.8345 -0.0246 0.0500 647. 70 46 24 70 45 25 206379.4605 -0.0056 0.0500 648. 72 46 26 72 45 27 205536.6579 -0.0381 0.0500 ------------------------------------------------------------------------------------------------------ Sigma = 0.043217 629 Distinct lines in fit Sigma.w = 0.864336 608 Degrees of freedom A /MHz 5140.84473(43) LJK /mHz -0.00209(18) B /MHz 3251.50056(25) LKKJ/mHz 0.00638(55) C /MHz 2262.83345(27) LK /mHz -0.00419(39) DJ /kHz 1.49316(12) lJ /mHz 0.0 DJK /kHz -2.61330(33) lJK /mHz -0.000198(31) DK /kHz 2.65116(81) lKJ /mHz -0.000364(64) dJ /kHz 0.394867(44) lK /mHz -0.00851(42) dK /kHz 4.88081(48) PJ /microHz 0.0 HJ / Hz -0.003982(23) PJJK /microHz 0.0 HJK / Hz -0.02318(11) PJK /microHz 0.0 HKJ / Hz 0.10021(32) PKJ /microHz 0.0 HK / Hz -0.07270(59) PKKJ /microHz 0.0 hJ / Hz -0.0032051(93) PK /microHz 0.0 hJK / Hz -0.01478(22) pJ /microHz 0.0 hK / Hz -0.15162(30) pJJK /microHz 0.0 LJ /mHz 0.0 pJK /microHz 0.0 LJJK/mHz 0.0 pKKJ /microHz 0.0 pK /microHz 0.0 CORRELATION COEFFICIENTS, C.ij: A B C DJ DJK DK dJ dK A 1.0000 B 0.3219 1.0000 C -0.1053 0.5291 1.0000 DJ 0.0332 0.8862 0.7630 1.0000 DJK 0.4535 0.0877 0.2748 -0.0058 1.0000 DK 0.6693 -0.0179 -0.4211 -0.2417 -0.1960 1.0000 dJ 0.2796 0.6988 -0.1490 0.4878 -0.2302 0.2039 1.0000 dK -0.1024 0.0610 -0.3629 0.0056 -0.3686 -0.0086 0.3849 1.0000 HJ 0.0189 0.8106 0.5585 0.9324 -0.1943 -0.1539 0.6252 0.1370 HJK 0.1142 0.1468 0.4005 0.1801 0.6800 -0.3874 -0.2070 -0.2906 HKJ 0.3085 0.1411 -0.0088 0.0378 0.3101 0.1167 0.1569 0.0067 HK 0.4721 -0.0460 -0.2719 -0.1973 -0.2362 0.8484 0.0584 -0.1242 hJ 0.1584 0.6961 0.0505 0.6300 -0.2918 0.0884 0.9212 0.3069 hJK -0.0932 -0.0664 -0.4570 -0.1450 -0.3904 0.0632 0.2915 0.9484 hK -0.2371 -0.3381 -0.1095 -0.1893 -0.1867 -0.1830 -0.2797 0.1596 LJK 0.0346 0.3341 0.0152 0.4050 -0.4133 0.1237 0.5124 0.1813 LKKJ -0.0836 -0.3977 -0.0748 -0.4647 0.2990 -0.0779 -0.5409 -0.1638 LK -0.0820 0.3751 0.1497 0.4915 -0.2155 -0.2079 0.4805 0.2012 lJK 0.0865 0.3189 0.4900 0.4349 0.2411 -0.1257 0.0371 -0.6536 lKJ 0.1695 0.3575 0.1231 0.2520 0.0938 0.1065 0.3579 -0.0495 lK 0.0718 0.4267 0.1377 0.4995 -0.2339 0.0223 0.5098 0.1119 HJ HJK HKJ HK hJ hJK hK LJK HJ 1.0000 HJK 0.0037 1.0000 HKJ 0.0199 -0.3979 1.0000 HK -0.1592 -0.1036 -0.3682 1.0000 hJ 0.8144 -0.2030 0.0966 -0.0207 1.0000 hJK -0.0141 -0.2864 -0.1108 0.0060 0.1991 1.0000 hK -0.0520 0.1479 -0.4063 -0.1075 -0.1210 0.1266 1.0000 LJK 0.6513 -0.2069 -0.1133 0.0808 0.6899 0.0631 0.3097 1.0000 LKKJ -0.6960 0.1581 -0.0083 0.0181 -0.7212 -0.0200 -0.2804 -0.9851 LK 0.7015 -0.0827 0.0723 -0.3305 0.6809 0.0318 0.3492 0.9039 lJK 0.4093 0.3547 -0.0216 -0.0610 0.1886 -0.8093 0.0871 0.4447 lKJ 0.1869 -0.2606 0.4496 -0.0198 0.3053 0.0021 -0.8112 -0.3251 lK 0.6915 0.0384 -0.1665 0.0337 0.6731 -0.0235 0.2654 0.9599 LKKJ LK lJK lKJ lK LKKJ 1.0000 LK -0.9463 1.0000 lJK -0.4923 0.4765 1.0000 lKJ 0.2774 -0.2899 -0.2627 1.0000 lK -0.9632 0.9004 0.5692 -0.3597 1.0000 Mean value of |C.ij|, i.ne.j = 0.2957 Mean value of C.ij, i.ne.j = 0.0796 Distribution of values of |C.ij|, i.ne.j: 10 20 30 40 50 60 ....,....|....,....|....,....|....,....|....,....|....,....|....,.. 30 <0.05 ****************************** 23 <0.10 *********************** 25 <0.15 ************************* 20 <0.20 ******************** 13 <0.25 ************* 16 <0.30 **************** 12 <0.35 ************ 13 <0.40 ************* 10 <0.45 ********** 11 <0.50 *********** 4 <0.55 **** 2 <0.60 ** 2 <0.65 ** 11 <0.70 *********** 2 <0.75 ** 1 <0.80 * 5 <0.85 ***** 1 <0.90 * 6 <0.95 ****** 3 <1.00 *** _______________________________________________________________________________ There are no influential transitions with hjj > 0.500 mean of all values = 0.0328 WORST FITTING LINES (line number=(o-c)/error): 179= -3.3 115= 3.1 311= 3.0 59= 2.6 40= -2.6 365= -2.5 450= 2.5 _______________________________________________________________________________