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Table E.1

Line list of the observed CHD2OCHO transitions used in the fit.

Transition J(Ka,   Kc) – ν (GHz) gu Eu (K) Aul (s−1)
30(5,26) o− – 29(5,25) o−a 332.0340 61 266 5.305 × 10−4
30(5,26) o+ – 29(5,25) o+ 332.0340 61 266 5.305 × 10−4
31(3,28) o− – 30(3,27) o− 333.1965 63 273 5.405 × 10−4
31(3,28) o+ – 30(3,27) o+ 333.1966 63 273 5.404 × 10−4
30(4,26) o+ – 29(4,25) o+ 333.8572 61 266 5.397 × 10−4
30(4,26) o− – 29(4,25) o− 333.8574 61 266 5.397 × 10−4
32(3,30) o− – 31(3,29) o− 333.9611 65 278 5.490 × 10−4
32(3,30) o+ – 31(3,29) o+ 333.9613 65 278 5.490 × 10−4
33(1,32) o− – 32(2,31) o− 335.0038 67 282 1.071 × 10−4
33(2,32) o− – 32(2,31) o− 335.0039 67 282 5.594 × 10−4
33(1,32) o− – 32(1,31) o− 335.0040 67 282 5.594 × 10−4
33(1,32) o+ – 32(2,31) o+ 335.0041 67 282 1.071 × 10−4
33(2,32) o− – 32(1,31) o− 335.0041 67 282 1.071 × 10−4
33(2,32) o+ – 32(2,31) o+ 335.0042 67 282 5.594 × 10−4
33(1,32) o+ – 32(1,31) o+ 335.0042 67 282 5.594 × 10−4
33(2,32) o+ – 32(1,31) o+ 335.0043 67 282 1.071 × 10−4
32(1,31) i – 31(2,30) i 335.1566 65 288 1.168 × 10−4
32(2,31) i – 31(2,30) i 335.1567 65 288 5.492 × 10−4
32(1,31) i – 31(1,30) i 335.1567 65 288 5.492 × 10−4
32(2,31) i – 31(1,30) i 335.1567 65 288 1.168 × 10−4
34(0,34) o− – 33(1,33) o− 336.1205 69 285 1.208 × 10−4
34(1,34) o− – 33(1,33) o− 336.1205 69 285 5.704 × 10−4
34(0,34) o− – 33(0,33) o− 336.1205 69 285 5.704 × 10−4
34(1,34) o− – 33(0,33) o− 336.1205 69 285 1.208 × 10−4
34(0,34) o+ – 33(1,33) o+ 336.1205 69 285 1.208 × 10−4
34(1,34) o+ – 33(1,33) o+ 336.1205 69 285 5.704 × 10−4
34(0,34) o+ – 33(0,33) o+ 336.1205 69 285 5.704 × 10−4
34(1,34) o+ – 33(0,33) o+ 336.1205 69 285 1.208 × 10−4
33(0,33) i – 32(1,32) i 336.6965 67 292 1.312 × 10−4
33(1,33) i – 32(1,32) i 336.6965 67 292 5.629 × 10−4
33(0,33) i – 32(0,32) i 336.6965 67 292 5.629 × 10−4
33(1,33) i – 32(0,32) i 336.6965 67 292 1.312 × 10−4
30(12,19) o+ – 29(12,18) o+ 337.9397 61 339 4.885 × 10−4
30(12,18) o+ – 29(12,17) o+ 337.9397 61 339 4.885 × 10−4
30(12,19) o− – 29(12,18) o− 337.9401 61 339 4.887 × 10−4
30(12,18) o− – 29(12,17) o− 337.9402 61 339 4.885 × 10−4
30(6,25) o− – 29(6,24) o− 339.0506 61 274 5.609 × 10−4
30(6,25) o+ – 29(6,24) o+ 339.0507 61 274 5.609 × 10−4
31(5,27) o+ – 30(5,26) o+ 341.8847 63 282 5.800 × 10−4
31(5,27) o− – 30(5,26) o− 341.8848 63 282 5.800 × 10−4
32(4,29) o− – 31(4,28) o− 342.7908 65 289 5.892 × 10−4
32(4,29) o+ – 31(4,28) o+ 342.7909 65 289 5.892 × 10−4
29(6,23) o− – 28(6,22) o− 342.8648 59 261 5.838 × 10−4
29(6,23) o+ – 28(6,22) o+ 342.8651 59 261 5.838 × 10−4
32(3,29) o− – 31(3,28) o− 342.8687 65 289 5.897 × 10−4
32(3,29) o+ – 31(3,28) o+ 342.8688 65 289 5.897 × 10−4
33(2,31) o− – 32(2,30) o− 343.6912 67 295 5.991 × 10−4
33(2,31) o+ – 32(2,30) o+ 343.6914 67 295 5.991 × 10−4
32(2,30) i – 31(3,29) i 343.7220 65 300 1.123 × 10−4
32(3,30) i – 31(3,29) i 343.7228 65 300 5.868 × 10−4
32(2,30) i – 31(2,29) i 343.7235 65 300 5.868 × 10−4
32(3,30) i – 31(2,29) i 343.7244 65 300 1.123 × 10−4
34(1,33) o− – 33(2,32) o− 344.7396 69 299 1.173 × 10−4
34(2,33) o− – 33(2,32) o− 344.7396 69 299 6.101 × 10−4
34(1,33) o− – 33(1,32) o− 344.7396 69 299 6.101 × 10−4
34(2,33) o− – 33(1,32) o− 344.7397 69 299 1.173 × 10−4
34(1,33) o+ – 33(2,32) o+ 344.7398 69 299 1.173 × 10−4
34(2,33) o+ – 33(2,32) o+ 344.7398 69 299 6.101 × 10−4
34(1,33) o+ – 33(1,32) o+ 344.7399 69 299 6.101 × 10−4
34(2,33) o+ – 33(1,32) o+ 344.7399 69 299 1.173 × 10−4
33(1,32) i – 32(2,31) i 345.2040 67 305 1.283 × 10−4
33(2,32) i – 32(2,31) i 345.2040 67 305 6.006 × 10−4
33(1,32) i – 32(1,31) i 345.2040 67 305 6.006 × 10−4
33(2,32) i – 32(1,31) i 345.2041 67 305 1.283 × 10−4
35(0,35) o− – 34(1,34) o− 345.8592 71 302 1.318 × 10−4
35(1,35) o− – 34(1,34) o− 345.8592 71 302 6.218 × 10−4
35(0,35) o− – 34(0,34) o− 345.8592 71 302 6.218 × 10−4
35(1,35) o− – 34(0,34) o− 345.8592 71 302 1.318 × 10−4
35(0,35) o+ – 34(1,34) o+ 345.8592 71 302 1.318 × 10−4
35(1,35) o+ – 34(1,34) o+ 345.8592 71 302 6.218 × 10−4
35(0,35) o+ – 34(0,34) o+ 345.8592 71 302 6.218 × 10−4
35(1,35) o+ – 34(0,34) o+ 345.8592 71 302 1.318 × 10−4
34(0,34) i – 33(1,33) i 346.7478 69 309 1.435 × 10−4
34(1,34) i – 33(1,33) i 346.7478 69 309 6.151 × 10−4
34(0,34) i – 33(0,33) i 346.7478 69 309 6.151 × 10−4
34(1,34) i – 33(0,33) i 346.7478 69 309 1.435 × 10−4
31(12,20) o+ – 30(12,19) o+ 349.4138 63 356 5.468 × 10−4
31(12,19) o+ – 30(12,18) o+ 349.4139 63 356 5.468 × 10−4
31(12,20) o− – 30(12,19) o− 349.4142 63 356 5.468 × 10−4
31(12,19) o− – 30(12,18) o− 349.4143 63 356 5.468 × 10−4
32(4,28) o+ – 31(4,27) o+ 352.5493 65 299 6.371 × 10−4
32(4,28) o− – 31(4,27) o− 352.5495 65 299 6.371 × 10−4
34(3,32) o− – 33(3,31) o− 353.4151 69 312 6.520 × 10−4
34(3,32) o+ – 33(3,31) o+ 353.4153 69 312 6.520 × 10−4
35(1,34) o− – 34(2,33) o− 354.4737 71 316 1.282 × 10−4
35(2,34) o− – 34(2,33) o− 354.4737 71 316 6.638 × 10−4
35(1,34) o− – 34(1,33) o− 354.4737 71 316 6.638 × 10−4
35(2,34) o− – 34(1,33) o− 354.4738 71 316 1.282 × 10−4
35(1,34) o+ – 34(2,33) o+ 354.4739 71 316 1.282 × 10−4
35(2,34) o+ – 34(2,33) o+ 354.4740 71 316 6.637 × 10−4
35(1,34) o+ – 34(1,33) o+ 354.4740 71 316 6.637 × 10−4
35(2,34) o+ – 34(1,33) o+ 354.4740 71 316 1.282 × 10−4
30(6,24) o− – 29(6,23) o− 354.6897 61 278 6.481 × 10−4
30(6,24) o+ – 29(6,23) o+ 354.6898 61 278 6.481 × 10−4
34(1,33) i – 33(2,32) i 355.2495 69 322 1.405 × 10−4
34(2,33) i – 33(2,32) i 355.2495 69 322 6.552 × 10−4
34(1,33) i – 33(1,32) i 355.2495 69 322 6.552 × 10−4
34(2,33) i – 33(1,32) i 355.2495 69 322 1.405 × 10−4
36(0,36) o− – 35(1,35) o− 355.5962 73 319 1.435 × 10−4
36(1,36) o− – 35(1,35) o− 355.5962 73 319 6.761 × 10−4
36(0,36) o− – 35(0,35) o− 355.5962 73 319 6.761 × 10−4
36(1,36) o− – 35(0,35) o− 355.5962 73 319 1.435 × 10−4
36(0,36) o+ – 35(1,35) o+ 355.5963 73 319 1.436 × 10−4
36(1,36) o+ – 35(1,35) o+ 355.5963 73 319 6.761 × 10−4
36(0,36) o+ – 35(0,35) o+ 355.5963 73 319 6.761 × 10−4
36(1,36) o+ – 35(0,35) o+ 355.5963 73 319 1.436 × 10−4
32(12,21) o+ – 31(12,20) o+ 360.9101 65 373 6.096 × 10−4
32(12,20) o+ – 31(12,19) o+ 360.9104 65 373 6.096 × 10−4
32(12,21) o− – 31(12,20) o− 360.9104 65 373 6.096 × 10−4
32(12,20) o− – 31(12,19) o− 360.9107 65 373 6.096 × 10−4
33(5,29) o+ – 32(5,28) o+ 361.4382 67 317 6.872 × 10−4
33(5,29) o− – 32(5,28) o− 361.4383 67 317 6.872 × 10−4
34(4,31) o− – 33(4,30) o− 362.2148 69 323 6.968 × 10−4
34(4,31) o+ – 33(4,30) o+ 362.2148 69 323 6.968 × 10−4
34(3,31) o− – 33(3,30) o− 362.2450 69 323 6.971 × 10−4
34(3,31) o+ – 33(3,30) o+ 362.2450 69 323 6.971 × 10−4

Notes. (a) The CHD2 OCHO torsional pattern consists of three non-degenerate sublevels, indicated by the p quantum number. A first 10 cm−1 energy symmetry-splitting separates the i and o states, so-called “H-in-plane” and “H-out-plane”, respectively. The lower torsional level o splits again by tunneling into two sublevels, o+ and o− 10.8 MHz above the first one (for more details, see Coudert et al. 2012).

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