Content for NMR-STAR saveframe, "spectral_peak_list_7"
save_spectral_peak_list_7
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_7
_Spectral_peak_list.Entry_ID 31013
_Spectral_peak_list.ID 7
_Spectral_peak_list.Name .
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_1
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 8
_Spectral_peak_list.Experiment_name '3D H(CCO)NH'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 3
_Spectral_peak_list.Chemical_shift_list .
_Spectral_peak_list.Assigned_chem_shift_list_ID 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
label dataset sw sf
H1 C13 N15
20200515_AO11_best_trosy_hnco_S.nv
2806.52709961 3017.24291992 1945.43103027
799.963989258 201.184997559 81.0690002441
H1.L H1.P H1.W H1.B H1.E H1.J H1.U C13.L C13.P C13.W C13.B C13.E C13.J C13.U N15.L N15.P N15.W N15.B N15.E N15.J N15.U vol int stat comment flag0 flag8 flag9
0 {} 7.99628 0.02423 0.05319 ++ {0.0} {} {} 174.72964 0.33138 0.66298 ++ {0.0} {} {} 127.90855 0.49505 0.96482 ++ {0.0} {} 64.9080581665 3.2306 0 {} 0 0 0
1 {} 8.37764 0.03214 0.03704 ++ {0.0} {} {} 175.40985 0.41910 0.47292 ++ {0.0} {} {} 127.29022 0.47639 0.55752 ++ {0.0} {} 12.0819635391 0.3910 0 {} 0 0 0
2 {} 8.28345 0.02628 0.01072 ++ {0.0} {} {} 176.74155 0.31832 0.11197 ++ {0.0} {} {} 126.13216 0.52437 0.19432 ++ {0.0} {} 1.46339702606 0.1960 0 {} 0 0 0
3 {} 8.18797 0.03118 0.03099 ++ {0.0} {} {} 175.47614 0.31235 0.31048 ++ {0.0} {} {} 126.02331 0.50213 0.49919 ++ {0.0} {} 7.45958089828 0.3212 0 {} 0 0 0
4 {} 8.11496 0.02527 0.04836 ++ {0.0} {} {} 177.19591 0.35011 0.62139 ++ {0.0} {} {} 125.03186 0.49608 0.83828 ++ {0.0} {} 25.7325229645 1.1556 0 {} 0 0 0
5 {} 8.10471 0.02879 0.02216 ++ {0.0} {} {} 175.29651 0.35878 0.28000 ++ {0.0} {} {} 124.51167 0.50635 0.35317 ++ {0.0} {} 5.21619129181 0.2454 0 {} 0 0 0
6 {} 8.14748 0.03808 0.01148 ++ {0.0} {} {} 174.80379 0.38778 0.13904 ++ {0.0} {} {} 124.08261 0.55234 0.17074 ++ {0.0} {} 1.30166780949 0.1890 0 {} 0 0 0
7 {} 7.59206 0.03141 0.05127 ++ {0.0} {} {} 178.82474 0.35661 0.55156 ++ {0.0} {} {} 123.71054 0.48767 0.75999 ++ {0.0} {} 21.533864975 0.8301 0 {} 0 0 0
8 {} 7.54274 0.02046 0.04566 ++ {0.0} {} {} 178.83430 0.34332 0.36980 ++ {0.0} {} {} 123.65687 0.56955 0.60519 ++ {0.0} {} 7.25368976593 0.3556 0 {} 0 0 0
9 {} 8.18456 0.02965 0.07374 ++ {0.0} {} {} 176.08899 0.35148 0.64823 ++ {0.0} {} {} 123.56944 0.45503 0.88962 ++ {0.0} {} 57.2819366455 2.6029 0 {} 0 0 0
10 {} 8.36155 0.02503 0.03576 ++ {0.0} {} {} 175.92477 0.30189 0.44660 ++ {0.0} {} {} 123.67567 0.56789 0.77582 ++ {0.0} {} 13.0120954514 0.6196 0 {} 0 0 0
11 {} 8.08476 0.03035 0.04301 ++ {0.0} {} {} 176.19055 0.33360 0.43619 ++ {0.0} {} {} 123.22712 0.60175 0.76981 ++ {0.0} {} 14.578707695 0.5102 0 {} 0 0 0
12 {} 8.26993 0.02329 0.04460 ++ {0.0} {} {} 176.99042 0.29443 0.51111 ++ {0.0} {} {} 122.82319 0.45736 0.79478 ++ {0.0} {} 24.583732605 1.3620 0 {} 0 0 0
13 {} 8.07516 0.02491 0.03628 ++ {0.0} {} {} 175.66785 0.34121 0.48255 ++ {0.0} {} {} 122.86215 0.53556 0.74004 ++ {0.0} {} 12.546122551 0.6203 0 {} 0 0 0
14 {} 7.91112 0.02729 0.01503 ++ {0.0} {} {} 178.64784 0.33964 0.16288 ++ {0.0} {} {} 122.66903 0.54483 0.26892 ++ {0.0} {} 2.00839996338 0.2093 0 {} 0 0 0
15 {} 8.64137 0.02741 0.01869 ++ {0.0} {} {} 176.64630 0.30792 0.18092 ++ {0.0} {} {} 122.63831 0.46845 0.27423 ++ {0.0} {} 2.29316425323 0.2273 0 {} 0 0 0
16 {} 7.95529 0.02838 0.04345 ++ {0.0} {} {} 176.71335 0.37042 0.55347 ++ {0.0} {} {} 122.67916 0.75998 1.11039 ++ {0.0} {} 26.6629562378 0.7356 0 {} 0 0 0
17 {} 8.13957 0.02591 0.05773 ++ {0.0} {} {} 176.57065 0.36906 0.69663 ++ {0.0} {} {} 122.63493 0.46079 0.89809 ++ {0.0} {} 57.2047538757 2.6029 0 {} 0 0 0
18 {} 8.50553 0.03354 0.05344 ++ {0.0} {} {} 176.51144 0.30807 0.49438 ++ {0.0} {} {} 122.58878 0.49734 0.77220 ++ {0.0} {} 21.123758316 0.7939 0 {} 0 0 0
19 {} 8.04739 0.02478 0.03310 ++ {0.0} {} {} 176.39259 0.35277 0.48223 ++ {0.0} {} {} 122.29376 0.57157 0.74902 ++ {0.0} {} 11.9483680725 0.5075 0 {} 0 0 0
20 {} 8.10278 0.02626 0.02380 ++ {0.0} {} {} 179.28824 0.36690 0.32875 ++ {0.0} {} {} 122.13088 0.55834 0.50783 ++ {0.0} {} 6.03437280655 0.2854 0 {} 0 0 0
21 {} 7.97432 0.02755 0.05249 ++ {0.0} {} {} 176.36601 0.34707 0.60865 ++ {0.0} {} {} 122.10584 0.51687 0.84074 ++ {0.0} {} 26.2333850861 1.2184 0 {} 0 0 0
22 {} 8.17932 0.03131 0.06173 ++ {0.0} {} {} 175.55695 0.34133 0.65185 ++ {0.0} {} {} 122.11922 0.55675 0.98560 ++ {0.0} {} 44.8275680542 1.7061 0 {} 0 0 0
23 {} 8.47693 0.02606 0.02519 ++ {0.0} {} {} 175.20470 0.34287 0.33028 ++ {0.0} {} {} 122.14948 0.55640 0.54056 ++ {0.0} {} 6.57461071014 0.3103 0 {} 0 0 0
24 {} 8.32649 0.02440 0.04943 ++ {0.0} {} {} 180.33382 0.36129 0.62630 ++ {0.0} {} {} 121.97601 0.56159 0.96590 ++ {0.0} {} 33.6082954407 1.5728 0 {} 0 0 0
25 {} 8.52720 0.02523 0.04920 ++ {0.0} {} {} 179.95021 0.34967 0.62472 ++ {0.0} {} {} 121.98074 0.56007 0.95720 ++ {0.0} {} 32.8668479919 1.5412 0 {} 0 0 0
26 {} 8.73492 0.02596 0.05148 ++ {0.0} {} {} 179.16422 0.36237 0.61004 ++ {0.0} {} {} 122.01684 0.50655 0.87426 ++ {0.0} {} 27.8832759857 1.2868 0 {} 0 0 0
27 {} 8.29007 0.02786 0.00268 ++ {0.0} {} {} 177.72537 0.36120 0.03468 ++ {0.0} {} {} 121.94502 0.55868 0.05583 ++ {0.0} {} 0.331775277853 0.1687 0 {} 0 0 0
28 {} 8.02762 0.03040 0.06625 ++ {0.0} {} {} 177.40594 0.37125 0.64728 ++ {0.0} {} {} 121.89333 0.53049 0.97260 ++ {0.0} {} 41.3995056152 1.4686 0 {} 0 0 0
29 {} 6.97657 0.03398 0.04909 ++ {0.0} {} {} 176.46428 0.36609 0.46515 ++ {0.0} {} {} 121.99986 0.53919 0.71094 ++ {0.0} {} 15.7948942184 0.5279 0 {} 0 0 0
30 {} 8.19552 0.02379 0.05692 ++ {0.0} {} {} 177.40320 0.35827 0.65287 ++ {0.0} {} {} 121.68273 0.44781 0.91721 ++ {0.0} {} 50.8803024292 2.4811 0 {} 0 0 0
31 {} 8.04777 0.03222 0.06219 ++ {0.0} {} {} 177.28299 0.37061 0.64500 ++ {0.0} {} {} 121.54119 0.56810 1.04030 ++ {0.0} {} 44.3835792542 1.4737 0 {} 0 0 0
32 {} 8.31060 0.02673 0.06397 ++ {0.0} {} {} 177.06409 0.42107 0.75050 ++ {0.0} {} {} 121.59492 0.56397 0.99572 ++ {0.0} {} 53.2880783081 1.8067 0 {} 0 0 0
33 {} 8.24802 0.02986 0.06288 ++ {0.0} {} {} 176.72081 0.36158 0.67775 ++ {0.0} {} {} 121.50681 0.47382 0.89854 ++ {0.0} {} 50.0544319153 1.8776 0 {} 0 0 0
34 {} 7.85529 0.02537 0.05820 ++ {0.0} {} {} 177.77362 0.35597 0.65777 ++ {0.0} {} {} 121.32235 0.46354 0.86201 ++ {0.0} {} 41.8804855347 1.8707 0 {} 0 0 0
35 {} 7.99692 0.02302 0.01320 ++ {0.0} {} {} 180.05084 0.31449 0.15692 ++ {0.0} {} {} 121.21074 0.53645 0.32355 ++ {0.0} {} 2.67106747627 0.2126 0 {} 0 0 0
36 {} 8.25993 0.02448 0.01737 ++ {0.0} {} {} 178.73853 0.35576 0.19587 ++ {0.0} {} {} 121.19986 0.54201 0.37877 ++ {0.0} {} 2.9283554554 0.2274 0 {} 0 0 0
37 {} 7.98085 0.03153 0.05897 ++ {0.0} {} {} 177.07179 0.35584 0.63423 ++ {0.0} {} {} 121.18006 0.54736 0.93495 ++ {0.0} {} 35.3652267456 1.3288 0 {} 0 0 0
38 {} 8.08017 0.02415 0.05037 ++ {0.0} {} {} 178.72356 0.33442 0.63967 ++ {0.0} {} {} 121.00826 0.60159 1.11926 ++ {0.0} {} 34.513710022 1.4688 0 {} 0 0 0
39 {} 8.35098 0.02384 0.00118 ++ {0.0} {} {} 178.29297 0.31870 0.01456 ++ {0.0} {} {} 120.98794 0.53155 0.02540 ++ {0.0} {} 0.165272474289 0.1653 0 {} 0 0 0
40 {} 8.27790 0.02544 0.01905 ++ {0.0} {} {} 178.31053 0.35643 0.26608 ++ {0.0} {} {} 121.02482 0.57569 0.45154 ++ {0.0} {} 4.91352987289 0.2475 0 {} 0 0 0
41 {} 8.14363 0.02988 0.03928 ++ {0.0} {} {} 177.58449 0.14225 0.41745 ++ {0.0} {} {} 121.01940 0.59770 0.76002 ++ {0.0} {} 6.27557086945 0.5139 0 {} 0 0 0
42 {} 7.91412 0.02624 0.05359 ++ {0.0} {} {} 177.46455 0.31073 0.56559 ++ {0.0} {} {} 120.98577 0.54123 0.96547 ++ {0.0} {} 31.7072963715 1.5043 0 {} 0 0 0
43 {} 8.15939 0.02930 0.06372 ++ {0.0} {} {} 177.06436 0.36877 0.74043 ++ {0.0} {} {} 120.99765 0.55996 1.00812 ++ {0.0} {} 57.6799468994 2.1558 0 {} 0 0 0
44 {} 7.95956 0.03369 0.06668 ++ {0.0} {} {} 174.78326 0.33282 0.56107 ++ {0.0} {} {} 120.93790 0.43923 0.76707 ++ {0.0} {} 31.7481460571 1.2043 0 {} 0 0 0
45 {} 8.02705 0.02511 0.05160 ++ {0.0} {} {} 178.18405 0.33356 0.62166 ++ {0.0} {} {} 120.85275 0.55908 0.97393 ++ {0.0} {} 37.089515686 1.7781 0 {} 0 0 0
46 {} 8.11712 0.02588 0.03407 ++ {0.0} {} {} 176.04056 0.31463 0.43423 ++ {0.0} {} {} 120.78965 0.52828 0.69919 ++ {0.0} {} 11.0394048691 0.5240 0 {} 0 0 0
47 {} 8.12288 0.02242 0.00186 ++ {0.0} {} {} 173.54199 0.38131 0.03299 ++ {0.0} {} {} 120.82703 0.56057 0.05076 ++ {0.0} {} 0.167592644691 0.1676 0 {} 0 0 0
48 {} 8.00216 0.02866 0.06000 ++ {0.0} {} {} 177.60411 0.35822 0.68486 ++ {0.0} {} {} 120.70569 0.52494 1.01305 ++ {0.0} {} 47.7255325317 1.9086 0 {} 0 0 0
49 {} 7.97667 0.03181 0.03291 ++ {0.0} {} {} 173.78183 0.36978 0.37886 ++ {0.0} {} {} 120.58282 0.46288 0.47624 ++ {0.0} {} 9.0574464798 0.3335 0 {} 0 0 0
50 {} 8.15585 0.02445 0.04893 ++ {0.0} {} {} 178.59175 0.35586 0.62531 ++ {0.0} {} {} 120.51180 0.51245 0.88787 ++ {0.0} {} 27.9887313843 1.3086 0 {} 0 0 0
51 {} 8.39200 0.03255 0.04876 ++ {0.0} {} {} 176.61285 0.34885 0.50111 ++ {0.0} {} {} 120.46705 0.56190 0.75703 ++ {0.0} {} 18.1009807587 0.6379 0 {} 0 0 0
52 {} 8.07606 0.02623 0.03747 ++ {0.0} {} {} 179.23967 0.33900 0.64031 ++ {0.0} {} {} 120.20988 0.47720 0.87350 ++ {0.0} {} 47.3574752808 2.0106 0 {} 0 0 0
53 {} 8.05250 0.03840 0.06954 ++ {0.0} {} {} 179.17836 0.35699 0.67431 ++ {0.0} {} {} 120.23461 0.52459 0.99146 ++ {0.0} {} 78.0801467896 2.3463 0 {} 0 0 0
54 {} 8.30954 0.02400 0.01410 ++ {0.0} {} {} 178.31281 0.33572 0.19511 ++ {0.0} {} {} 120.28999 0.59404 0.39679 ++ {0.0} {} 3.59712004662 0.2203 0 {} 0 0 0
55 {} 7.81157 0.02385 0.02009 ++ {0.0} {} {} 179.99637 0.33717 0.27915 ++ {0.0} {} {} 119.81132 0.47163 0.37230 ++ {0.0} {} 4.75738811493 0.2664 0 {} 0 0 0
56 {} 8.49778 0.02864 0.02505 ++ {0.0} {} {} 178.25034 0.35228 0.30306 ++ {0.0} {} {} 119.88518 0.56582 0.50228 ++ {0.0} {} 6.82468080521 0.2780 0 {} 0 0 0
57 {} 8.42493 0.02728 0.01996 ++ {0.0} {} {} 177.35646 0.35361 0.24914 ++ {0.0} {} {} 119.87988 0.63969 0.48504 ++ {0.0} {} 5.30977535248 0.2401 0 {} 0 0 0
58 {} 7.16246 0.03146 0.05816 ++ {0.0} {} {} 175.86710 0.36311 0.59343 ++ {0.0} {} {} 119.84048 0.48167 0.79086 ++ {0.0} {} 29.892156601 1.1257 0 {} 0 0 0
59 {} 8.28891 0.02441 0.04518 ++ {0.0} {} {} 179.65601 0.32740 0.59900 ++ {0.0} {} {} 119.78957 0.47671 0.85855 ++ {0.0} {} 27.1955127716 1.3371 0 {} 0 0 0
60 {} 8.36004 0.03346 0.05824 ++ {0.0} {} {} 179.06386 0.35312 0.58766 ++ {0.0} {} {} 119.78188 0.49476 0.80673 ++ {0.0} {} 25.9906673431 0.9667 0 {} 0 0 0
61 {} 7.97578 0.02602 0.05545 ++ {0.0} {} {} 178.59740 0.35022 0.66446 ++ {0.0} {} {} 119.78556 0.48091 0.94760 ++ {0.0} {} 41.1193084717 1.8742 0 {} 0 0 0
62 {} 8.22699 0.02709 0.05209 ++ {0.0} {} {} 178.29953 0.32578 0.56160 ++ {0.0} {} {} 119.69477 0.55995 0.92993 ++ {0.0} {} 28.2710723877 1.3392 0 {} 0 0 0
63 {} 7.80543 0.02431 0.05247 ++ {0.0} {} {} 178.05548 0.30809 0.56700 ++ {0.0} {} {} 119.71588 0.55599 0.97624 ++ {0.0} {} 37.9472045898 1.8390 0 {} 0 0 0
64 {} 7.88747 0.04008 0.06586 ++ {0.0} {} {} 179.45773 0.31370 0.50379 ++ {0.0} {} {} 119.56380 0.54092 0.86447 ++ {0.0} {} 31.2898712158 0.9807 0 {} 0 0 0
65 {} 8.17181 0.03511 0.05716 ++ {0.0} {} {} 176.74228 0.32985 0.51880 ++ {0.0} {} {} 119.50223 0.57259 0.83723 ++ {0.0} {} 24.6173915863 0.7887 0 {} 0 0 0
66 {} 7.87900 0.03359 0.05909 ++ {0.0} {} {} 178.30537 0.34113 0.57566 ++ {0.0} {} {} 119.42644 0.45397 0.79606 ++ {0.0} {} 30.9115428925 1.1775 0 {} 0 0 0
67 {} 8.15039 0.02701 0.00525 ++ {0.0} {} {} 178.08296 0.36931 0.05695 ++ {0.0} {} {} 119.39809 0.49576 0.06570 ++ {0.0} {} 0.326670885086 0.1728 0 {} 0 0 0
68 {} 8.04627 0.02433 0.04929 ++ {0.0} {} {} 177.08318 0.32696 0.60631 ++ {0.0} {} {} 119.24484 0.44184 0.78301 ++ {0.0} {} 25.3352565765 1.2737 0 {} 0 0 0
69 {} 7.89883 0.02663 0.00323 ++ {0.0} {} {} 176.50346 0.30632 0.02907 ++ {0.0} {} {} 119.38577 0.50668 0.04932 ++ {0.0} {} 0.330772966146 0.1696 0 {} 0 0 0
70 {} 8.16287 0.02259 0.02835 ++ {0.0} {} {} 174.24458 0.36082 0.43723 ++ {0.0} {} {} 119.42144 0.44781 0.58956 ++ {0.0} {} 8.99273586273 0.4654 0 {} 0 0 0
71 {} 8.15039 0.03049 0.00263 ++ {0.0} {} {} 180.33809 0.39222 0.02669 ++ {0.0} {} {} 118.75542 0.59471 0.03960 ++ {0.0} {} 0.166182562709 0.1662 0 {} 0 0 0
72 {} 7.94850 0.02649 0.02353 ++ {0.0} {} {} 178.22810 0.38731 0.34891 ++ {0.0} {} {} 118.82100 0.51969 0.45956 ++ {0.0} {} 5.87855148315 0.2833 0 {} 0 0 0
73 {} 7.43678 0.02506 0.02399 ++ {0.0} {} {} 177.19164 0.34732 0.32883 ++ {0.0} {} {} 118.86256 0.44343 0.41494 ++ {0.0} {} 6.01425218582 0.3046 0 {} 0 0 0
74 {} 8.20673 0.02607 0.01964 ++ {0.0} {} {} 180.19753 0.36774 0.28412 ++ {0.0} {} {} 118.37165 0.56270 0.41924 ++ {0.0} {} 4.54620599747 0.2430 0 {} 0 0 0
75 {} 7.85878 0.02625 0.01247 ++ {0.0} {} {} 179.69420 0.29960 0.09605 ++ {0.0} {} {} 118.12079 0.43094 0.13637 ++ {0.0} {} 1.97970795631 0.1921 0 {} 0 0 0
76 {} 8.26306 0.02416 0.04528 ++ {0.0} {} {} 177.34706 0.30323 0.51338 ++ {0.0} {} {} 118.18373 0.55462 0.92712 ++ {0.0} {} 27.5469608307 1.2703 0 {} 0 0 0
77 {} 8.47500 0.02393 0.04258 ++ {0.0} {} {} 176.30600 0.32531 0.49376 ++ {0.0} {} {} 118.10477 0.47013 0.75879 ++ {0.0} {} 16.6827812195 0.8427 0 {} 0 0 0
78 {} 7.59403 0.02618 0.02150 ++ {0.0} {} {} 176.62144 0.32711 0.25815 ++ {0.0} {} {} 117.53864 0.47394 0.36957 ++ {0.0} {} 5.17728281021 0.2633 0 {} 0 0 0
79 {} 8.70291 0.03701 0.03544 ++ {0.0} {} {} 177.09464 0.32053 0.30317 ++ {0.0} {} {} 117.24033 0.53919 0.51517 ++ {0.0} {} 9.10408306122 0.3064 0 {} 0 0 0
80 {} 7.99884 0.02482 0.04495 ++ {0.0} {} {} 178.10681 0.37173 0.60524 ++ {0.0} {} {} 117.11361 0.57564 0.91699 ++ {0.0} {} 23.8666572571 1.0652 0 {} 0 0 0
81 {} 8.19641 0.02352 0.04816 ++ {0.0} {} {} 177.27614 0.36524 0.63123 ++ {0.0} {} {} 117.09505 0.56032 0.95076 ++ {0.0} {} 30.2640151978 1.4078 0 {} 0 0 0
82 {} 7.65361 0.02604 0.04855 ++ {0.0} {} {} 179.16216 0.36004 0.61392 ++ {0.0} {} {} 116.68978 0.55992 0.93072 ++ {0.0} {} 29.7501468658 1.3950 0 {} 0 0 0
83 {} 8.05249 0.01712 0.01438 ++ {0.0} {} {} 176.94568 0.35315 0.30857 ++ {0.0} {} {} 116.73524 0.56570 0.50363 ++ {0.0} {} 4.45383691788 0.2795 0 {} 0 0 0
84 {} 7.41567 0.02562 0.04762 ++ {0.0} {} {} 175.83374 0.31555 0.53450 ++ {0.0} {} {} 116.52943 0.55737 0.93009 ++ {0.0} {} 27.6255455017 1.3353 0 {} 0 0 0
85 {} 7.86314 0.02848 0.04603 ++ {0.0} {} {} 176.98792 0.30007 0.48830 ++ {0.0} {} {} 115.72923 0.52176 0.79989 ++ {0.0} {} 19.9883174896 0.9017 0 {} 0 0 0
86 {} 8.30511 0.04355 0.05795 ++ {0.0} {} {} 178.06844 0.34986 0.49322 ++ {0.0} {} {} 115.31860 0.46477 0.69556 ++ {0.0} {} 22.3074913025 0.6512 0 {} 0 0 0
87 {} 7.34369 0.02077 0.01900 ++ {0.0} {} {} 177.00034 0.32296 0.29638 ++ {0.0} {} {} 115.44635 0.52607 0.48635 ++ {0.0} {} 5.20280313492 0.2959 0 {} 0 0 0
88 {} 7.96975 0.02316 0.01582 ++ {0.0} {} {} 178.14244 0.32674 0.21480 ++ {0.0} {} {} 114.71130 0.51935 0.34888 ++ {0.0} {} 4.25251817703 0.2383 0 {} 0 0 0
89 {} 6.89657 0.02542 0.02464 ++ {0.0} {} {} 180.50320 0.31716 0.30526 ++ {0.0} {} {} 113.63351 0.51691 0.49604 ++ {0.0} {} 6.62366533279 0.3109 0 {} 0 0 0
90 {} 6.78320 0.02362 0.02815 ++ {0.0} {} {} 180.50349 0.31766 0.38900 ++ {0.0} {} {} 113.64138 0.54215 0.67409 ++ {0.0} {} 8.92179965973 0.4275 0 {} 0 0 0
91 {} 7.66021 0.02188 0.02621 ++ {0.0} {} {} 180.52458 0.33712 0.41554 ++ {0.0} {} {} 113.46365 0.46530 0.57439 ++ {0.0} {} 7.4584736824 0.4466 0 {} 0 0 0
92 {} 7.54554 0.02264 0.03303 ++ {0.0} {} {} 180.52455 0.33303 0.47086 ++ {0.0} {} {} 113.46481 0.48137 0.68062 ++ {0.0} {} 10.8253421783 0.6349 0 {} 0 0 0
93 {} 6.67467 0.02235 0.01805 ++ {0.0} {} {} 180.05952 0.35235 0.28218 ++ {0.0} {} {} 113.45990 0.53214 0.41015 ++ {0.0} {} 4.55586051941 0.2600 0 {} 0 0 0
94 {} 6.87497 0.02186 0.00924 ++ {0.0} {} {} 179.97270 0.36512 0.18907 ++ {0.0} {} {} 113.48014 0.58479 0.24909 ++ {0.0} {} 1.85318124294 0.2019 0 {} 0 0 0
95 {} 6.76368 0.02278 0.02164 ++ {0.0} {} {} 179.96863 0.38458 0.36815 ++ {0.0} {} {} 113.49062 0.60933 0.58336 ++ {0.0} {} 7.44503879547 0.3050 0 {} 0 0 0
96 {} 7.37467 0.02215 0.01416 ++ {0.0} {} {} 180.08101 0.37020 0.24465 ++ {0.0} {} {} 113.27594 0.47000 0.25174 ++ {0.0} {} 2.66910457611 0.2183 0 {} 0 0 0
97 {} 7.25985 0.02255 0.02388 ++ {0.0} {} {} 180.07159 0.36444 0.38668 ++ {0.0} {} {} 113.28729 0.47395 0.50383 ++ {0.0} {} 6.36042642593 0.3517 0 {} 0 0 0
98 {} 7.70808 0.02166 0.02373 ++ {0.0} {} {} 179.97188 0.35899 0.39226 ++ {0.0} {} {} 113.31252 0.54727 0.60045 ++ {0.0} {} 6.4309835434 0.3732 0 {} 0 0 0
99 {} 7.59329 0.02164 0.02768 ++ {0.0} {} {} 179.97171 0.37982 0.50120 ++ {0.0} {} {} 113.30985 0.51377 0.65458 ++ {0.0} {} 8.93202018738 0.5235 0 {} 0 0 0
100 {} 6.95852 0.02280 0.01946 ++ {0.0} {} {} 180.54086 0.37254 0.31495 ++ {0.0} {} {} 112.93835 0.55890 0.47284 ++ {0.0} {} 4.9243683815 0.2672 0 {} 0 0 0
101 {} 6.94068 0.02352 0.01842 ++ {0.0} {} {} 180.23393 0.35506 0.28165 ++ {0.0} {} {} 112.96751 0.62393 0.53096 ++ {0.0} {} 5.2034869194 0.2588 0 {} 0 0 0
102 {} 6.82782 0.02296 0.02542 ++ {0.0} {} {} 180.24869 0.35472 0.39510 ++ {0.0} {} {} 112.97933 0.66696 0.72541 ++ {0.0} {} 10.0547237396 0.3725 0 {} 0 0 0
103 {} 7.46501 0.02046 0.02126 ++ {0.0} {} {} 180.54855 0.39976 0.41307 ++ {0.0} {} {} 112.82561 0.54575 0.56751 ++ {0.0} {} 7.00456428528 0.3391 0 {} 0 0 0
104 {} 7.34957 0.01978 0.02464 ++ {0.0} {} {} 180.55826 0.36077 0.42834 ++ {0.0} {} {} 112.82888 0.51573 0.64811 ++ {0.0} {} 7.3171453476 0.4429 0 {} 0 0 0
105 {} 7.54819 0.01922 0.02268 ++ {0.0} {} {} 180.29253 0.43004 0.49019 ++ {0.0} {} {} 112.72917 0.67074 0.95820 ++ {0.0} {} 11.5891809464 0.3978 0 {} 0 0 0
106 {} 7.59586 0.01540 0.00271 ++ {0.0} {} {} 179.94083 0.37053 0.07014 ++ {0.0} {} {} 112.36179 0.64398 0.10798 ++ {0.0} {} 0.667900621891 0.1773 0 {} 0 0 0
107 {} 7.30536 0.02318 0.01093 ++ {0.0} {} {} 179.93532 0.32757 0.14375 ++ {0.0} {} {} 112.32421 0.42676 0.17994 ++ {0.0} {} 1.94118535519 0.2047 0 {} 0 0 0
108 {} 6.87682 0.02355 0.01681 ++ {0.0} {} {} 180.00511 0.34573 0.22089 ++ {0.0} {} {} 112.42080 0.52834 0.35627 ++ {0.0} {} 3.69704079628 0.2303 0 {} 0 0 0
109 {} 6.76544 0.02057 0.02465 ++ {0.0} {} {} 179.98552 0.39078 0.44763 ++ {0.0} {} {} 112.40544 0.54099 0.61329 ++ {0.0} {} 7.66599750519 0.4039 0 {} 0 0 0
110 {} 7.54085 0.01906 0.02195 ++ {0.0} {} {} 180.00873 0.33631 0.38581 ++ {0.0} {} {} 112.27597 0.53222 0.61802 ++ {0.0} {} 6.6354174614 0.3916 0 {} 0 0 0
111 {} 7.42551 0.02115 0.03220 ++ {0.0} {} {} 179.99243 0.36955 0.51520 ++ {0.0} {} {} 112.27702 0.55158 0.84252 ++ {0.0} {} 12.9610872269 0.6589 0 {} 0 0 0
112 {} 7.35404 0.02031 0.00821 ++ {0.0} {} {} 180.51819 0.32082 0.10411 ++ {0.0} {} {} 111.84986 0.59582 0.23940 ++ {0.0} {} 2.29815125465 0.1915 0 {} 0 0 0
113 {} 7.42855 0.02047 0.00943 ++ {0.0} {} {} 179.96660 0.36213 0.17493 ++ {0.0} {} {} 111.35403 0.26022 0.21633 ++ {0.0} {} 1.24297261238 0.1979 0 {} 0 0 0
114 {} 7.37253 0.02497 0.04006 ++ {0.0} {} {} 178.22292 0.36912 0.54721 ++ {0.0} {} {} 111.16103 0.46838 0.73093 ++ {0.0} {} 16.6437664032 0.7668 0 {} 0 0 0
115 {} 8.35065 0.02396 0.01715 ++ {0.0} {} {} 176.81804 0.35669 0.27618 ++ {0.0} {} {} 111.00861 0.45443 0.30566 ++ {0.0} {} 3.53128314018 0.2435 0 {} 0 0 0
116 {} 8.13101 0.03460 0.05377 ++ {0.0} {} {} 178.00314 0.36246 0.54424 ++ {0.0} {} {} 109.04948 0.56271 0.80683 ++ {0.0} {} 23.3879585266 0.7583 0 {} 0 0 0
;
loop_
_Spectral_dim.ID
_Spectral_dim.Axis_code
_Spectral_dim.Spectrometer_frequency
_Spectral_dim.Atom_type
_Spectral_dim.Atom_isotope_number
_Spectral_dim.Spectral_region
_Spectral_dim.Magnetization_linkage_ID
_Spectral_dim.Under_sampling_type
_Spectral_dim.Sweep_width
_Spectral_dim.Sweep_width_units
_Spectral_dim.Value_first_point
_Spectral_dim.Absolute_peak_positions
_Spectral_dim.Acquisition
_Spectral_dim.Center_frequency_offset
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
1 . . H 1 HN . 'not observed' 2803.80249023 Hz . . . 4.729 . . 31013 7
2 . . H 1 H . 'not observed' 8798.94433594 Hz . . . 4.786 . . 31013 7
3 . . N 15 HN . 'not observed' 2399.6640625 Hz . . . 119.705 . . 31013 7
stop_
save_