Content for NMR-STAR saveframe, spectral_peak_list_1
save_spectral_peak_list_1
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_1
_Spectral_peak_list.Entry_ID 36771
_Spectral_peak_list.ID 1
_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 .
_Spectral_peak_list.Chem_shift_reference_label .
_Spectral_peak_list.Experiment_ID 4
_Spectral_peak_list.Experiment_name '3D 1H-15N NOESY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions .
_Spectral_peak_list.Chemical_shift_list assigned_chemical_shifts_1
_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 unknown
_Spectral_peak_list.Text_data
;
Number Position F1 Position F2 Position F3 Volume
1 8.3362 114.21688 3.98707 1171150.0
2 8.47037 122.73916 4.02012 3000690.0
3 8.47004 122.73916 3.0459 1965500.0
4 8.4741 122.73916 3.30503 1406750.0
5 8.47089 122.73916 4.56865 1051900.0
6 10.34174 129.44037 2.03997 1020110.0
7 10.34089 129.44037 2.26373 1191020.0
8 10.343 129.44037 3.34167 871928.0
9 10.34696 129.44037 4.02444 882360.0
10 10.34246 129.44037 8.46626 589639.0
11 10.34308 129.44037 4.56105 886188.0
12 10.34357 129.44037 3.89154 629278.0
13 10.34151 129.44037 2.09779 947123.0
14 9.03922 125.94497 4.57062 7437780.0
15 9.04075 125.92165 2.06752 3352440.0
16 9.03694 125.95289 8.30171 824078.0
17 9.0389 125.95196 2.24952 1190520.0
18 9.03349 125.95196 3.30676 872055.0
19 9.03842 125.95196 3.03847 627249.0
20 8.28738 125.72534 4.5033 40878600.0
21 8.28568 125.70287 4.22765 6170520.0
22 8.2865 125.73534 1.78514 18003200.0
23 8.28615 125.72534 0.93805 15880800.0
24 8.286 125.74039 0.6347 4883630.0
25 8.89105 126.28161 4.39992 18176000.0
26 8.89032 126.26413 3.83989 5845060.0
27 8.88824 126.25565 2.32539 2983640.0
28 8.891 126.28188 2.08822 13893700.0
29 8.89075 126.2666 1.71284 2064790.0
30 8.88802 126.2666 2.54126 2821180.0
31 8.89022 126.2666 4.07279 1039850.0
32 8.71578 117.51082 4.08499 6029480.0
33 8.7132 117.44972 2.08219 5651140.0
34 8.7147 117.50015 1.39174 13909000.0
35 8.71412 117.44972 3.84986 1767520.0
36 7.28221 112.61391 4.07302 4471830.0
37 7.28087 112.62643 3.82586 3237140.0
38 7.28222 112.62428 2.54076 4424510.0
39 7.28026 112.61918 1.44064 12606300.0
40 7.28297 112.62147 0.63435 4167690.0
41 7.2804 112.60574 8.71573 6203430.0
42 7.28463 112.62147 3.21686 1569260.0
43 7.28267 112.62147 2.86418 1014890.0
44 7.28218 112.62147 0.80394 2116270.0
45 7.2812 112.62147 0.8809 2080360.0
46 7.3167 117.82424 3.829 5968630.0
47 7.31276 117.78268 3.23367 8297010.0
48 7.31622 117.82826 1.69871 21563400.0
49 7.3148 117.80393 1.418 18234100.0
50 7.31465 117.80419 0.85631 11463600.0
51 7.31312 117.79129 2.86787 1733610.0
52 7.31223 117.79129 4.06997 1771140.0
53 7.31133 117.79129 4.2804 2795560.0
54 7.32018 117.79129 8.85706 898521.0
55 7.26125 114.145 4.72487 9019520.0
56 7.26244 114.15087 2.86406 12482300.0
57 7.26299 114.15382 1.69511 8681590.0
58 7.2651 114.16437 0.65185 3250060.0
59 7.26319 114.17064 0.88257 1853360.0
60 7.26177 114.17064 2.07566 1941850.0
61 7.26343 114.17064 0.7985 1759320.0
62 7.15493 123.72445 4.47805 5253570.0
63 7.15259 123.74187 4.30678 6716690.0
64 7.15407 123.73723 4.11201 13325500.0
65 7.15478 123.75922 2.85489 3356090.0
66 7.15643 123.72445 9.10247 1448170.0
67 7.15637 123.72445 0.6626 1351080.0
68 7.15344 123.72445 2.10281 37017700.0
69 7.15493 123.72445 4.64624 5085630.0
70 8.57052 127.53296 2.17003 11197600.0
71 8.56962 127.53708 7.16409 3777350.0
72 8.56982 127.53296 3.45432 1296900.0
73 8.29914 122.17578 2.9488 3292720.0
74 6.06364 105.27504 2.79223 2803900.0
75 6.0658 105.27504 2.19019 2653020.0
76 6.0658 105.27504 0.85921 1597990.0
77 6.07003 105.27504 8.26491 936600.0
78 7.44356 105.28237 6.06327 27407500.0
79 7.44438 105.2807 0.85013 2304850.0
80 7.44296 105.2807 8.31027 1325400.0
81 7.85902 124.47017 4.34659 11215100.0
82 7.85736 124.49487 3.42489 3139540.0
83 7.85835 124.45267 3.24327 4701510.0
84 7.85785 124.47047 2.18033 20995200.0
85 7.8582 124.47753 1.38262 22857000.0
86 7.85732 124.46687 0.65086 6113790.0
87 7.85833 124.46687 6.67683 1345840.0
88 8.24384 123.08841 4.55934 24504000.0
89 8.24554 123.0607 3.94295 17688500.0
90 8.24408 123.0921 3.11422 5598560.0
91 8.24363 123.08793 2.55376 9121610.0
92 8.24291 123.0607 0.74858 2971230.0
93 8.24455 123.0607 7.62751 1442510.0
94 8.24354 123.0607 1.37489 2172900.0
95 8.24349 123.0607 4.05334 10736200.0
96 8.24534 123.0607 0.80431 2553470.0
97 8.2434 123.0607 0.65893 1746360.0
98 8.06892 119.36536 3.92505 14275400.0
99 8.06916 119.35906 3.12161 25206400.0
100 8.06908 119.35693 2.54745 13349800.0
101 8.06888 119.36007 7.62419 8816340.0
102 7.60847 116.8907 3.90644 21874900.0
103 7.60756 116.88067 3.10084 3878440.0
104 7.60727 116.8943 1.37134 18952000.0
105 7.61004 116.89185 7.96168 19930300.0
106 7.60845 116.88067 4.09308 2631040.0
107 7.60815 116.88067 4.48532 1486410.0
108 7.60875 116.88067 2.55 2246970.0
109 7.60895 116.88067 1.62105 13895800.0
110 7.60774 116.88067 0.73501 1000720.0
111 7.93937 113.69682 3.92882 25806600.0
112 7.9388 113.70083 8.25334 19352600.0
113 7.93892 113.69682 2.53428 1269190.0
114 7.93875 113.69682 2.99115 1976450.0
115 7.93834 113.69682 3.30894 1477730.0
116 7.93969 113.69682 4.074 22529800.0
117 7.93609 113.69682 4.57049 2220770.0
118 7.9344 113.69682 8.56587 1958790.0
119 8.26463 114.9017 3.93982 26767800.0
120 8.26218 114.92011 1.47295 10229100.0
121 8.26236 114.90439 7.62347 2370310.0
122 8.26558 114.90439 2.80845 1311390.0
123 8.26407 114.90439 3.01672 1098330.0
124 8.26658 114.90439 3.12212 1056930.0
125 8.34267 121.05585 2.075 2944830.0
126 8.33874 121.03198 1.49001 7685880.0
127 8.3424 121.00049 7.94158 3374080.0
128 8.33763 121.01244 9.30497 2488200.0
129 8.33877 121.01059 8.5357 21565100.0
130 8.54692 120.68477 4.35673 4394840.0
131 8.5505 120.67896 3.88186 6183520.0
132 8.55075 120.69594 2.661 16911300.0
133 8.55113 120.70885 1.95114 20285100.0
134 8.54789 120.70885 7.6294 2725400.0
135 8.55194 120.68267 9.26885 14273100.0
136 8.55081 120.70885 2.80679 9803860.0
137 8.55108 120.70885 3.11296 1882770.0
138 8.55108 120.70885 3.48757 1973210.0
139 6.71152 109.92202 2.65056 2786360.0
140 6.71445 109.93127 2.13975 4034320.0
141 6.71336 109.94931 0.71704 5091000.0
142 6.71269 109.93127 1.94226 1111710.0
143 6.71269 109.93127 1.6129 2115930.0
144 6.86074 109.91033 2.6599 4295530.0
145 6.86067 109.95907 2.13866 6070160.0
146 6.86188 109.93045 1.62216 2599420.0
147 6.86047 109.91555 0.7162 6605150.0
148 6.86459 109.93045 4.08816 1040000.0
149 6.86367 109.93045 1.94283 1971320.0
150 9.27444 107.65116 1.95263 8030110.0
151 9.27264 107.6314 8.28263 2655430.0
152 9.27112 107.6314 1.61315 1698990.0
153 7.61872 108.23286 4.36726 4047990.0
154 7.61904 108.22327 3.41275 29797500.0
155 7.61472 108.21505 3.11859 5028770.0
156 7.61826 108.22759 2.31223 16960900.0
157 7.61903 108.23312 9.27092 11867300.0
158 7.6191 108.21557 3.92651 2697320.0
159 7.62009 108.21557 1.62529 1153710.0
160 7.61892 108.21557 0.94742 2347280.0
161 7.71313 125.45766 4.09704 8596660.0
162 7.71192 125.44841 3.40378 9246330.0
163 7.71075 125.44004 2.28729 6375810.0
164 7.71233 125.45612 2.05184 29984300.0
165 7.71377 125.45606 1.60829 4408380.0
166 7.71268 125.46624 8.23535 22305900.0
167 7.7126 125.45606 3.12083 1423340.0
168 7.7147 125.45606 3.86362 1872540.0
169 7.70912 125.45606 9.27298 1430910.0
170 7.71326 125.45606 1.48785 2426240.0
171 7.7265 122.88212 3.58747 4087960.0
172 7.72719 122.86455 3.12739 4372340.0
173 7.72764 122.88505 2.34601 14982700.0
174 7.72692 122.87745 2.10632 9521690.0
175 7.72761 122.85897 8.23764 15278900.0
176 7.72733 122.86849 0.01717 1403060.0
177 7.40235 116.66073 1.27229 21932400.0
178 7.40256 116.66204 7.74174 29520500.0
179 7.39995 116.66204 2.34603 2055250.0
180 7.40084 116.66204 3.13385 1243970.0
181 7.40311 116.66204 7.8277 26051900.0
182 7.83767 111.50196 4.63855 6743040.0
183 7.8361 111.49422 3.12581 2982460.0
184 7.8362 111.49894 2.17903 18518200.0
185 7.83555 111.49458 1.70456 6842720.0
186 7.83605 111.50268 1.28008 11299900.0
187 7.83787 111.4921 0.71056 1380160.0
188 7.83674 111.4921 0.99827 1392800.0
189 7.84068 111.4921 8.56081 1129310.0
190 7.51326 115.44648 3.77346 5186690.0
191 7.51112 115.4527 1.16681 3718940.0
192 7.51574 115.47232 0.98229 7646220.0
193 7.51483 115.47877 7.8117 24435400.0
194 7.51893 115.46576 8.25811 1232530.0
195 7.51451 115.46576 8.54073 1700950.0
196 7.51426 115.46576 4.64935 2313030.0
197 7.51447 115.46576 0.3306 2304150.0
198 7.47615 124.26877 1.37321 5291020.0
199 7.47523 124.25938 1.18177 13404500.0
200 7.47587 124.28346 8.53723 7274460.0
201 7.47585 124.26877 3.13412 1887610.0
202 7.47825 124.26877 0.36878 1487640.0
203 7.47775 124.26877 9.69756 1238000.0
204 8.54978 118.53976 4.45474 9572140.0
205 8.55078 118.52427 3.95239 4481400.0
206 8.55012 118.5954 3.21416 3249860.0
207 8.55042 118.5421 7.51183 15985000.0
208 8.55007 118.53266 9.7085 1402410.0
209 8.55048 118.53266 3.41875 1385460.0
210 8.55052 118.53266 10.36448 903832.0
211 7.51265 113.85719 1.84405 8296220.0
212 7.51301 113.86634 10.35703 10579100.0
213 7.5101 113.85719 4.46689 2241930.0
214 7.51419 113.85719 3.89414 2418200.0
215 10.37402 115.24381 7.73176 1090330.0
216 10.37416 115.24381 3.94597 960100.0
217 9.71372 109.08128 4.63912 13398900.0
218 9.71636 109.06152 7.53039 4203370.0
219 9.71223 109.08144 10.36435 6780840.0
220 9.71606 109.07086 2.09788 1537660.0
221 10.06935 125.72731 4.72691 1122640.0
222 10.07206 125.72731 2.42966 956977.0
223 9.1335 106.70044 4.72191 11373300.0
224 9.13217 106.7285 1.4835 7196610.0
225 9.12993 106.73162 10.0815 1622030.0
226 9.13202 106.73162 10.59679 1139440.0
227 9.13222 106.73162 5.45978 2879810.0
228 9.13315 106.73162 5.59977 2710430.0
229 9.13242 106.73162 4.91309 4378260.0
230 9.13172 106.73162 4.52613 4378260.0
231 9.13185 106.73162 2.62996 1905710.0
232 9.13195 106.73162 0.83216 2155000.0
233 8.16481 114.69528 4.69906 5801770.0
234 8.16326 114.72127 3.23735 3156150.0
235 8.16035 114.68882 2.69971 3313030.0
236 8.16177 114.6664 2.46486 6479930.0
237 8.16237 114.68564 5.45846 34523600.0
238 8.16242 114.69831 9.14898 18526500.0
239 8.16273 114.68882 4.51214 2908120.0
240 8.1636 114.68882 4.92692 2604360.0
241 9.27874 116.85867 2.58523 7646940.0
242 9.2776 116.86554 2.21572 22757600.0
243 9.2798 116.88614 8.17043 10794800.0
244 9.2772 116.86554 5.48853 12950000.0
245 9.28007 116.87603 10.52272 13306200.0
246 9.27794 116.86554 4.95981 2526220.0
247 9.27558 116.86554 3.74478 1552860.0
248 9.27851 116.86554 1.36932 1301550.0
249 9.2776 116.86554 2.24386 22367100.0
250 9.27851 116.86554 1.49495 1116310.0
251 10.52663 108.48585 5.60056 4588850.0
252 10.52654 108.48585 5.10577 14385300.0
253 10.52738 108.48585 8.15131 1186270.0
254 10.5276 108.48585 4.98909 13101900.0
255 10.52597 108.48585 2.62145 1806040.0
256 10.52618 108.48585 2.23583 2464630.0
257 8.67637 117.62675 3.27094 5345830.0
258 8.67513 117.62473 2.60822 9754740.0
259 8.67464 117.61972 7.75562 14771700.0
260 8.67477 117.6146 5.61385 8836850.0
261 8.67664 117.61394 4.98541 18140600.0
262 8.67357 117.62323 10.52218 23863400.0
263 8.67574 117.61484 9.2641 3094680.0
264 8.6722 117.60701 9.6971 1455060.0
265 8.6766 117.60701 4.67749 4963960.0
266 7.74393 104.68763 4.94785 10345300.0
267 7.74337 104.72685 4.6576 10507400.0
268 7.74305 104.69875 3.86872 23770000.0
269 7.74229 104.67374 5.81919 2661080.0
270 7.74561 104.73788 5.60474 3629590.0
271 7.74352 104.70129 10.53007 1955470.0
272 7.74409 104.70129 3.26984 1518550.0
273 7.74569 104.70129 2.59814 1817590.0
274 7.74746 104.70129 0.46794 803250.0
275 7.73813 104.70129 -1.54526 804550.0
276 8.63082 116.05102 4.72809 9731340.0
277 8.63229 116.09551 4.46959 6604620.0
278 8.63176 116.11309 2.69757 10745900.0
279 8.63326 116.10749 1.33986 4024010.0
280 8.63216 116.10473 7.72239 26415300.0
281 8.63195 116.09746 5.79626 6046080.0
282 8.63178 116.09551 3.01003 944065.0
283 8.6294 116.09551 3.37785 1780660.0
284 8.63229 116.09551 4.43681 6155750.0
285 8.63356 116.09551 -1.54269 567213.0
286 7.71267 120.64384 4.73637 6467590.0
287 7.71025 120.65043 4.48773 2877870.0
288 7.71177 120.61878 3.36168 13409400.0
289 7.70872 120.60309 -0.57 1516440.0
290 7.71486 120.60309 -1.56102 1646570.0
291 7.71218 120.60309 2.68759 2124580.0
292 7.71066 120.60309 7.16998 2534810.0
293 7.17991 114.88545 4.75044 3180560.0
294 7.18233 114.88545 3.07008 2241090.0
295 8.32951 116.06976 4.74832 8509630.0
296 8.32076 116.06755 3.06357 4841560.0
297 8.32002 116.06526 2.54287 3520080.0
298 6.72954 118.87839 3.68713 12743700.0
299 6.73184 118.92703 3.36798 3493380.0
300 6.73019 118.88289 2.54599 3021540.0
301 6.73017 118.8831 0.88451 22514800.0
302 6.73036 118.87161 -0.59251 4991740.0
303 6.7295 118.88104 8.30914 12131600.0
304 6.72839 118.88289 3.05597 1162920.0
305 7.27616 120.94254 2.2385 12058500.0
306 7.27815 120.91727 1.1872 4282380.0
307 7.27768 120.92816 0.48874 5480860.0
308 7.27971 120.92816 -0.05256 15469200.0
309 7.27967 120.92816 4.40451 1699290.0
310 7.27871 120.92816 1.67464 2253250.0
311 7.27742 120.92816 0.88464 2499380.0
312 7.27854 120.92816 0.20234 2573850.0
313 7.28012 120.92816 -0.58888 1843610.0
314 7.45067 117.99664 1.79983 6905090.0
315 7.45245 118.04188 0.48332 3873470.0
316 7.45303 118.04036 -1.54386 16927600.0
317 7.45115 118.01895 -0.58258 2239470.0
318 7.45267 118.01895 1.25617 12608200.0
319 9.3646 123.26699 4.3149 27356300.0
320 9.36363 123.26448 3.27135 12455300.0
321 9.36379 123.27606 1.63292 4966230.0
322 9.36255 123.25026 5.6727 5222100.0
323 9.36239 123.25469 10.24729 1316820.0
324 9.3632 123.25469 2.12046 1745480.0
325 10.26136 126.88573 3.56817 5288590.0
326 10.25933 126.87529 2.25215 3092820.0
327 10.26502 126.87188 6.01259 4277430.0
328 10.25843 126.90864 5.22406 3007090.0
329 10.2566 126.86028 7.8864 1237340.0
330 10.26384 126.86028 1.35868 1461090.0
331 10.26037 126.86028 5.50861 3153760.0
332 8.8467 121.36836 3.555 4766720.0
333 8.84749 121.3438 1.1531 4658040.0
334 8.84581 121.36614 5.67952 3366220.0
335 8.84765 121.36648 10.25399 12866200.0
336 8.84677 121.32789 5.51493 3100380.0
337 8.84747 121.32789 5.21423 2439330.0
338 8.84708 121.32789 3.2485 3053230.0
339 8.84886 121.32789 0.84798 1058220.0
340 7.90433 117.9618 4.21213 10709600.0
341 7.90272 117.98396 3.82058 3527160.0
342 7.90509 117.98122 2.11659 32113300.0
343 7.90365 117.98628 1.15648 4325320.0
344 7.90446 117.9736 8.84202 23186900.0
345 7.90662 117.9861 8.22603 14353300.0
346 7.90401 117.94972 1.35609 4624340.0
347 7.90532 117.94972 3.5072 4346050.0
348 7.90087 117.94972 4.81132 1313380.0
349 7.90545 117.94972 5.19807 1401190.0
350 8.24787 112.57992 4.78512 6179380.0
351 8.24681 112.59791 4.21537 2973380.0
352 8.24589 112.57125 3.62772 9430840.0
353 8.24702 112.57341 3.4354 15330100.0
354 8.24572 112.57264 2.10447 13316500.0
355 8.24564 112.54454 5.20965 4279030.0
356 8.24715 112.548 8.81577 13516000.0
357 8.24441 112.59126 1.55566 2138460.0
358 8.8186 122.44357 4.40761 8765980.0
359 8.81764 122.42814 3.71301 12524600.0
360 8.81726 122.421 5.20965 4446280.0
361 8.81376 122.42255 7.91072 1862210.0
362 8.81786 122.42255 7.47638 1252360.0
363 8.8174 122.42255 4.79587 2536290.0
364 7.46309 112.71911 4.61108 8515240.0
365 7.46607 112.72809 4.34557 5405070.0
366 7.46468 112.7317 3.71114 2678270.0
367 7.46712 112.71911 2.95132 15827400.0
368 7.462 112.71911 1.54171 1811410.0
369 7.46535 112.71911 2.34285 1827060.0
370 7.46357 112.71911 4.78819 6115960.0
371 7.46544 112.71911 5.2917 1043740.0
372 7.8473 116.82251 4.59332 4942720.0
373 7.84502 116.83796 4.32029 5609990.0
374 7.84729 116.86484 3.0626 8138390.0
375 7.84873 116.81823 2.75992 12497400.0
376 7.84774 116.8479 7.47666 22339800.0
377 7.84804 116.82709 5.27852 8616000.0
378 7.84749 116.83796 9.76637 1595380.0
379 9.76681 121.0223 4.54103 8632920.0
380 9.76579 120.98311 3.09887 6422290.0
381 9.76697 120.98311 2.75589 5599240.0
382 9.76803 121.01001 5.27886 22159000.0
383 9.76579 120.98311 3.23574 4983490.0
384 9.76624 120.98311 0.62723 1633770.0
385 9.76429 120.98311 0.86586 652982.0
386 9.76697 120.98311 2.85035 3635380.0
387 9.44952 121.45759 4.54813 28556600.0
388 9.44914 121.45541 4.16987 13695000.0
389 9.44772 121.45759 2.76226 6411180.0
390 9.45045 121.45759 7.38209 1545700.0
391 9.44956 121.45759 0.86102 995682.0
392 9.44751 121.45759 2.16379 1023940.0
393 9.44881 121.45759 0.79249 1319500.0
394 9.09425 107.28848 4.47888 25713800.0
395 9.09489 107.27307 3.9215 12429200.0
396 9.09407 107.28936 2.93902 8608230.0
397 9.0938 107.28454 2.76968 5526510.0
398 9.09531 107.28613 7.66598 11231500.0
399 9.09376 107.28454 9.44355 9338230.0
400 9.0916 107.28454 7.95459 1695370.0
401 9.09535 107.28454 3.23462 2732940.0
402 9.09144 107.28454 2.09486 1797670.0
403 9.09282 107.28454 0.47607 1452180.0
404 9.09218 107.28454 9.76949 767917.0
405 7.6568 122.60099 4.48268 7102620.0
406 7.65902 122.59603 2.84427 18236900.0
407 7.65542 122.60099 0.6446 3203470.0
408 7.65877 122.62499 7.9679 13632900.0
409 7.65799 122.60099 9.40811 1360390.0
410 7.65851 122.60099 9.76225 1955600.0
411 7.659 122.60099 3.90692 3547650.0
412 7.9747 114.89478 3.27796 16678700.0
413 7.97468 114.89489 2.83316 7147290.0
414 7.97539 114.89478 1.84753 21181000.0
415 7.975 114.91411 0.80056 5379230.0
416 7.97003 114.89478 4.44894 1363000.0
417 7.98177 114.89478 9.76638 1236000.0
418 8.31239 118.36914 3.90561 3350470.0
419 8.31444 118.34911 3.26617 4662660.0
420 8.31558 118.34935 1.83545 12078400.0
421 8.31476 118.34445 7.95892 12793700.0
422 8.31418 118.36873 7.68927 12571800.0
423 8.31785 118.34445 9.04684 1323500.0
424 8.31447 118.34445 4.19043 1430410.0
425 8.31526 118.34445 4.45022 1422400.0
426 8.31706 118.34445 -0.11595 1604890.0
427 8.31409 118.34445 0.86205 3843860.0
428 7.67763 118.86824 4.081 4185140.0
429 7.67859 118.87139 3.87422 11911200.0
430 7.67904 118.86974 3.10471 24062800.0
431 7.67746 118.86974 7.91716 13732600.0
432 7.67889 118.86974 2.70668 2602230.0
433 7.68022 118.86974 -0.0933 877622.0
434 7.67955 118.86974 3.23935 17460600.0
435 7.91642 117.45859 3.24382 7835090.0
436 7.91801 117.46729 4.36861 7204530.0
437 7.9148 117.46729 3.11351 4457450.0
438 6.88953 114.78873 2.33948 4633400.0
439 6.88737 114.79854 1.10057 16314900.0
440 6.88785 114.79931 7.91423 9042550.0
441 6.88973 114.79612 7.69712 1884210.0
442 6.88853 114.79612 4.37665 2417650.0
443 6.88623 114.79612 3.27072 1861260.0
444 6.89029 114.79612 0.46824 1518650.0
445 6.88837 114.79612 3.86993 1009180.0
446 6.89014 114.79612 3.52035 724112.0
447 6.8898 114.79612 7.42643 945901.0
448 6.88741 114.79612 8.84309 1153360.0
449 8.46131 119.91262 3.86788 4544550.0
450 8.46121 119.91105 1.79366 24660000.0
451 8.46004 119.89747 1.38958 5972410.0
452 8.46329 119.89541 -0.09912 3070690.0
453 8.4614 119.91708 -1.23142 3508860.0
454 8.46219 119.87668 -2.29884 3243080.0
455 8.46066 119.89411 6.89239 13496300.0
456 8.46209 119.90594 8.91894 9092990.0
457 8.46145 119.89747 4.3601 1526190.0
458 8.46083 119.89747 3.19091 2102430.0
459 8.46228 119.89747 2.31393 1759240.0
460 8.4595 119.89747 2.69591 1562880.0
461 8.93395 117.31043 4.64747 5222240.0
462 8.9343 117.31032 2.05966 18610500.0
463 8.93448 117.30735 1.77969 12861800.0
464 8.93402 117.345 0.92565 3691910.0
465 8.93256 117.29864 6.91111 1949330.0
466 8.93557 117.29864 4.3761 1600500.0
467 8.93672 117.29864 3.86337 2326040.0
468 8.93403 117.29864 3.52094 2491600.0
469 8.93317 117.29864 1.44873 7374790.0
470 8.92786 117.29864 5.99852 647281.0
471 8.83563 109.10785 2.05451 5770290.0
472 8.83527 109.10499 1.41117 3538220.0
473 8.83575 109.1173 7.41661 11366000.0
474 8.83218 109.10499 4.65821 2067190.0
475 8.83407 109.10499 5.97347 1023250.0
476 8.83913 109.10499 1.78408 1563630.0
477 8.83889 109.10499 0.90024 856945.0
478 10.95247 116.6984 4.5075 4043530.0
479 10.95326 116.68487 7.41987 5532910.0
480 10.95126 116.68688 8.8658 2829370.0
481 10.95283 116.68688 1.32217 2243880.0
482 10.95103 116.68688 0.78726 1940750.0
483 10.95289 116.68688 6.01768 794456.0
484 7.91757 120.03859 4.23852 4202400.0
485 7.91288 120.06045 3.3319 4067420.0
486 7.91285 120.01979 10.95576 2648400.0
487 7.91002 120.01979 0.18941 1744460.0
488 9.3308 103.36916 3.16617 4506320.0
489 9.32901 103.37278 7.36488 1231700.0
490 9.35218 120.04487 4.72825 4135850.0
491 9.35276 120.05191 4.25941 11723500.0
492 9.35368 120.05551 2.76801 5650230.0
493 9.35312 120.04596 3.82186 1599440.0
494 9.35442 120.04596 -1.23912 2573950.0
495 9.34785 120.04596 -0.16987 828970.0
496 9.35494 120.04596 8.82381 706379.0
497 9.52501 110.31224 4.74078 5573690.0
498 9.52131 110.29376 4.24753 3787710.0
499 9.52395 110.33251 3.94354 29907200.0
500 9.52463 110.33013 0.1234 3124140.0
501 9.52356 110.32957 9.35775 24293400.0
502 9.52262 110.33569 8.37875 6964260.0
503 9.52202 110.33681 5.96458 3856780.0
504 9.52744 110.33251 -1.2451 922618.0
505 9.52218 110.33251 1.91404 3744890.0
506 9.52395 110.33251 7.52856 1435470.0
507 9.52478 110.33251 3.83054 20194600.0
508 8.37591 116.08799 4.78756 17148100.0
509 8.37466 116.08681 3.84385 4922670.0
510 8.3768 116.08681 2.75969 13090500.0
511 8.37352 116.10085 1.39834 3220690.0
512 8.37764 116.08681 3.49227 1070630.0
513 8.37761 116.08681 4.44489 2334880.0
514 7.55023 121.96734 4.78885 11012500.0
515 7.54974 121.94229 4.45684 11008500.0
516 7.54998 121.94745 8.36443 20977200.0
517 7.54747 121.93922 3.84347 2523300.0
518 7.54786 121.93922 3.94832 2148910.0
519 7.54978 121.93922 7.73079 32142200.0
520 7.72215 117.85933 4.7462 3436270.0
521 7.72703 117.84688 4.52638 12727300.0
522 7.72977 117.86916 2.74966 5017320.0
523 7.7224 117.84647 0.29552 4579380.0
524 7.72859 117.8527 -0.18328 4883020.0
525 7.72781 117.8629 8.36555 3693650.0
526 7.72907 117.8629 9.50104 1242630.0
527 7.72475 117.8629 0.09915 1812760.0
528 7.72749 117.8629 1.91892 1546090.0
529 7.72905 117.8629 1.27163 21806000.0
530 8.6671 120.97319 4.53319 43493000.0
531 8.66689 120.96657 3.05863 14499500.0
532 8.66634 120.97319 2.72856 15348500.0
533 8.66571 120.96974 2.2031 7396830.0
534 8.66552 120.97319 1.38914 18757100.0
535 8.66529 120.97052 0.30927 7618210.0
536 8.66599 120.95903 7.19254 3803530.0
537 8.66638 120.96424 7.74032 2803540.0
538 8.66783 120.97319 3.88744 1799670.0
539 8.66758 120.97319 -0.1942 2498990.0
540 8.66259 120.97319 6.99523 1290550.0
541 8.33906 120.13241 4.60705 25823200.0
542 8.33762 120.13278 3.65133 14053100.0
543 8.33838 120.1405 2.72694 10376500.0
544 8.33791 120.13241 2.05484 24059300.0
545 8.3378 120.13241 7.20057 1356670.0
546 8.33734 120.13241 2.59954 8130420.0
547 8.33906 120.13241 1.11126 763679.0
548 8.40873 118.0544 2.59721 3885440.0
549 8.41225 118.04228 4.61412 1954130.0
550 8.41138 118.04228 2.74858 2570340.0
551 8.41208 118.04228 7.42485 1772020.0
552 7.19299 116.12351 3.88247 15586900.0
553 7.19294 116.13579 3.06037 19449800.0
554 7.19271 116.13251 2.19356 10146200.0
555 7.19191 116.12373 8.40351 19820800.0
556 7.19141 116.13354 2.72925 4658960.0
557 7.19222 116.13354 1.12129 1886820.0
558 7.19477 116.13354 -0.18983 1344060.0
559 7.19414 116.13354 0.30939 1464390.0
560 7.19374 116.13354 1.80243 9007700.0
561 7.19072 116.13354 7.00969 17068500.0
562 6.99697 116.92743 3.06446 10046200.0
563 6.99821 116.90663 2.81062 8812820.0
564 6.99874 116.91981 2.20885 5624450.0
565 6.99796 116.92049 1.38839 26041700.0
566 6.99847 116.9157 1.1373 14410800.0
567 6.9969 116.91437 0.31506 8905630.0
568 6.99834 116.92962 -0.13246 5546170.0
569 6.99517 116.91989 -0.53545 1156050.0
570 7.42271 119.74335 4.37141 8291200.0
571 7.42118 119.75565 3.4168 6481770.0
572 7.42261 119.75157 1.39136 18381200.0
573 7.42235 119.73701 -0.11834 5755050.0
574 7.42267 119.75734 7.01836 13933700.0
575 7.42413 119.75734 3.63762 1891250.0
576 7.42374 119.75734 1.92424 1955440.0
577 7.42279 119.75734 1.14418 2491250.0
578 7.42254 119.75734 0.79953 1402990.0
579 7.42119 119.75734 0.40977 2253440.0
580 7.4229 119.75734 0.13304 1848090.0
581 7.42475 119.75734 10.45994 923112.0
582 7.42119 119.75734 0.31646 1977000.0
583 10.46575 128.33272 3.23714 2987240.0
584 10.46415 128.29403 2.9298 1390240.0
585 10.46957 128.29403 3.63106 1341200.0
586 10.4643 128.29403 1.92264 4146500.0
587 10.46688 128.29403 2.3659 6454670.0
588 8.73277 120.48997 4.35419 3652840.0
589 8.73489 120.4813 4.14366 11226500.0
590 8.7354 120.49345 3.42868 5174230.0
591 8.73684 120.50241 1.55309 3037720.0
592 8.7353 120.48419 7.85999 3344000.0
593 8.73394 120.50241 7.41357 16273400.0
594 8.73553 120.50241 7.57679 13090500.0
595 8.73193 120.50241 0.39007 1345360.0
596 8.73888 120.50241 -0.52433 978467.0
597 7.57413 120.66638 4.14941 3123360.0
598 7.57169 120.63885 3.41316 10281100.0
599 7.57178 120.66705 2.80794 7184200.0
600 7.57188 120.64841 1.5404 22505800.0
601 7.5727 120.64012 -0.26915 11318000.0
602 7.57278 120.68988 -0.56219 6885200.0
603 7.57162 120.65112 7.84773 13659400.0
604 7.57178 120.66481 3.85843 2346540.0
605 7.56969 120.66481 3.09992 1959300.0
606 7.5761 120.66481 0.37389 2580860.0
607 7.84979 121.12811 4.36956 6117280.0
608 7.84994 121.11532 3.40282 3253430.0
609 7.84999 121.11532 2.9154 10267700.0
610 7.85005 121.12226 2.30282 19361300.0
611 7.85053 121.11309 1.53446 7881010.0
612 7.85209 121.11712 0.84368 5712570.0
613 7.85025 121.11225 0.39899 22756200.0
614 7.85014 121.10936 -0.26462 5346300.0
615 7.84471 121.11712 -0.53547 2590570.0
616 7.84975 121.11712 4.15154 1577420.0
617 8.64302 119.47884 4.20737 14102000.0
618 8.64228 119.47609 2.99349 16591400.0
619 8.64151 119.50007 0.86788 6970910.0
620 8.64083 119.43283 0.41542 4025820.0
621 8.64306 119.48784 7.84123 13297700.0
622 8.64267 119.48871 7.55404 2277680.0
623 8.64406 119.48871 6.62725 1474010.0
624 8.64137 119.48871 6.06349 1319060.0
625 8.64367 119.48871 3.39802 1928060.0
626 6.6458 110.25107 2.2045 4487310.0
627 6.64697 110.25339 8.2627 22672600.0
628 6.64862 110.2466 6.07032 1297700.0
629 6.64507 110.2466 4.5643 2589500.0
630 6.64822 110.2466 4.11981 2546440.0
631 6.64664 110.2466 3.01367 2943030.0
632 8.26392 110.24534 4.12516 3534990.0
633 8.26541 110.27095 3.01252 3575960.0
634 8.26737 110.25107 2.20336 4752030.0
635 8.26259 110.25107 4.58145 2839990.0
636 8.26792 110.25107 7.94253 953740.0
637 8.56554 122.16929 4.19434 4545560.0
638 8.56289 122.15674 3.98384 12311200.0
639 8.5639 122.16218 2.25237 5471840.0
640 8.56593 122.17437 0.68177 4539800.0
641 8.56382 122.16929 7.87327 2552650.0
642 8.5665 122.16929 1.49429 1424700.0
643 8.56027 122.16929 1.78048 1572310.0
644 8.56486 122.16929 3.38976 6015800.0
645 8.4175 118.89147 3.97248 3581400.0
646 8.41786 118.84735 1.48779 8015410.0
647 8.421 118.83875 7.83895 2339490.0
648 8.41677 118.83875 4.24266 1253880.0
649 8.48986 117.29473 1.50069 5566660.0
650 8.49271 117.30962 0.87557 2517680.0
651 8.48984 117.30962 2.13551 7634870.0
652 7.76484 119.27966 4.23905 14219200.0
653 7.76302 119.24428 3.99838 5404980.0
654 7.76539 119.27622 3.71845 3194980.0
655 7.76414 119.28143 2.55507 34842800.0
656 7.76508 119.29966 1.93255 7705200.0
657 7.76688 119.28327 1.76746 9995010.0
658 7.76644 119.29224 0.68225 4401740.0
659 7.76595 119.28006 8.48788 14029400.0
660 7.76879 119.28865 8.24646 2935110.0
661 7.89407 115.99982 4.25291 3580040.0
662 7.88663 115.97659 3.99615 10164600.0
663 7.88599 115.96805 3.27988 3080690.0
664 7.88853 116.02066 1.46592 14658800.0
665 7.88954 116.02066 0.85872 13894900.0
666 7.88829 116.02066 8.22949 14483300.0
667 7.88903 116.02066 1.61614 9725230.0
668 6.85976 111.17792 7.44058 127941000.0
669 8.14919 108.03161 4.28968 6878820.0
670 8.15016 108.02585 7.91516 13957000.0
671 7.91275 123.41923 4.35469 8983650.0
672 7.91337 123.42339 1.51894 17838000.0
673 7.99599 121.67008 1.48253 18689800.0
674 8.0052 120.06512 4.3307 15591100.0
675 8.00696 120.09148 1.50189 5906570.0
676 8.07675 123.65035 1.46097 4557470.0
677 8.07918 123.65035 4.34377 5494780.0
678 6.94459 112.75272 7.63773 20615200.0
;
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 . aliased 6.891 ppm . . . 4.764 . . 36771 1
2 . . N 15 HN 1 aliased 28.009 ppm . . . 116.556 . . 36771 1
3 . . H 1 HN . aliased 14.999 ppm . . . 4.764 . . 36771 1
stop_
save_