Content for NMR-STAR saveframe, "peak_list_1"
save_peak_list_1
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_1
_Spectral_peak_list.Entry_ID 15159
_Spectral_peak_list.ID 1
_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.Experiment_ID 4
_Spectral_peak_list.Experiment_name '2D 1H-1H NOESY'
_Spectral_peak_list.Number_of_spectral_dimensions 2
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
# Number of dimensions 2
#INAME 1 H
#INAME 2 H
1 8.353 8.358 2 U 6.196e+04 0.00e+00 m 0 9 9 0
3 8.124 8.124 2 U 8.569e+05 0.00e+00 m 0 19 19 0
10 4.221 4.221 2 U 9.085e+04 0.00e+00 m 0 21 21 0
15 1.741 8.124 2 U 5.380e+03 0.00e+00 m 0 23 19 0
17 1.741 1.741 2 U 3.300e+06 0.00e+00 m 0 23 23 0
18 1.741 1.652 2 U 2.579e+05 0.00e+00 m 0 23 24 0
20 1.741 2.209 2 U 1.451e+04 0.00e+00 m 0 23 28 0
21 1.652 8.124 2 U 1.526e+04 0.00e+00 m 0 24 19 0
23 1.652 1.741 2 U 3.193e+05 0.00e+00 m 0 24 23 0
24 1.652 1.652 2 U 2.029e+06 0.00e+00 m 0 24 24 0
26 1.652 2.209 2 U 7.382e+03 0.00e+00 m 0 24 28 0
27 2.302 8.124 2 U 3.393e+03 0.00e+00 m 0 27 19 0
29 2.302 1.741 2 U 1.746e+04 0.00e+00 m 0 27 23 0
30 2.302 1.652 2 U 1.408e+04 0.00e+00 m 0 27 24 0
31 2.302 2.293 2 U 4.801e+05 0.00e+00 m 0 27 27 0
32 2.302 2.209 2 U 5.332e+04 0.00e+00 m 0 27 28 0
33 2.218 8.124 2 U 3.177e+03 0.00e+00 m 0 28 19 0
35 2.218 1.741 2 U 1.432e+04 0.00e+00 m 0 28 23 0
36 2.218 1.652 2 U 9.609e+03 0.00e+00 m 0 28 24 0
37 2.218 2.293 2 U 1.366e+05 0.00e+00 m 0 28 27 0
38 2.218 2.209 2 U 4.638e+05 0.00e+00 m 0 28 28 0
39 8.236 8.236 2 U 4.821e+05 0.00e+00 m 0 37 37 0
41 3.841 8.236 2 U 9.951e+03 0.00e+00 m 0 39 37 0
42 3.841 3.832 2 U 2.399e+05 0.00e+00 m 0 39 39 0
43 8.519 8.519 2 U 2.044e+05 0.00e+00 m 0 60 60 0
49 3.899 8.519 2 U 7.077e+03 0.00e+00 m 0 62 60 0
50 3.899 3.899 2 U 6.116e+05 0.00e+00 m 0 62 62 0
52 3.899 1.169 2 U 1.729e+04 0.00e+00 m 0 62 65 0
53 3.899 0.769 2 U 3.477e+04 0.00e+00 m 0 62 68 0
54 3.899 0.499 2 U 2.435e+04 0.00e+00 m 0 62 73 0
55 1.530 8.519 2 U 1.875e+04 0.00e+00 m 0 64 60 0
57 1.530 1.521 2 U 8.408e+05 0.00e+00 m 0 64 64 0
58 1.530 1.169 2 U 5.203e+04 0.00e+00 m 0 64 65 0
59 1.530 0.769 2 U 3.062e+04 0.00e+00 m 0 64 68 0
60 1.530 0.499 2 U 3.974e+04 0.00e+00 m 0 64 73 0
61 1.169 8.519 2 U 5.041e+03 0.00e+00 m 0 65 60 0
63 1.169 1.521 2 U 6.929e+04 0.00e+00 m 0 65 64 0
64 1.169 1.169 2 U 6.779e+05 0.00e+00 m 0 65 65 0
65 1.169 0.769 2 U 2.102e+04 0.00e+00 m 0 65 68 0
66 1.169 0.499 2 U 2.011e+04 0.00e+00 m 0 65 73 0
67 0.769 8.519 2 U 7.235e+03 0.00e+00 m 0 68 60 0
69 0.769 1.521 2 U 5.462e+04 0.00e+00 m 0 68 64 0
70 0.769 1.169 2 U 2.563e+04 0.00e+00 m 0 68 65 0
71 0.769 0.769 2 U 1.137e+06 0.00e+00 m 0 68 68 0
72 0.769 0.499 2 U 5.492e+04 0.00e+00 m 0 68 73 0
73 0.495 8.519 2 U 4.872e+03 0.00e+00 m 0 69 60 0
75 0.499 1.521 2 U 6.088e+04 0.00e+00 m 0 73 64 0
76 0.499 1.169 2 U 2.367e+04 0.00e+00 m 0 73 65 0
77 0.499 0.769 2 U 5.106e+04 0.00e+00 m 0 73 68 0
78 0.499 0.499 2 U 1.913e+06 0.00e+00 m 0 73 73 0
79 8.617 8.617 2 U 9.928e+04 0.00e+00 m 0 114 114 0
82 3.895 8.617 2 U 1.162e+04 0.00e+00 m 0 116 114 0
83 3.895 3.895 2 U 6.059e+05 0.00e+00 m 0 116 116 0
84 3.895 3.268 2 U 1.039e+05 0.00e+00 m 0 116 117 0
85 3.268 8.617 2 U 1.027e+04 0.00e+00 m 0 117 114 0
87 3.268 3.268 2 U 7.235e+05 0.00e+00 m 0 117 117 0
88 7.308 7.299 2 U 1.734e+05 0.00e+00 m 0 121 121 0
98 5.119 7.299 2 U 4.261e+03 0.00e+00 m 0 123 121 0
99 5.119 5.119 2 U 2.060e+04 0.00e+00 m 0 123 123 0
100 5.119 3.005 2 U 7.987e+03 0.00e+00 m 0 123 125 0
101 5.119 2.704 2 U 1.532e+04 0.00e+00 m 0 123 126 0
102 5.119 6.762 2 U 3.477e+03 0.00e+00 m 0 123 134 0
103 5.119 7.114 2 U 9.205e+03 0.00e+00 m 0 123 135 0
108 3.005 7.299 2 U 1.102e+04 0.00e+00 m 0 125 121 0
109 3.005 5.119 2 U 1.333e+03 0.00e+00 m 0 125 123 0
110 3.005 3.005 2 U 1.709e+05 0.00e+00 m 0 125 125 0
111 3.005 2.704 2 U 7.108e+04 0.00e+00 m 0 125 126 0
112 3.005 6.762 2 U 9.352e+03 0.00e+00 m 0 125 134 0
113 3.005 6.762 2 U 9.352e+03 0.00e+00 m 0 125 134 0
118 2.704 7.299 2 U 9.646e+03 0.00e+00 m 0 126 121 0
119 2.704 5.119 2 U 2.796e+03 0.00e+00 m 0 126 123 0
120 2.704 3.005 2 U 6.670e+04 0.00e+00 m 0 126 125 0
121 2.704 2.704 2 U 6.132e+05 0.00e+00 m 0 126 126 0
122 2.704 6.762 2 U 1.892e+04 0.00e+00 m 0 126 134 0
123 2.704 6.762 2 U 1.892e+04 0.00e+00 m 0 126 134 0
125 2.704 6.557 2 U 4.116e+03 0.00e+00 m 0 126 383 0
132 6.762 6.762 2 U 1.060e+06 0.00e+00 m 0 134 134 0
133 6.762 7.114 2 U 7.644e+03 0.00e+00 m 0 134 135 0
134 6.762 10.363 2 U 2.442e+04 0.00e+00 - 0 134 138 0
143 7.114 7.114 2 U 4.009e+05 0.00e+00 m 0 135 135 0
144 7.114 10.363 2 U 5.480e+02 0.00e+00 - 0 135 138 0
154 10.372 10.368 2 U 1.312e+05 0.00e+00 - 0 138 138 0
158 6.554 7.299 2 U 5.821e+04 0.00e+00 m 0 139 121 0
162 6.554 6.762 2 U 1.940e+04 0.00e+00 m 0 139 134 0
163 6.554 7.114 2 U 7.244e+03 0.00e+00 m 0 139 135 0
165 6.554 6.554 2 U 5.011e+05 0.00e+00 m 0 139 139 0
166 6.554 7.197 2 U 6.339e+03 0.00e+00 m 0 139 141 0
167 6.551 6.764 2 U 1.810e+04 0.00e+00 m 0 139 142 0
174 7.197 10.363 2 U 1.252e+04 0.00e+00 - 0 141 138 0
176 7.197 7.197 2 U 4.709e+05 0.00e+00 m 0 141 141 0
178 6.757 7.299 2 U 1.743e+03 0.00e+00 m 0 142 121 0
183 6.757 7.114 2 U 3.486e+03 0.00e+00 m 0 142 135 0
184 6.757 10.363 2 U 6.490e+02 0.00e+00 - 0 142 138 0
185 6.757 6.554 2 U 2.448e+04 0.00e+00 m 0 142 139 0
186 6.757 7.197 2 U 1.760e+04 0.00e+00 m 0 142 141 0
187 6.757 6.757 2 U 5.579e+05 0.00e+00 m 0 142 142 0
188 9.262 9.262 2 U 7.481e+04 0.00e+00 m 0 145 145 0
193 4.407 9.262 2 U 6.290e+03 0.00e+00 m 0 147 145 0
194 4.407 4.407 2 U -4.461e+03 0.00e+00 m 0 147 147 0
195 4.407 1.737 2 U 1.566e+04 0.00e+00 m 0 147 149 0
196 4.407 2.084 2 U 7.402e+03 0.00e+00 m 0 147 153 0
197 4.407 1.895 2 U 6.397e+03 0.00e+00 m 0 147 154 0
198 1.746 9.262 2 U 3.856e+03 0.00e+00 m 0 149 145 0
200 1.746 1.738 2 U 1.856e+06 0.00e+00 m 0 149 149 0
201 1.746 2.084 2 U 3.494e+04 0.00e+00 m 0 149 153 0
202 1.746 1.895 2 U 8.008e+04 0.00e+00 m 0 149 154 0
205 2.084 1.737 2 U 5.426e+04 0.00e+00 m 0 153 149 0
206 2.084 2.084 2 U 4.739e+05 0.00e+00 m 0 153 153 0
207 2.084 1.895 2 U 1.099e+05 0.00e+00 m 0 153 154 0
208 1.895 9.262 2 U 1.764e+03 0.00e+00 m 0 154 145 0
210 1.895 1.737 2 U 7.830e+04 0.00e+00 m 0 154 149 0
211 1.895 2.084 2 U 9.699e+04 0.00e+00 m 0 154 153 0
212 1.895 1.895 2 U 4.749e+05 0.00e+00 m 0 154 154 0
213 8.578 8.578 2 U 1.780e+05 0.00e+00 m 0 160 160 0
221 4.163 8.578 2 U 1.988e+04 0.00e+00 m 0 162 160 0
222 4.163 4.163 2 U 2.229e+05 0.00e+00 m 0 162 162 0
223 4.163 1.279 2 U 1.474e+04 0.00e+00 m 0 162 164 0
224 4.163 0.769 2 U 5.538e+03 0.00e+00 m 0 162 165 0
225 4.163 0.607 2 U 9.046e+03 0.00e+00 m 0 162 168 0
226 4.163 0.691 2 U 1.112e+04 0.00e+00 m 0 162 169 0
229 1.279 8.578 2 U 1.340e+04 0.00e+00 m 0 164 160 0
231 1.279 1.279 2 U 7.071e+05 0.00e+00 m 0 164 164 0
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233 1.279 0.607 2 U 3.368e+04 0.00e+00 m 0 164 168 0
234 1.279 0.691 2 U 5.160e+04 0.00e+00 m 0 164 169 0
235 1.279 1.416 2 U 1.246e+05 0.00e+00 m 0 164 172 0
236 1.279 1.298 2 U 6.914e+05 0.00e+00 m 0 164 173 0
237 0.769 8.578 2 U 1.253e+04 0.00e+00 m 0 165 160 0
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240 0.769 0.769 2 U 1.137e+06 0.00e+00 m 0 165 165 0
241 0.769 0.607 2 U 2.911e+04 0.00e+00 m 0 165 168 0
242 0.769 0.691 2 U 1.597e+05 0.00e+00 m 0 165 169 0
243 0.769 1.416 2 U 1.745e+04 0.00e+00 m 0 165 172 0
244 0.769 1.298 2 U 1.729e+04 0.00e+00 m 0 165 173 0
247 0.607 1.279 2 U 2.614e+04 0.00e+00 m 0 168 164 0
248 0.607 0.769 2 U 1.660e+04 0.00e+00 m 0 168 165 0
249 0.607 0.607 2 U 1.139e+06 0.00e+00 m 0 168 168 0
250 0.607 0.691 2 U 1.245e+05 0.00e+00 m 0 168 169 0
251 0.607 1.416 2 U 1.909e+04 0.00e+00 m 0 168 172 0
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255 0.691 1.279 2 U 4.871e+04 0.00e+00 m 0 169 164 0
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263 1.416 1.279 2 U 1.135e+05 0.00e+00 m 0 172 164 0
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267 1.416 1.416 2 U 6.050e+05 0.00e+00 m 0 172 172 0
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277 8.464 8.464 2 U 2.452e+05 0.00e+00 m 0 185 185 0
286 4.140 8.464 2 U 4.570e+04 0.00e+00 m 0 187 185 0
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295 1.040 8.464 2 U 8.154e+03 0.00e+00 m 0 189 185 0
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300 1.040 1.004 2 U 2.971e+05 0.00e+00 m 0 189 194 0
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1474 4.518 6.672 1 U 8.235e+03 0.00e+00 m 0 312 352 0
1475 4.163 6.672 1 U 1.072e+04 0.00e+00 m 0 46 352 0
1480 2.056 6.672 1 U 3.572e+03 0.00e+00 m 0 102 352 0
1482 0.769 6.672 1 U 1.218e+04 0.00e+00 m 0 165 352 0
1483 0.769 6.672 1 U 1.218e+04 0.00e+00 m 0 68 352 0
1485 0.415 6.672 1 U 2.687e+03 0.00e+00 r 0 298 352 0
1486 0.415 6.917 1 U 1.207e+04 0.00e+00 r 0 298 353 0
1488 0.691 6.917 1 U 7.939e+03 0.00e+00 m 0 169 353 0
1489 0.732 6.917 1 U 8.130e+03 0.00e+00 m 0 297 353 0
1490 0.769 6.917 1 U 1.179e+04 0.00e+00 m 0 68 353 0
1492 0.691 6.966 1 U 5.810e+03 0.00e+00 m 0 169 346 0
1493 0.732 6.966 1 U 4.748e+03 0.00e+00 m 0 297 346 0
1494 0.769 6.966 1 U 4.796e+03 0.00e+00 m 0 68 346 0
1498 1.980 6.917 1 U 6.803e+03 0.00e+00 m 0 542 353 0
1503 0.769 6.966 1 U 4.796e+03 0.00e+00 m 0 165 346 0
1505 0.769 6.917 1 U 1.179e+04 0.00e+00 m 0 165 353 0
1513 2.362 7.463 1 U 1.110e+03 0.00e+00 m 0 0 602 0
1514 1.332 7.463 1 U 1.718e+03 0.00e+00 m 0 581 602 0
1515 1.561 7.463 1 U 1.876e+03 0.00e+00 m 0 580 602 0
1523 3.512 7.016 1 U 1.986e+03 0.00e+00 m 0 604 0 0
1525 3.953 7.015 1 U 4.484e+03 0.00e+00 m 0 606 0 0
1529 4.221 2.293 1 U 1.144e+03 0.00e+00 m 0 21 27 0
1530 4.221 2.209 1 U 3.457e+03 0.00e+00 m 0 21 28 0
1532 1.411 6.914 1 U 8.641e+03 0.00e+00 m 0 274 282 0
1533 4.163 8.464 1 U 6.663e+04 0.00e+00 m 0 162 185 0
1536 3.005 9.262 1 U 3.357e+03 0.00e+00 m 0 125 145 0
1537 2.704 9.262 1 U 6.611e+03 0.00e+00 m 0 126 145 0
1538 2.847 7.114 1 U 2.264e+04 0.00e+00 m 0 338 135 0
1539 2.551 7.114 1 U 5.921e+03 0.00e+00 m 0 337 135 0
1540 2.704 7.114 1 U 1.281e+04 0.00e+00 m 0 126 135 0
1541 3.005 7.114 1 U 6.568e+03 0.00e+00 m 0 125 135 0
1543 0.812 8.190 1 U 4.137e+03 0.00e+00 m 0 484 479 0
1546 3.728 3.832 1 U 6.743e+04 0.00e+00 m 0 40 39 0
1548 3.300 3.291 1 U 6.897e+05 0.00e+00 m 0 56 56 0
1549 3.337 3.328 1 U 5.505e+05 0.00e+00 m 0 55 55 0
1552 1.989 1.989 1 U 7.911e+05 0.00e+00 m 0 48 48 0
1554 1.748 1.750 1 U 1.900e+06 0.00e+00 m 0 52 52 0
1555 1.625 1.625 1 U 1.790e+06 0.00e+00 m 0 49 49 0
1556 1.553 1.558 1 U 8.539e+05 0.00e+00 m 0 53 53 0
1557 1.989 1.750 1 U 4.061e+04 0.00e+00 m 0 48 52 0
1558 1.989 1.625 1 U 1.140e+05 0.00e+00 m 0 48 49 0
1559 1.989 1.556 1 U 3.237e+04 0.00e+00 m 0 48 53 0
1560 1.553 1.989 1 U 2.289e+04 0.00e+00 m 0 53 48 0
1561 1.625 1.989 1 U 9.959e+04 0.00e+00 m 0 49 48 0
1562 1.748 1.989 1 U 2.494e+04 0.00e+00 m 0 52 48 0
1563 1.748 1.625 1 U 1.955e+05 0.00e+00 m 0 52 49 0
1564 1.625 1.755 1 U 2.260e+05 0.00e+00 m 0 49 52 0
1565 1.625 1.553 1 U 2.196e+05 0.00e+00 m 0 49 53 0
1567 0.880 0.880 1 U 2.691e+06 0.00e+00 m 0 216 216 0
1573 4.427 0.880 1 U 1.188e+04 0.00e+00 m 0 294 216 0
1596 8.190 7.956 1 U 3.817e+04 0.00e+00 m 0 245 259 0
1602 2.556 8.421 1 U 8.430e+03 0.00e+00 m 0 279 266 0
1604 1.401 6.914 1 U 1.317e+04 0.00e+00 m 0 275 282 0
1606 5.721 6.914 1 U 1.281e+03 0.00e+00 m 0 288 282 0
1607 6.102 6.914 1 U -6.500e+01 0.00e+00 m 0 287 282 0
1608 1.639 6.914 1 U 7.237e+03 0.00e+00 m 0 271 282 0
1609 1.793 6.914 1 U 4.240e+03 0.00e+00 m 0 270 282 0
1611 1.639 6.616 1 U 5.781e+03 0.00e+00 m 0 271 528 0
1613 6.672 8.731 1 U 1.122e+04 0.00e+00 m 0 352 333 0
1628 0.406 0.406 1 U 1.730e+06 0.00e+00 m 0 362 362 0
1629 0.483 0.483 1 U 2.099e+06 0.00e+00 m 0 361 361 0
1630 0.406 0.483 1 U 1.810e+05 0.00e+00 m 0 362 361 0
1631 0.483 0.406 1 U 1.440e+05 0.00e+00 m 0 361 362 0
1632 0.483 1.521 1 U 6.672e+04 0.00e+00 m 0 361 360 0
1633 0.406 1.521 1 U 2.934e+04 0.00e+00 m 0 362 360 0
1635 6.557 6.557 1 U 4.892e+05 0.00e+00 m 0 383 383 0
1637 4.170 4.170 1 U 1.899e+05 0.00e+00 m 0 46 46 0
1645 4.170 3.328 1 U 5.905e+03 0.00e+00 m 0 46 55 0
1646 4.170 3.291 1 U 8.783e+03 0.00e+00 m 0 46 56 0
1648 3.300 3.328 1 U 4.834e+05 0.00e+00 m 0 56 55 0
1649 3.337 3.291 1 U 2.643e+05 0.00e+00 m 0 55 56 0
1650 4.522 4.522 1 U 6.586e+05 0.00e+00 m 0 84 84 0
1651 2.737 2.728 1 U 4.624e+05 0.00e+00 m 0 93 93 0
1652 3.268 3.259 1 U 6.751e+05 0.00e+00 m 0 94 94 0
1653 2.356 2.356 1 U 3.178e+05 0.00e+00 m 0 86 86 0
1654 1.691 1.693 1 U 2.586e+06 0.00e+00 m 0 0 0 0
1657 3.268 2.728 1 U 1.652e+04 0.00e+00 m 0 94 93 0
1663 1.790 1.790 1 U 8.789e+05 0.00e+00 m 0 87 87 0
1664 1.467 1.458 1 U 5.954e+05 0.00e+00 m 0 91 91 0
1671 1.790 1.458 1 U 1.833e+04 0.00e+00 m 0 87 91 0
1691 3.347 2.356 1 U -6.641e+04 0.00e+00 r 0 110 572 0
1692 3.636 2.356 1 U -3.211e+04 0.00e+00 r 0 109 572 0
1702 3.347 3.347 1 U 5.246e+05 0.00e+00 m 0 110 110 0
1703 2.056 2.056 1 U 4.739e+05 0.00e+00 m 0 102 102 0
1704 1.791 1.782 1 U 8.698e+05 0.00e+00 m 0 107 107 0
1705 1.663 1.654 1 U 2.865e+06 0.00e+00 m 0 103 103 0
1706 1.900 1.891 1 U 4.033e+05 0.00e+00 m 0 106 106 0
1707 4.094 4.094 1 U 3.362e+05 0.00e+00 m 0 100 100 0
1710 3.636 3.636 1 U 3.713e+05 0.00e+00 m 0 109 109 0
1711 2.056 1.891 1 U 1.093e+05 0.00e+00 m 0 102 106 0
1712 1.900 2.056 1 U 8.752e+04 0.00e+00 m 0 106 102 0
1713 1.791 2.056 1 U 3.955e+04 0.00e+00 m 0 107 102 0
1714 2.056 1.782 1 U 5.082e+04 0.00e+00 m 0 102 107 0
1715 1.791 1.654 1 U 1.976e+05 0.00e+00 m 0 107 103 0
1716 1.900 1.654 1 U 4.821e+04 0.00e+00 m 0 106 103 0
1717 2.056 1.654 1 U 1.097e+05 0.00e+00 m 0 102 103 0
1718 1.663 2.056 1 U 6.737e+04 0.00e+00 m 0 103 102 0
1719 1.791 1.891 1 U 1.282e+05 0.00e+00 m 0 107 106 0
1720 1.663 1.891 1 U 5.562e+04 0.00e+00 m 0 103 106 0
1721 1.663 1.782 1 U 2.012e+05 0.00e+00 m 0 103 107 0
1722 1.900 1.782 1 U 6.503e+04 0.00e+00 m 0 106 107 0
1760 4.522 1.790 1 U 7.528e+03 0.00e+00 m 0 84 87 0
1761 4.522 1.632 1 U 5.285e+03 0.00e+00 m 0 84 0 0
1762 1.675 1.666 1 U 3.198e+06 0.00e+00 m 0 90 90 0
1765 1.790 1.666 1 U 1.871e+05 0.00e+00 m 0 87 90 0
1766 1.675 1.790 1 U 1.638e+05 0.00e+00 m 0 90 87 0
1767 1.675 1.458 1 U 2.262e+04 0.00e+00 m 0 90 91 0
1768 1.467 1.666 1 U 1.306e+04 0.00e+00 m 0 91 90 0
1771 2.737 2.356 1 U 3.278e+03 0.00e+00 m 0 93 86 0
1772 2.356 2.728 1 U 4.681e+03 0.00e+00 m 0 86 93 0
1773 1.467 1.790 1 U 5.670e+03 0.00e+00 m 0 91 87 0
1776 2.737 1.790 1 U -3.800e+01 0.00e+00 m 0 93 87 0
1777 3.268 1.790 1 U 5.176e+03 0.00e+00 m 0 94 87 0
1778 2.356 1.666 1 U 1.515e+04 0.00e+00 m 0 86 90 0
1789 7.308 8.617 1 U 3.781e+03 0.00e+00 m 0 121 114 0
1793 6.554 8.129 1 U 7.500e+01 0.00e+00 m 0 139 374 0
1794 6.762 6.762 1 U 1.060e+06 0.00e+00 m 0 134 134 0
1805 2.704 0.769 1 U 9.320e+03 0.00e+00 m 0 126 68 0
1806 6.762 10.363 1 U 2.442e+04 0.00e+00 - 0 134 138 0
1811 7.114 7.197 1 U 2.611e+04 0.00e+00 m 0 135 141 0
1812 7.197 7.114 1 U 2.053e+04 0.00e+00 m 0 141 135 0
1814 4.407 1.688 1 U 1.622e+04 0.00e+00 m 0 147 150 0
1815 1.697 1.688 1 U 1.960e+06 0.00e+00 m 0 150 150 0
1816 1.697 1.737 1 U 1.490e+06 0.00e+00 m 0 150 149 0
1817 1.746 1.688 1 U 4.250e+05 0.00e+00 m 0 149 150 0
1819 1.697 9.262 1 U 6.720e+03 0.00e+00 m 0 150 145 0
1820 1.697 8.578 1 U 5.038e+03 0.00e+00 m 0 150 160 0
1825 1.895 1.688 1 U 6.369e+04 0.00e+00 m 0 154 150 0
1826 1.895 1.688 1 U 6.369e+04 0.00e+00 m 0 154 150 0
1829 1.692 1.895 1 U 4.604e+04 0.00e+00 m 0 150 154 0
1830 1.688 2.084 1 U 3.846e+04 0.00e+00 m 0 150 153 0
1833 0.607 6.966 1 U 5.335e+03 0.00e+00 m 0 168 346 0
1835 4.163 1.416 1 U 1.450e+04 0.00e+00 m 0 162 172 0
1836 4.163 1.298 1 U 1.405e+04 0.00e+00 m 0 162 173 0
1841 4.163 0.769 1 U 5.538e+03 0.00e+00 m 0 162 68 0
1842 2.576 0.607 1 U 8.346e+03 0.00e+00 m 0 176 168 0
1843 2.576 0.691 1 U 2.199e+04 0.00e+00 m 0 176 169 0
1845 2.576 1.298 1 U 2.256e+04 0.00e+00 m 0 176 173 0
1846 2.576 1.416 1 U 2.330e+04 0.00e+00 m 0 176 172 0
1847 2.576 1.279 1 U 2.030e+04 0.00e+00 m 0 176 164 0
1848 2.576 2.576 1 U 1.273e+06 0.00e+00 m 0 176 176 0
1855 0.607 6.917 1 U 8.984e+03 0.00e+00 m 0 168 353 0
1857 1.416 8.578 1 U 1.852e+04 0.00e+00 m 0 172 160 0
1861 4.163 6.917 1 U 4.037e+03 0.00e+00 m 0 46 353 0
1862 4.163 6.672 1 U 1.072e+04 0.00e+00 m 0 162 352 0
1863 1.416 8.464 1 U 5.484e+03 0.00e+00 m 0 172 185 0
1874 2.576 6.966 1 U 5.780e+03 0.00e+00 m 0 176 346 0
1875 2.576 6.917 1 U 1.096e+04 0.00e+00 m 0 176 353 0
1878 1.298 6.966 1 U 6.237e+03 0.00e+00 m 0 173 346 0
1879 1.298 6.917 1 U 9.893e+03 0.00e+00 m 0 173 353 0
1911 8.190 8.421 1 U 1.083e+04 0.00e+00 m 0 245 266 0
1912 1.040 6.056 1 U 5.441e+03 0.00e+00 m 0 193 329 0
1913 4.140 6.056 1 U 1.017e+03 0.00e+00 m 0 187 329 0
1915 4.427 4.808 1 U 1.618e+04 0.00e+00 m 0 294 213 0
1916 4.808 4.427 1 U -1.537e+03 0.00e+00 m 0 213 294 0
1917 1.013 7.696 1 U 1.563e+04 0.00e+00 m 0 194 211 0
1918 0.834 7.696 1 U 1.895e+03 0.00e+00 m 0 193 211 0
1921 1.040 6.516 1 U 2.858e+03 0.00e+00 m 0 193 330 0
1925 3.645 8.181 1 U 1.929e+03 0.00e+00 m 0 240 245 0
1926 3.728 8.406 1 U 6.454e+03 0.00e+00 m 0 239 235 0
1927 3.645 8.406 1 U 7.974e+03 0.00e+00 m 0 240 235 0
1928 4.660 8.181 1 U 3.032e+04 0.00e+00 m 0 247 245 0
1935 0.732 0.732 1 U 1.936e+06 0.00e+00 m 0 297 297 0
1936 0.415 0.732 1 U 4.009e+04 0.00e+00 m 0 298 297 0
1937 0.732 0.415 1 U 5.598e+04 0.00e+00 m 0 297 298 0
1938 0.415 0.415 1 U 1.143e+06 0.00e+00 m 0 298 298 0
1939 0.732 1.619 1 U 3.920e+04 0.00e+00 m 0 297 296 0
1940 0.415 1.619 1 U 2.944e+04 0.00e+00 m 0 298 296 0
1948 0.718 0.718 1 U 2.382e+06 0.00e+00 m 0 424 424 0
1952 0.718 7.265 1 U 1.565e+04 0.00e+00 m 0 424 419 0
1953 0.718 7.608 1 U 2.463e+03 0.00e+00 m 0 424 432 0
1956 2.675 0.718 1 U 6.369e+03 0.00e+00 m 0 409 424 0
1964 8.287 8.412 1 U 1.449e+04 0.00e+00 m 0 405 388 0
1965 8.412 8.287 1 U 2.269e+04 0.00e+00 m 0 388 405 0
1966 3.938 8.421 1 U 1.322e+04 0.00e+00 m 0 237 266 0
1968 3.938 3.319 1 U 8.714e+04 0.00e+00 m 0 237 261 0
1977 -0.286 6.516 1 U 1.792e+03 0.00e+00 m 0 189 330 0
1984 0.560 0.560 1 U 1.669e+06 0.00e+00 m 0 463 463 0
1985 0.686 0.560 1 U 1.057e+05 0.00e+00 m 0 472 463 0
1989 0.686 0.686 1 U 2.333e+06 0.00e+00 m 0 472 472 0
1990 0.560 0.871 1 U 3.739e+04 0.00e+00 m 0 463 470 0
1991 0.686 0.871 1 U 4.619e+04 0.00e+00 m 0 472 470 0
1992 0.560 1.115 1 U 2.652e+04 0.00e+00 m 0 463 469 0
1993 0.686 1.115 1 U 3.841e+04 0.00e+00 m 0 472 469 0
1994 0.560 0.686 1 U 1.055e+05 0.00e+00 m 0 463 472 0
1995 0.880 0.686 1 U 3.994e+04 0.00e+00 m 0 470 472 0
1996 1.124 0.686 1 U 2.903e+04 0.00e+00 m 0 469 472 0
1997 1.296 0.686 1 U 2.660e+04 0.00e+00 m 0 462 472 0
1998 0.560 1.296 1 U 6.180e+04 0.00e+00 m 0 463 462 0
1999 0.686 1.296 1 U 2.596e+04 0.00e+00 m 0 472 462 0
2010 5.028 4.827 1 U -2.283e+04 0.00e+00 m 0 481 358 0
2012 0.812 0.812 1 U 1.252e+06 0.00e+00 m 0 484 484 0
2018 6.616 7.030 1 U 1.462e+03 0.00e+00 m 0 528 530 0
2025 0.812 0.483 1 U 3.599e+04 0.00e+00 r 0 484 361 0
2026 0.812 0.406 1 U 2.068e+04 0.00e+00 r 0 484 362 0
2027 0.483 0.812 1 U 4.645e+04 0.00e+00 m 0 361 484 0
2028 0.406 0.812 1 U 2.357e+04 0.00e+00 m 0 362 484 0
2034 1.980 6.966 1 U 5.955e+03 0.00e+00 r 0 542 346 0
2040 0.607 6.672 1 U 2.309e+03 0.00e+00 r 0 168 352 0
2042 2.535 6.616 1 U 2.072e+04 0.00e+00 r 0 314 528 0
2043 0.880 7.956 1 U 1.081e+04 0.00e+00 r 0 216 259 0
2044 0.495 6.917 1 U 2.060e+04 0.00e+00 r 0 69 353 0
2047 1.416 6.917 1 U 7.684e+03 0.00e+00 r 0 172 353 0
2048 0.493 6.672 1 U 8.948e+03 0.00e+00 r 0 564 352 0
2049 0.495 6.680 1 U 1.472e+04 0.00e+00 r 0 69 352 0
2050 2.532 7.956 1 U 3.765e+03 0.00e+00 r 0 250 259 0
2051 2.706 7.956 1 U 2.029e+03 0.00e+00 r 0 249 259 0
2053 6.672 7.114 1 U 5.854e+03 0.00e+00 r 0 352 135 0
2054 4.673 2.524 1 U 2.035e+04 0.00e+00 - 0 512 314 0
2055 2.576 0.732 1 U 1.891e+04 0.00e+00 - 0 176 297 0
2056 2.576 0.415 1 U 1.553e+04 0.00e+00 - 0 176 298 0
2058 0.493 6.758 1 U 6.611e+03 0.00e+00 r 0 564 142 0
2059 0.675 6.760 1 U 2.556e+04 0.00e+00 r 0 568 142 0
2060 0.680 8.190 1 U 2.766e+04 0.00e+00 r 0 471 479 0
2061 0.671 6.557 1 U 1.506e+04 0.00e+00 r 0 568 139 0
2063 0.557 7.198 1 U 8.890e+03 0.00e+00 r 0 564 141 0
2064 0.675 7.198 1 U 9.263e+03 0.00e+00 r 0 568 141 0
2065 0.478 6.557 1 U 6.819e+03 0.00e+00 r 0 565 139 0
2067 1.285 6.672 1 U 2.138e+04 0.00e+00 r 0 168 352 0
2069 0.830 6.717 1 U 1.138e+04 0.00e+00 r 0 194 201 0
2071 1.428 7.777 1 U 1.908e+04 0.00e+00 r 0 275 524 0
2072 1.401 6.616 1 U 1.642e+04 0.00e+00 r 0 275 528 0
;
loop_
_Spectral_dim.ID
_Spectral_dim.Atom_type
_Spectral_dim.Atom_isotope_number
_Spectral_dim.Spectral_region
_Spectral_dim.Magnetization_linkage_ID
_Spectral_dim.Sweep_width
_Spectral_dim.Sweep_width_units
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
1 H 1 H . 12 . . . 15159 1
stop_
save_