Content for NMR-STAR saveframe, "spectral_peak_list_2"
save_spectral_peak_list_2
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_2
_Spectral_peak_list.Entry_ID 15317
_Spectral_peak_list.ID 2
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $NC_sample
_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 '3D 1H-13C NOESY aliph'
_Spectral_peak_list.Number_of_spectral_dimensions 3
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
w1 w2 w3 Data Height
41.696 1.877 1.387 365473
39.001 1.041 3.941 875389
45.600 7.847 1.052 443717
45.801 3.923 1.051 1269597
34.014 2.372 4.021 584599
50.393 1.634 2.010 246723
31.555 1.052 1.859 439291
36.193 2.007 2.287 7065676
31.940 0.770 4.342 222219
53.732 0.752 2.313 374486
36.085 7.628 2.168 138335
35.122 0.812 4.013 252322
32.493 8.181 1.879 1225781
36.452 0.997 3.736 1520158
50.282 1.043 1.440 967044
50.208 1.151 1.457 1031788
40.997 7.017 0.762 186246
36.832 8.685 0.836 131193
33.045 8.941 0.575 140842
37.344 8.810 0.493 143973
45.629 3.084 0.819 397308
45.365 7.368 0.882 2682168
40.716 3.888 1.928 259030
49.977 7.022 0.776 317461
46.006 7.611 0.846 437163
47.556 7.635 0.530 180923
47.539 3.184 0.531 453544
41.942 1.014 1.234 399951
48.854 8.422 0.643 249359
48.813 3.433 0.634 201105
49.188 8.423 0.858 120300
50.246 1.736 0.866 666940
32.638 8.807 1.961 164300
47.619 1.480 0.970 347959
46.388 2.969 1.093 284397
45.079 4.143 0.884 978754
46.315 3.430 0.289 163241
48.660 8.975 0.988 377470
48.480 7.838 0.968 317594
45.221 7.331 1.032 82423
40.983 3.116 3.845 239943
45.852 7.835 0.951 349312
52.761 1.003 3.115 113612
44.541 7.796 0.902 138995
43.745 3.427 4.207 681786
42.331 8.932 0.767 149393
31.935 2.151 3.946 224301
31.979 7.972 3.946 172325
54.742 3.090 1.552 181157
54.785 3.101 1.800 221591
42.391 2.293 2.306 666161
49.984 2.780 0.776 535664
46.009 2.780 0.848 1014458
46.623 8.927 0.931 446861
31.578 0.863 2.707 189065
31.949 7.047 3.978 131083
49.246 2.899 0.867 293615
40.977 3.879 0.763 603978
41.139 2.053 0.762 456317
53.054 2.311 0.829 172672
33.938 8.330 4.428 3026586
43.662 1.915 3.092 557800
32.212 4.037 1.918 1802852
53.743 8.261 1.141 119679
40.993 7.807 0.761 169059
40.958 2.628 0.764 576670
40.977 2.768 0.764 479372
40.973 3.949 0.761 681889
33.785 7.806 2.394 1650016
33.932 1.985 3.949 846382
46.128 1.975 0.956 627108
46.738 2.926 0.769 111211
32.484 8.954 2.154 157570
43.056 0.546 3.179 744539
44.045 2.796 4.213 108333
33.065 1.481 0.573 2053556
42.198 1.490 0.781 2225044
52.992 2.027 2.303 817000
45.321 8.930 0.886 513108
41.874 7.016 1.440 270269
42.644 0.664 3.755 384852
48.824 8.212 0.640 390619
32.430 7.802 1.880 774634
45.969 6.845 0.839 136099
46.002 7.026 0.847 163305
42.491 2.403 0.774 684219
44.063 0.654 4.211 99500
43.934 0.794 4.199 147222
41.885 3.102 1.356 152915
46.988 7.958 1.515 171033
47.050 7.837 1.515 268499
46.896 8.034 0.962 387782
45.418 7.938 1.055 365501
42.241 4.134 0.771 629145
45.095 8.007 0.930 178699
45.095 7.366 0.930 470877
36.055 7.960 4.000 380536
42.619 7.726 3.776 203698
38.173 4.398 4.400 40979444
38.174 2.422 4.400 1484992
38.250 3.362 4.400 199031
38.142 8.628 4.399 246435
38.169 1.992 4.400 503227
32.606 4.407 1.974 161055
32.546 4.382 2.431 471362
32.592 2.419 1.977 7056507
32.616 1.982 2.424 7762034
49.338 1.986 3.361 1386070
50.319 2.415 1.966 664582
50.352 2.414 2.030 873488
50.281 3.384 1.966 532878
50.336 3.378 2.029 794026
50.348 1.989 2.023 57123396
50.345 2.002 1.979 63482792
37.421 1.816 4.192 676487
37.407 1.159 4.191 504534
37.415 8.377 4.194 4563520
37.524 0.903 4.210 2342498
38.556 4.190 1.801 221628
38.573 1.470 1.812 909424
38.600 8.379 1.811 325628
38.480 0.829 1.802 1581948
38.518 1.164 1.804 429429
36.883 4.192 0.827 132944
36.823 1.454 0.819 130156
36.851 8.364 0.836 173025
51.262 4.188 1.167 259328
51.256 4.192 1.471 206437
51.265 1.159 1.463 10629602
51.273 1.460 1.160 8897368
51.265 0.848 1.162 2583906
41.411 8.643 0.872 171604
41.375 4.188 0.870 803204
41.369 1.812 0.900 560974
41.391 8.379 0.874 612410
38.069 2.022 4.141 1046090
38.051 0.893 4.139 2318478
38.064 8.436 4.140 3722046
32.770 8.381 2.021 909081
32.678 4.137 2.018 366233
32.774 0.896 2.023 2068712
44.556 8.377 0.907 1260566
44.558 4.137 0.905 905844
44.586 2.020 0.907 1220671
33.924 8.443 4.429 1019236
33.945 3.807 4.427 1694433
33.827 1.547 4.431 535246
33.938 8.330 4.428 3026586
39.987 8.434 3.758 721560
39.993 8.434 3.838 745726
39.982 4.426 3.761 457000
39.971 4.426 3.838 517857
40.021 8.144 3.763 180941
39.990 8.146 3.828 149766
32.817 8.328 4.163 919832
32.797 1.570 4.161 4154897
32.798 8.152 4.157 2086615
32.960 8.325 1.570 1205524
32.892 4.155 1.570 2061897
32.945 1.144 1.572 2994303
32.921 8.150 1.570 578628
32.944 7.007 1.569 159657
32.979 6.779 1.579 127954
32.946 1.568 1.572 57937796
52.928 2.915 1.570 2501682
39.302 1.575 2.923 162339
39.275 2.749 2.929 4554614
48.473 8.326 1.141 328235
48.447 4.158 1.141 440607
48.454 2.901 1.147 529999
48.466 1.132 1.124 41864980
48.459 1.558 1.126 3934334
32.668 8.152 4.644 580176
32.669 2.736 4.643 782678
32.682 2.928 4.644 1105372
32.677 7.013 4.645 1161659
32.684 8.356 4.642 1779806
39.278 8.159 2.741 748022
39.269 8.151 2.933 462727
39.259 7.013 2.932 901136
39.261 8.352 2.937 296763
39.269 0.965 2.739 688690
39.265 0.960 2.933 645255
39.279 0.717 2.926 237210
39.285 7.017 2.747 1391602
33.585 3.951 4.409 922024
33.617 4.166 4.409 1159753
33.590 8.884 4.407 2052127
33.439 1.974 4.401 374506
40.073 8.368 3.951 937606
40.013 8.351 4.166 525153
40.023 4.398 3.952 487168
40.012 4.400 4.166 637193
40.035 3.946 4.164 3364614
40.020 4.159 3.951 3105053
40.021 8.893 3.951 378787
40.030 8.887 4.168 564891
40.014 8.743 3.957 218100
40.017 8.738 4.165 441049
40.045 7.757 4.166 137420
40.000 1.974 4.168 179275
31.968 8.887 4.412 737856
31.942 8.735 4.413 755103
31.956 2.108 4.412 1100633
31.976 2.791 4.414 2458631
38.285 8.889 2.795 1326227
38.299 4.411 2.790 720729
38.284 7.734 2.794 1151902
38.283 6.947 2.789 395762
38.281 2.793 2.793 26956476
38.284 8.737 2.795 1156843
35.682 2.795 4.007 194829
35.660 8.734 4.005 1258728
35.659 2.303 4.004 1735740
35.698 1.982 4.003 3580394
35.820 4.002 4.003 12544933
53.025 8.735 1.956 1096265
53.041 8.734 2.008 1038695
53.038 2.289 2.009 4501892
53.061 4.000 2.007 1448643
53.054 1.995 2.008 22399834
36.554 8.735 2.313 1059142
36.562 4.005 2.315 1273628
36.474 2.310 2.311 68573784
36.377 7.768 2.306 378391
34.751 7.773 4.083 991563
34.722 3.096 4.086 179064
34.748 3.236 4.088 288837
34.795 1.716 4.082 1047178
34.723 0.765 4.084 196940
53.874 3.949 1.945 210888
53.874 7.816 1.945 1817838
43.593 6.755 3.090 514651
43.587 6.755 3.233 495383
43.704 7.775 3.107 125527
43.562 7.773 3.233 153351
43.636 4.089 3.085 108120
43.580 4.086 3.232 175738
43.602 3.089 3.234 5616108
43.599 3.231 3.092 5800496
43.590 7.451 3.089 662488
43.604 7.450 3.236 745987
43.608 1.524 3.091 697557
43.590 1.524 3.236 705839
43.596 1.717 3.091 660855
43.590 1.717 3.236 792136
43.596 1.924 3.235 726274
50.671 4.123 1.536 81634
51.102 4.082 1.528 304125
51.087 4.098 1.712 507502
51.132 3.084 1.524 444274
51.126 3.095 1.720 334080
51.080 3.233 1.527 453991
51.107 3.228 1.717 492836
51.117 7.448 1.527 387568
51.096 7.449 1.718 408292
51.097 1.712 1.528 3841997
51.077 7.801 1.526 291648
51.089 0.970 1.546 300391
51.122 0.748 1.528 672538
51.073 1.534 1.711 4967698
43.018 8.215 3.426 358435
42.763 0.745 3.396 1736399
42.982 7.830 3.420 994740
42.995 2.102 3.421 1204788
43.074 0.953 3.443 4241856
32.092 3.425 2.114 301370
32.102 8.226 2.114 772576
32.123 4.418 2.123 353947
32.171 0.945 2.112 5034136
32.144 7.847 2.098 2511113
45.532 7.826 0.906 792086
45.518 3.424 0.897 1248415
45.527 2.106 0.900 4299676
45.527 2.106 0.900 4299676
45.553 8.221 0.905 641090
45.467 3.886 0.887 771098
45.537 2.359 0.909 479178
45.584 2.690 0.908 484928
45.744 0.882 0.879 98850232
47.345 2.748 0.968 784993
47.370 2.922 0.964 713369
47.330 7.006 0.965 334487
47.287 7.825 0.964 2468790
47.256 2.088 0.965 3064827
47.342 8.216 0.963 714516
47.471 3.443 0.965 3245328
35.478 8.223 3.895 927821
35.483 3.892 3.894 6144304
35.457 2.261 3.895 878109
35.450 2.370 3.894 589643
35.479 2.005 3.895 2157611
35.469 7.604 3.898 255208
35.480 7.817 3.898 178335
35.501 8.065 3.895 433487
35.471 1.805 3.894 952251
35.484 0.828 3.894 1455671
53.086 8.223 2.006 1552101
53.188 3.902 2.001 1028467
53.080 7.606 2.004 774937
36.216 0.893 2.271 497660
36.245 0.890 2.391 380572
36.214 8.223 2.264 1039518
36.222 8.222 2.391 1093053
36.237 3.900 2.260 653866
36.224 3.896 2.389 583435
36.225 2.012 2.385 4081243
36.174 7.610 2.261 192448
35.015 7.606 4.041 949573
35.159 1.925 4.040 3780558
35.111 1.459 4.040 1866575
35.065 2.163 4.040 1264256
32.110 7.608 1.900 899302
32.125 7.605 2.036 903903
32.108 1.441 2.028 1043917
32.153 4.044 2.027 680610
32.212 4.037 1.918 1802852
32.078 1.461 1.911 2655446
31.965 7.829 1.907 1019228
52.810 4.038 1.699 229169
52.804 2.958 1.697 1321181
42.081 1.433 2.930 4506802
48.820 7.605 1.435 374589
48.844 4.038 1.438 604199
48.884 1.918 1.437 1464897
48.834 8.683 1.453 90646
48.897 2.012 1.436 1729492
48.900 2.954 1.436 1048096
41.512 2.064 3.624 869763
41.621 7.833 3.626 612412
41.958 3.644 3.643 9855324
41.621 0.776 3.625 2059902
41.553 8.071 3.621 219538
41.649 8.703 3.627 329187
41.607 3.057 3.626 420085
41.615 8.240 3.620 128332
41.834 0.954 3.609 639686
37.567 3.421 2.102 239504
37.533 7.831 2.104 683055
37.568 3.616 2.100 203816
37.547 8.068 2.103 437607
37.533 0.759 2.105 1741113
38.276 7.015 0.742 124439
38.298 6.775 0.733 125398
38.285 7.438 0.734 255408
38.255 1.521 0.737 650119
38.278 1.752 0.739 764916
38.265 3.418 0.737 773815
38.264 7.831 0.736 839015
38.264 3.624 0.735 377487
38.277 1.990 0.737 2264016
38.289 8.060 0.740 199489
38.285 2.305 0.737 973610
38.296 1.359 0.740 281206
38.274 0.738 0.736 39555720
53.036 7.828 0.830 307789
53.043 7.798 1.967 792392
53.094 3.632 0.819 222546
53.050 3.626 1.979 175916
53.063 1.985 0.831 802712
53.047 0.775 1.985 1612082
42.480 7.826 0.774 519111
42.431 3.621 0.772 1058907
42.377 2.082 0.772 3586566
42.490 8.064 0.767 399716
42.558 2.960 0.772 324777
42.302 0.775 0.776 65714300
42.646 8.066 3.367 579040
42.631 1.121 3.367 514986
42.627 1.834 3.368 695696
38.291 3.888 1.795 280952
38.334 7.822 1.795 83880
38.334 8.046 1.796 894215
38.290 3.357 1.786 202751
39.813 3.906 0.830 1301568
39.819 8.066 0.832 705639
39.834 3.366 0.834 307479
39.818 1.127 0.832 1565366
39.812 1.838 0.833 2027352
39.841 2.394 0.831 333326
39.833 7.803 0.832 341374
39.825 2.634 0.832 1108009
39.810 2.761 0.832 1032344
39.820 7.139 0.830 665066
39.817 8.232 0.835 346934
53.652 3.923 1.137 160424
53.677 8.071 1.131 310779
53.686 8.064 1.885 383000
53.668 3.362 1.139 192975
53.682 3.362 1.878 185753
53.698 0.806 1.136 946219
53.708 0.807 1.876 1086784
53.750 1.113 1.154 320474
53.693 1.125 1.875 665876
53.689 1.866 1.134 716485
53.759 3.941 1.878 222918
40.994 3.361 0.763 1069592
40.989 1.810 0.765 2993337
40.999 1.126 0.761 1028389
41.001 8.036 0.763 944719
41.011 8.240 0.762 525071
41.038 1.470 0.762 1057986
41.015 2.400 0.765 181166
34.398 8.005 3.837 875589
34.438 7.822 3.848 168368
34.420 2.418 3.834 660344
34.401 2.173 3.836 1622068
34.369 8.699 3.833 249799
34.422 8.148 3.834 455711
34.377 1.415 3.838 393551
34.461 1.916 3.836 767169
34.388 0.782 3.838 1377881
51.998 0.774 2.146 404627
52.101 8.007 2.167 1171653
52.097 8.709 2.182 482769
52.039 3.840 2.150 798534
33.809 8.010 2.395 555319
33.851 8.006 2.451 514742
33.833 3.837 2.394 464716
33.841 3.838 2.441 384864
33.890 8.705 2.389 187118
33.856 8.696 2.449 142641
33.785 7.806 2.394 1650016
33.822 6.828 2.387 678826
33.360 7.795 4.421 168004
33.424 8.715 4.409 1009037
33.424 8.715 4.409 1009037
33.242 0.937 4.419 879146
33.112 3.079 4.412 1331672
40.037 3.613 2.539 207120
40.005 3.624 3.052 257728
40.001 0.776 2.547 227499
40.043 0.796 3.043 182750
40.018 8.705 2.534 494907
40.026 8.704 3.052 587171
39.953 4.403 2.554 186517
40.013 4.406 3.052 132552
40.019 2.532 3.054 1536296
40.017 3.049 2.532 1351121
40.021 8.256 3.056 241827
40.015 0.960 2.536 734365
40.020 0.963 3.055 651414
40.022 1.079 2.538 510699
40.007 1.070 3.054 364934
34.066 8.246 4.014 620277
34.107 1.060 4.019 1186058
34.164 0.689 4.016 1834237
42.385 8.257 1.002 249795
42.369 8.241 2.330 265956
42.413 4.038 1.031 137875
42.351 4.014 0.993 146370
42.389 4.032 2.308 98097
42.362 0.987 2.322 587936
42.368 2.320 1.000 433362
42.369 0.718 2.322 439017
42.377 2.103 0.995 214949
42.331 0.837 2.316 453614
50.757 3.365 0.693 515596
50.758 8.252 0.693 434697
50.770 2.344 0.693 709931
50.707 2.098 0.692 887444
50.737 2.976 0.696 184389
48.160 8.255 0.850 530083
48.104 4.002 0.836 1647101
48.148 7.363 0.833 278883
48.102 6.872 0.830 244427
48.081 2.404 0.831 1241156
50.065 8.257 2.102 387529
50.168 3.977 2.109 113165
50.257 0.717 2.097 633506
50.172 0.821 2.086 671510
33.785 8.152 3.935 612325
33.783 6.870 3.933 214972
33.903 0.844 3.935 3360934
34.207 9.003 3.944 590015
40.911 8.127 1.428 424955
40.757 8.153 1.925 410779
40.732 1.399 1.925 1163023
40.721 1.923 1.399 1459587
40.727 1.917 1.926 1095936
40.719 0.797 1.924 904139
40.732 8.999 1.400 187712
40.754 8.999 1.930 196321
50.046 3.842 0.778 517577
49.966 6.838 0.763 134928
50.070 8.154 0.777 493846
49.998 3.951 0.778 447597
50.045 1.405 0.776 1108975
50.081 1.856 0.778 1898420
49.960 9.003 0.771 148434
45.987 8.153 0.848 793651
45.991 3.944 0.847 2518037
45.997 1.848 0.849 2445586
45.979 8.990 0.850 211707
46.003 1.455 0.848 2467674
50.634 8.154 1.837 531626
50.614 0.788 1.832 1538434
33.260 8.993 4.422 1223368
33.278 2.585 4.420 1921199
33.197 2.132 4.425 1516650
33.215 1.051 4.423 1119482
33.260 8.993 4.422 1223368
33.300 2.928 4.418 1749409
33.278 2.585 4.420 1921199
33.227 7.366 4.425 365576
40.545 8.997 2.929 1410236
40.547 8.997 2.602 1053790
40.530 4.415 2.602 536579
40.550 2.927 2.601 4772506
40.549 2.600 2.929 4981460
40.537 7.366 2.930 435851
40.560 7.364 2.605 454299
40.547 1.072 2.920 238072
40.353 1.074 2.594 305328
40.556 4.422 2.929 572135
40.530 4.415 2.602 536579
42.367 2.427 3.609 607539
42.377 0.960 3.608 1878088
42.350 1.084 3.609 2200508
42.263 6.872 3.608 192698
42.366 8.386 3.604 233362
42.372 1.937 3.606 732669
42.378 1.637 3.608 272348
42.369 7.365 3.609 985821
31.943 0.962 2.423 1244841
31.970 1.078 2.429 1485406
31.959 6.872 2.425 455778
31.943 0.839 2.425 957280
32.105 3.588 2.437 317871
31.978 7.365 2.425 889784
46.040 8.705 0.967 236020
46.053 3.044 0.958 658704
46.088 6.876 0.959 331657
46.060 2.431 0.960 2022232
46.387 3.039 1.091 343718
46.396 8.268 1.094 255979
46.414 4.020 1.092 704270
46.570 8.997 1.061 238608
46.416 7.365 1.091 2526051
46.417 3.606 1.089 1944926
46.407 2.424 1.089 2528084
46.464 6.871 1.089 422033
46.561 1.951 1.062 424371
33.021 6.876 3.876 409451
33.025 0.773 3.881 2119282
33.035 1.976 3.890 428495
33.026 8.410 3.879 222850
33.003 1.791 3.882 236975
40.694 0.813 1.396 1659814
40.587 6.883 2.172 268202
40.683 3.897 1.392 567328
40.663 3.887 2.175 262677
40.602 1.391 2.165 922157
40.616 2.155 1.389 1010740
40.622 0.868 2.169 833921
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44.477 7.286 1.048 256762
44.462 1.865 1.049 584749
44.398 1.046 1.046 49980196
44.369 3.546 1.047 1671946
44.692 8.470 1.046 236527
45.010 6.834 1.063 181081
45.006 7.743 1.064 1790007
44.988 4.375 1.061 313909
45.024 2.520 1.064 1981235
45.235 3.503 1.059 1127194
45.248 1.888 1.059 811559
39.629 4.340 4.341 2820744
39.630 1.731 4.344 826420
39.639 2.447 4.343 1355720
39.633 3.575 4.341 270458
39.630 2.069 4.342 1208674
39.634 8.962 4.343 2643413
32.225 1.052 1.744 192580
32.253 4.340 1.737 259654
32.282 1.734 2.448 3033662
32.278 2.446 1.736 2562586
32.298 3.572 1.733 202801
32.313 8.966 1.731 243101
32.292 8.958 2.444 387763
32.232 1.436 1.747 402034
32.269 3.929 2.439 137123
51.041 2.506 3.566 408987
51.018 2.492 3.934 368902
51.054 1.053 3.566 1052546
51.047 1.051 3.937 921435
51.025 1.688 3.565 284697
51.072 1.709 3.934 245564
51.063 3.565 3.564 1326059
51.057 3.562 3.938 1314934
51.056 3.936 3.566 1047248
51.063 2.069 3.564 1011370
51.064 2.063 3.933 1272386
51.065 1.629 3.561 292456
51.072 1.616 3.932 244579
51.053 4.369 3.560 318964
51.047 4.374 3.935 409003
51.920 1.055 2.070 581609
51.948 4.349 2.072 306894
51.977 1.743 2.071 1597104
51.965 3.568 2.070 622110
51.920 8.963 2.068 151135
52.011 1.410 2.070 517199
52.023 2.071 2.083 16938708
36.943 1.028 3.584 161962
36.920 8.964 3.585 698113
36.914 3.584 3.584 5126390
36.911 2.086 3.586 1397962
36.885 2.310 3.583 879821
36.839 7.947 3.577 168752
36.887 7.283 3.588 286234
36.849 1.520 3.581 454106
36.868 3.114 3.581 390006
36.930 6.847 3.590 258630
36.868 1.857 3.585 823032
53.856 8.963 2.069 1106376
53.859 3.581 2.073 694639
53.867 2.077 2.086 9446687
53.864 2.303 2.067 3213890
53.860 8.651 2.079 333898
36.077 8.962 2.313 598556
36.069 3.582 2.310 769278
36.090 8.634 2.315 192932
36.137 2.298 2.298 61622720
36.506 8.640 4.240 563595
36.471 3.973 4.240 1138236
36.553 7.957 4.245 314601
38.597 8.646 4.002 411556
38.603 4.231 3.996 608180
31.515 1.075 4.650 257682
31.562 7.955 4.651 562815
31.574 1.634 4.650 1133810
31.568 1.991 4.648 952534
31.529 7.289 4.653 349792
31.595 8.094 4.647 234285
31.555 1.419 4.651 1373837
34.025 1.057 1.658 756387
34.001 1.073 1.996 799011
34.036 7.956 1.656 513419
34.022 7.956 1.994 428451
34.024 1.995 1.656 1932698
33.998 7.287 1.659 131841
34.017 7.283 2.001 134604
34.026 1.650 1.997 2471327
34.019 1.419 1.657 992560
34.025 1.426 1.996 1162892
52.833 7.960 1.570 189482
52.840 7.952 1.636 185637
49.023 7.955 1.422 520676
37.716 0.822 3.535 737652
37.704 1.067 3.537 1383311
37.714 7.289 3.539 654434
37.713 1.829 3.538 863841
37.694 8.461 3.538 310137
37.709 8.046 3.537 390527
37.712 2.118 3.538 837105
37.709 1.530 3.537 1242014
54.789 0.807 1.539 688736
54.788 0.815 1.805 513867
54.823 1.062 1.814 220657
54.787 7.290 1.543 372483
54.792 7.288 1.812 490104
54.776 1.817 1.545 1526432
54.782 8.453 1.544 192059
54.757 8.431 1.812 298520
54.779 0.966 1.546 276368
54.766 3.545 1.808 367278
54.777 1.543 1.809 1768572
44.128 0.804 3.058 592584
44.132 0.807 3.130 519842
44.155 3.571 3.077 230129
44.128 3.578 3.125 257375
44.123 6.842 3.043 241359
44.146 6.830 3.139 216819
44.187 1.848 3.064 393246
44.128 1.842 3.143 426558
44.072 1.532 3.068 579126
52.658 0.821 1.552 569859
52.615 0.810 1.872 479386
52.583 1.053 1.870 373491
52.556 7.294 1.526 272584
52.529 7.289 1.869 392341
52.533 3.551 1.526 397885
52.556 3.560 1.875 358907
52.612 3.050 1.526 346803
52.612 3.050 1.871 152607
52.612 3.140 1.523 180709
52.612 3.147 1.875 185009
52.539 6.833 1.512 259423
52.497 6.838 1.872 250056
52.556 1.515 1.872 1235935
43.400 1.717 3.437 631272
43.159 8.451 3.457 1178269
43.132 8.107 3.457 420452
43.159 8.791 3.460 155186
43.076 1.957 3.447 888184
45.218 8.436 0.874 1559615
45.257 3.457 0.865 1887965
45.229 1.960 0.869 4429148
45.236 8.104 0.866 1080689
45.381 1.470 0.879 2112732
47.506 1.528 0.965 299653
47.502 8.434 0.964 3378766
47.492 8.114 0.962 928120
47.490 1.951 0.963 4337392
41.880 8.470 1.442 695443
41.870 8.101 1.442 5620108
41.858 4.173 1.440 3018834
42.658 8.049 3.780 936787
42.626 1.099 3.778 2636094
42.629 3.769 3.774 9711010
42.612 0.889 3.771 1898141
42.639 8.516 3.756 1610676
31.482 0.504 2.128 223480
31.394 8.045 2.122 1082179
31.445 0.888 2.119 1664575
31.384 1.102 2.121 1630756
31.393 8.504 2.127 660426
31.410 3.536 2.122 491224
45.937 8.048 0.883 687594
45.942 8.503 0.886 966777
45.938 3.778 0.883 1451796
47.580 2.925 1.119 196326
47.630 3.532 1.120 647459
47.639 8.045 1.119 2831266
47.640 3.779 1.120 2259560
47.639 2.120 1.121 2813708
47.618 0.887 1.120 6520408
47.648 8.502 1.120 773735
47.603 7.731 1.117 188607
47.637 1.434 1.119 1194524
42.635 0.488 3.745 763114
42.642 2.199 3.745 932522
42.632 1.015 3.747 2137792
42.632 3.291 3.746 738295
42.629 8.803 3.749 471342
31.560 0.483 2.210 645100
31.557 3.466 2.211 423642
31.547 0.844 2.209 1072868
31.557 8.509 2.210 1709999
31.558 3.742 2.212 658640
31.558 1.001 2.211 2395702
31.567 8.797 2.212 674426
31.352 1.503 2.217 159507
45.392 1.689 1.055 1007855
45.567 3.445 1.053 1549927
45.424 8.502 1.054 1634816
45.430 3.739 1.055 1878346
45.414 2.209 1.056 2236405
45.427 8.799 1.058 1465351
48.607 0.492 0.982 4244740
48.541 3.456 0.969 307352
48.441 1.950 0.961 379820
48.507 8.034 0.978 230846
48.602 8.484 0.981 2274484
48.595 3.738 0.981 2299839
48.594 8.799 0.981 540033
48.596 1.487 0.983 1865983
33.724 2.825 4.440 1016887
33.847 8.167 4.427 341006
39.994 4.172 2.821 543054
40.013 1.441 2.816 226028
39.957 1.045 2.827 178466
40.032 1.043 2.633 212521
39.981 0.953 2.640 214592
40.012 8.795 2.826 1514617
40.015 8.794 2.640 1204999
39.969 4.449 2.825 254586
40.004 2.823 2.640 4936416
40.003 2.636 2.826 5144806
40.014 8.499 2.823 893571
32.459 2.880 4.461 1572592
32.459 1.912 4.463 845816
32.497 1.649 4.462 465677
32.505 1.378 4.458 265694
32.486 8.505 4.459 1358482
38.214 3.781 2.871 360715
38.219 3.777 2.972 345740
38.210 4.476 2.976 264830
38.240 2.889 2.968 7719434
38.233 2.939 2.969 7632304
38.228 7.724 2.974 617158
38.195 7.008 2.861 297357
38.225 7.011 2.962 253663
38.219 8.506 2.868 1750880
38.224 8.505 2.971 1614132
37.634 8.540 4.212 941706
37.632 3.288 4.213 1058255
37.620 7.157 4.214 698103
37.642 8.812 4.214 237741
37.597 1.398 4.213 1184248
39.727 3.749 3.288 251755
39.839 0.987 3.290 134091
39.813 8.541 3.293 852692
39.747 4.212 3.284 239370
39.805 7.156 3.290 555160
39.791 8.810 3.290 334222
39.793 1.515 3.291 131334
39.816 0.657 3.273 182060
42.202 7.158 3.819 231015
42.244 8.812 3.821 461269
42.227 4.445 3.817 232735
42.207 1.507 3.821 2404694
42.195 8.180 3.829 214337
42.200 7.847 3.820 437953
42.221 0.655 3.820 528939
42.048 7.982 3.786 417057
44.433 8.813 4.453 364177
44.468 3.816 4.450 563619
44.452 1.512 4.450 1763795
44.427 8.182 4.454 303985
47.054 8.535 1.514 218514
46.949 3.289 1.513 178749
47.014 7.153 1.514 771215
46.944 7.385 1.509 304738
47.020 8.812 1.516 1098616
47.008 3.815 1.515 1490916
46.990 4.443 1.514 629185
47.002 1.509 1.514 33667736
47.023 8.178 1.516 371131
47.009 0.660 1.515 1674727
47.045 2.879 1.516 349899
36.027 8.180 4.002 1135177
36.063 1.382 4.003 994040
36.053 1.596 4.000 1054940
35.992 1.913 4.002 2727390
36.071 2.916 4.002 174872
35.923 7.796 4.002 656796
32.503 8.181 1.949 1244806
32.324 1.612 1.940 2612627
32.487 7.802 1.953 772348
32.598 8.511 1.953 117930
53.470 8.180 1.656 322659
53.459 7.808 1.667 299861
49.297 8.175 1.371 237189
49.305 8.177 1.581 414424
49.290 4.002 1.371 410919
49.234 1.607 1.375 7680692
49.288 1.897 1.371 1191793
49.189 2.931 1.377 860616
49.347 7.804 1.369 231672
49.356 7.800 1.581 184098
54.745 7.808 4.074 1775204
54.742 1.384 4.076 3521046
54.742 1.384 4.076 3521046
54.718 2.058 4.075 897623
54.793 8.064 4.086 213477
54.745 7.808 4.074 1775204
41.728 4.071 1.384 3143083
41.754 0.666 1.374 751205
33.335 1.237 3.900 1225852
33.372 1.447 3.908 971323
33.332 7.848 3.903 1024484
33.327 0.649 3.901 1931536
41.886 7.850 1.222 915860
41.882 3.902 1.229 539398
41.876 3.900 1.468 540425
41.899 1.247 1.227 3304944
41.876 8.800 1.442 282999
41.919 0.654 1.224 1193552
48.814 2.234 0.640 529396
48.806 0.290 0.637 2952824
48.770 0.988 0.638 2154702
48.769 6.900 0.639 247237
48.806 7.155 0.644 366070
48.824 7.377 0.636 732036
48.814 7.846 0.639 513194
48.803 3.902 0.636 1528900
48.816 1.253 0.636 1245472
48.795 1.482 0.638 946241
50.213 6.895 0.674 273839
50.271 7.155 0.676 883621
50.266 7.379 0.674 1051072
50.298 7.847 0.675 537964
50.171 1.477 0.674 3303334
50.645 3.943 0.688 461995
50.502 0.984 1.297 649262
50.517 7.851 1.299 307524
50.500 3.890 1.295 194115
50.346 0.675 1.297 3988132
36.464 7.955 3.733 928333
36.457 1.898 3.735 1664083
36.457 1.700 3.736 690187
36.454 1.440 3.735 1305545
36.458 2.092 3.735 695201
36.455 7.850 3.735 833339
31.914 7.966 1.908 1189998
31.903 3.733 1.908 720075
53.341 7.962 1.688 310394
53.351 3.735 1.694 297192
50.268 7.964 1.439 571022
50.233 3.737 1.442 572184
50.260 1.899 1.449 1581463
50.256 1.690 1.440 3375306
50.250 2.893 1.437 625414
50.285 7.836 1.430 297331
50.271 0.857 1.440 662613
34.719 7.827 3.954 1683174
34.701 2.077 3.955 1964330
34.726 2.340 3.958 1117169
34.671 8.053 3.956 400497
34.597 1.830 3.951 806813
52.075 4.068 2.039 467463
52.161 7.819 2.037 1441830
52.166 7.820 2.115 1423332
52.162 2.338 2.038 2426743
52.110 2.365 2.127 2902143
52.167 8.050 2.040 588620
33.608 7.819 2.341 905048
33.572 3.959 2.335 691709
33.592 3.952 2.405 702698
33.613 8.040 2.344 258994
33.771 7.610 2.353 760175
37.408 8.057 4.158 775336
37.383 3.940 4.166 1364873
37.398 1.965 4.167 464939
37.481 7.837 4.166 609166
39.015 8.060 3.944 1291575
38.717 4.146 3.945 1195739
39.015 4.132 3.933 855474
38.999 7.851 3.941 713434
39.070 0.816 3.943 247397
39.031 0.648 3.945 271711
40.993 2.095 3.848 889779
40.985 0.819 3.847 1847347
40.993 0.964 3.850 2195538
40.986 7.865 3.850 1270816
45.637 7.866 0.817 1296675
45.682 3.847 0.819 1297701
45.702 0.817 0.819 58217468
46.829 1.714 0.956 987248
46.881 3.845 0.964 1873757
46.944 7.851 0.961 2759700
32.544 0.795 4.153 2918039
32.578 1.711 4.152 772466
32.833 7.818 4.136 1651173
41.750 3.952 1.830 190543
41.800 7.864 1.522 954304
41.762 7.872 1.824 961415
41.819 4.149 1.821 351929
41.750 1.535 1.823 3106832
41.762 1.819 1.826 3346785
41.716 0.833 1.533 1163346
41.637 0.867 1.823 1616049
41.637 0.784 1.823 507849
49.173 3.937 0.858 377773
49.241 7.856 0.864 375813
49.236 4.152 0.867 197028
49.221 1.515 0.864 1667333
49.229 1.823 0.865 1505337
49.237 0.862 0.864 100958760
49.189 1.705 0.862 1042328
46.962 7.875 0.791 814768
46.972 4.154 0.790 2037391
46.950 1.537 0.790 1891550
46.967 1.700 0.789 3156986
50.948 7.875 1.701 952432
51.001 0.784 1.696 1958260
32.775 7.842 4.142 1637995
32.919 2.289 4.145 1018623
32.882 1.960 4.136 3094463
32.725 3.105 4.146 247616
53.827 2.159 1.949 3540168
53.765 2.283 1.945 2103396
53.839 4.130 1.948 1308508
36.086 7.822 2.174 742462
36.098 4.131 2.169 694089
36.109 4.132 2.291 575583
36.109 2.284 2.172 15443106
36.095 1.953 2.171 4169303
32.246 7.943 4.473 830300
32.238 3.133 4.473 1947652
52.764 7.945 3.154 566772
52.802 4.475 3.148 300409
31.574 8.278 4.590 916822
31.558 3.113 4.591 7017058
53.562 4.585 3.038 443218
53.615 8.276 3.134 284941
53.551 4.589 3.127 675866
53.571 3.135 3.141 107673872
53.643 3.081 3.061 67583432
53.782 4.408 3.084 182634
53.751 4.411 3.191 229679
;
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 C 13 C 1 3620.07 . . . 15317 2
2 H 1 H 2 5998.80 . . . 15317 2
3 H 1 HC 1 11001.10 . . . 15317 2
stop_
loop_
_Spectral_peak_software.Software_ID
_Spectral_peak_software.Software_label
_Spectral_peak_software.Method_ID
_Spectral_peak_software.Method_label
_Spectral_peak_software.Entry_ID
_Spectral_peak_software.Spectral_peak_list_ID
2 $VNMR . . 15317 2
stop_
save_