Content for NMR-STAR saveframe, "spectral_peak_list_3"
save_spectral_peak_list_3
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_3
_Spectral_peak_list.Entry_ID 30538
_Spectral_peak_list.ID 3
_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 7
_Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aliphatic'
_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
;
#Number of dimensions 3
#FORMAT xeasy3D
#INAME 1 HC
#INAME 2 C
#INAME 3 H
#SPECTRUM C13NOESY HC C H
1 2.909 33.925 3.434 1 T 1.406e+07 0.00e+00 a 0 0 0 0 0
2 4.511 73.390 3.665 1 T 4.995e+06 0.00e+00 a 0 0 0 0 0
4 4.511 73.369 1.211 1 T 1.273e+07 0.00e+00 a 0 0 0 0 0
6 4.904 62.574 1.215 1 T 4.499e+06 0.00e+00 a 0 0 0 0 0
11 1.206 20.538 7.589 1 T 1.516e+06 0.00e+00 a 0 0 0 0 0
12 1.208 20.628 8.568 1 T 9.348e+05 0.00e+00 a 0 0 0 0 0
13 1.208 20.580 8.403 1 T 4.459e+06 0.00e+00 a 0 0 0 0 0
14 1.209 20.652 9.162 1 T 1.444e+06 0.00e+00 a 0 0 0 0 0
15 1.208 20.627 4.895 1 T 8.116e+06 0.00e+00 a 0 0 0 0 0
16 1.207 20.690 4.502 1 T 1.459e+07 0.00e+00 a 0 0 0 0 0
17 1.208 20.658 4.238 1 T 2.340e+06 0.00e+00 a 0 0 0 0 0
18 1.207 20.627 3.671 1 T 3.325e+06 0.00e+00 a 0 0 0 0 0
19 1.207 20.634 3.482 1 T 5.058e+06 0.00e+00 a 0 0 0 0 0
20 1.208 20.639 2.574 1 T 3.888e+06 0.00e+00 a 0 0 0 0 0
21 1.208 20.581 2.239 1 T 8.716e+06 0.00e+00 a 0 0 0 0 0
25 4.299 67.325 4.925 1 T 9.812e+05 0.00e+00 a 0 0 0 0 0
26 4.297 67.325 2.905 1 T 1.237e+06 0.00e+00 a 0 0 0 0 0
27 4.298 67.325 8.374 1 T 1.691e+06 0.00e+00 a 0 0 0 0 0
28 4.299 67.353 8.530 1 T 3.143e+07 0.00e+00 a 0 0 0 0 0
29 4.538 69.098 8.542 1 T 1.442e+06 0.00e+00 a 0 0 0 0 0
31 4.299 67.370 0.916 1 T 3.607e+06 0.00e+00 a 0 0 0 0 0
32 4.299 67.372 1.224 1 T 3.392e+07 0.00e+00 a 0 0 0 0 0
33 4.542 69.170 1.226 1 T 1.185e+07 0.00e+00 a 0 0 0 0 0
36 1.223 21.736 4.301 1 T 1.054e+07 0.00e+00 a 0 0 0 0 0
37 1.225 21.743 4.541 1 T 1.491e+07 0.00e+00 a 0 0 0 0 0
38 1.223 21.702 8.533 1 T 4.171e+06 0.00e+00 a 0 0 0 0 0
40 4.986 56.758 8.405 1 T 1.097e+07 0.00e+00 a 0 0 0 0 0
41 4.985 56.760 7.446 1 T 1.284e+06 0.00e+00 a 0 0 0 0 0
42 4.986 56.845 3.784 1 T 5.026e+06 0.00e+00 a 0 0 0 0 0
43 4.986 56.760 2.086 1 T 2.693e+06 0.00e+00 a 0 0 0 0 0
44 4.985 56.760 1.002 1 T 1.771e+06 0.00e+00 a 0 0 0 0 0
45 2.087 50.333 4.558 1 T 1.494e+06 0.00e+00 a 0 0 0 0 0
46 2.083 50.305 4.976 1 T 1.711e+06 0.00e+00 a 0 0 0 0 0
47 2.083 50.310 3.795 1 T 1.183e+07 0.00e+00 a 0 0 0 0 0
48 2.083 50.259 7.435 1 T 7.332e+05 0.00e+00 a 0 0 0 0 0
49 2.082 50.259 8.403 1 T 1.100e+06 0.00e+00 a 0 0 0 0 0
50 3.787 50.303 2.085 1 T 1.370e+07 0.00e+00 a 0 0 0 0 0
51 3.793 50.392 4.977 1 T 2.966e+06 0.00e+00 a 0 0 0 0 0
52 3.790 50.396 4.557 1 T 1.306e+06 0.00e+00 a 0 0 0 0 0
53 3.790 50.259 7.446 1 T 2.101e+06 0.00e+00 a 0 0 0 0 0
54 3.792 50.259 8.402 1 T 1.700e+06 0.00e+00 a 0 0 0 0 0
55 4.985 56.760 8.502 1 T 1.332e+06 0.00e+00 a 0 0 0 0 0
56 2.082 50.259 8.500 1 T 1.151e+06 0.00e+00 a 0 0 0 0 0
57 3.792 50.259 8.494 1 T 5.535e+05 0.00e+00 a 0 0 0 0 0
58 3.741 69.542 7.020 1 T 3.083e+06 0.00e+00 a 0 0 0 0 0
60 3.958 63.001 1.042 1 T 2.613e+07 0.00e+00 a 0 0 0 0 0
61 3.960 62.968 1.984 1 T 2.684e+06 0.00e+00 a 0 0 0 0 0
62 3.958 63.005 1.582 1 T 6.961e+06 0.00e+00 a 0 0 0 0 0
63 3.960 63.081 1.306 1 T 1.151e+06 0.00e+00 a 0 0 0 0 0
64 3.958 63.043 3.461 1 T 4.194e+06 0.00e+00 a 0 0 0 0 0
65 3.959 62.960 2.910 1 T 3.470e+06 0.00e+00 a 0 0 0 0 0
66 3.958 62.939 3.147 1 T 1.537e+06 0.00e+00 a 0 0 0 0 0
67 3.958 62.939 3.394 1 T 1.872e+06 0.00e+00 a 0 0 0 0 0
68 3.743 69.575 4.544 1 T 8.629e+06 0.00e+00 a 0 0 0 0 0
69 3.743 69.548 3.954 1 T 6.954e+06 0.00e+00 a 0 0 0 0 0
70 3.959 63.018 4.552 1 T 5.887e+06 0.00e+00 a 0 0 0 0 0
71 3.742 69.527 3.139 1 T 7.706e+06 0.00e+00 a 0 0 0 0 0
72 3.742 69.403 3.275 1 T 2.015e+06 0.00e+00 a 0 0 0 0 0
73 3.958 62.939 3.218 1 T 1.236e+06 0.00e+00 a 0 0 0 0 0
74 3.741 69.523 1.044 1 T 2.178e+07 0.00e+00 a 0 0 0 0 0
75 3.742 69.548 1.575 1 T 8.510e+05 0.00e+00 a 0 0 0 0 0
76 3.744 69.548 7.568 1 T 5.700e+05 0.00e+00 a 0 0 0 0 0
77 3.741 69.518 8.404 1 T 1.622e+06 0.00e+00 a 0 0 0 0 0
78 3.741 69.531 7.348 1 T 7.838e+05 0.00e+00 a 0 0 0 0 0
80 3.960 63.067 7.045 1 T 1.203e+06 0.00e+00 a 0 0 0 0 0
81 3.958 62.987 7.444 1 T 3.066e+06 0.00e+00 a 0 0 0 0 0
82 3.958 62.940 8.745 1 T 3.878e+06 0.00e+00 a 0 0 0 0 0
83 3.959 62.983 8.406 1 T 8.872e+06 0.00e+00 a 0 0 0 0 0
84 3.958 62.939 3.750 1 T 1.466e+07 0.00e+00 a 0 0 0 0 0
86 1.044 22.412 4.983 1 T 7.350e+05 0.00e+00 a 0 0 0 0 0
87 1.044 22.381 3.970 1 T 6.104e+06 0.00e+00 a 0 0 0 0 0
88 1.044 22.354 3.747 1 T 9.112e+06 0.00e+00 a 0 0 0 0 0
89 1.041 22.250 4.506 1 T 1.133e+06 0.00e+00 a 0 0 0 0 0
90 1.041 22.316 4.235 1 T 1.105e+06 0.00e+00 a 0 0 0 0 0
91 1.043 22.316 2.883 1 T 1.630e+06 0.00e+00 a 0 0 0 0 0
92 1.044 22.385 3.355 1 T 1.371e+06 0.00e+00 a 0 0 0 0 0
93 1.043 22.334 3.141 1 T 3.757e+06 0.00e+00 a 0 0 0 0 0
94 1.042 22.316 1.982 1 T 1.917e+06 0.00e+00 a 0 0 0 0 0
95 1.044 22.316 1.571 1 T 5.822e+06 0.00e+00 a 0 0 0 0 0
96 1.042 22.316 7.017 1 T 5.675e+05 0.00e+00 a 0 0 0 0 0
97 1.045 22.311 7.571 1 T 9.807e+05 0.00e+00 a 0 0 0 0 0
98 1.043 22.358 8.403 1 T 5.473e+06 0.00e+00 a 0 0 0 0 0
99 1.039 22.348 9.048 1 T 6.313e+05 0.00e+00 a 0 0 0 0 0
100 1.041 22.296 8.754 1 T 7.162e+05 0.00e+00 a 0 0 0 0 0
101 2.899 37.662 4.402 1 T 2.918e+06 0.00e+00 a 0 0 0 0 0
102 3.031 37.673 4.398 1 T 3.628e+06 0.00e+00 a 0 0 0 0 0
103 3.033 37.643 7.447 1 T 3.842e+06 0.00e+00 a 0 0 0 0 0
104 2.904 37.643 7.443 1 T 3.942e+06 0.00e+00 a 0 0 0 0 0
105 2.907 37.643 6.974 1 T 1.188e+06 0.00e+00 a 0 0 0 0 0
106 3.031 37.643 6.977 1 T 1.320e+06 0.00e+00 a 0 0 0 0 0
107 3.032 37.643 7.708 1 T 2.029e+06 0.00e+00 a 0 0 0 0 0
108 2.905 37.643 7.711 1 T 2.376e+06 0.00e+00 a 0 0 0 0 0
109 3.033 37.643 2.410 1 T 1.701e+06 0.00e+00 a 0 0 0 0 0
110 2.908 37.642 2.421 1 T 2.644e+06 0.00e+00 a 0 0 0 0 0
111 3.033 37.643 8.477 1 T 6.147e+05 0.00e+00 a 0 0 0 0 0
112 2.906 37.643 8.477 1 T 5.515e+05 0.00e+00 a 0 0 0 0 0
113 4.390 55.349 2.914 1 T 1.045e+07 0.00e+00 a 0 0 0 0 0
114 4.390 55.349 3.037 1 T 6.973e+06 0.00e+00 a 0 0 0 0 0
115 4.390 55.349 3.362 1 T 8.998e+05 0.00e+00 a 0 0 0 0 0
116 4.390 55.349 3.692 1 T 5.797e+05 0.00e+00 a 0 0 0 0 0
117 4.391 55.349 6.981 1 T 1.118e+06 0.00e+00 a 0 0 0 0 0
118 4.391 55.349 7.449 1 T 1.039e+07 0.00e+00 a 0 0 0 0 0
119 4.393 55.349 7.695 1 T 9.151e+05 0.00e+00 a 0 0 0 0 0
120 4.392 55.376 8.495 1 T 3.557e+07 0.00e+00 a 0 0 0 0 0
121 4.394 55.349 2.420 1 T 8.055e+05 0.00e+00 a 0 0 0 0 0
122 5.138 58.521 6.913 1 T 6.191e+06 0.00e+00 a 0 0 0 0 0
123 5.138 58.626 6.652 1 T 2.449e+06 0.00e+00 a 0 0 0 0 0
124 3.380 67.742 5.122 1 T 3.694e+06 0.00e+00 a 0 0 0 0 0
125 3.379 67.730 4.439 1 T 1.466e+07 0.00e+00 a 0 0 0 0 0
126 5.139 58.591 3.381 1 T 1.523e+07 0.00e+00 a 0 0 0 0 0
127 5.139 58.585 8.286 1 T 1.544e+07 0.00e+00 a 0 0 0 0 0
128 5.138 58.591 8.139 1 T 5.301e+06 0.00e+00 a 0 0 0 0 0
129 5.137 58.598 8.498 1 T 9.762e+06 0.00e+00 a 0 0 0 0 0
130 5.140 58.591 8.953 1 T 9.056e+05 0.00e+00 a 0 0 0 0 0
131 5.140 58.591 9.172 1 T 7.457e+05 0.00e+00 a 0 0 0 0 0
132 3.380 67.824 8.264 1 T 3.523e+06 0.00e+00 a 0 0 0 0 0
133 3.383 67.728 8.484 1 T 9.145e+05 0.00e+00 a 0 0 0 0 0
134 5.137 58.636 4.202 1 T 2.332e+06 0.00e+00 a 0 0 0 0 0
135 5.139 58.612 4.446 1 T 1.363e+07 0.00e+00 a 0 0 0 0 0
136 3.380 67.702 4.191 1 T 1.698e+06 0.00e+00 a 0 0 0 0 0
137 4.432 67.819 3.386 1 T 1.361e+07 0.00e+00 a 0 0 0 0 0
138 4.433 67.821 4.198 1 T 1.729e+06 0.00e+00 a 0 0 0 0 0
139 4.432 67.821 4.827 1 T 8.837e+05 0.00e+00 a 0 0 0 0 0
140 3.381 67.821 4.816 1 T 7.018e+05 0.00e+00 a 0 0 0 0 0
141 5.138 58.591 4.810 1 T 1.597e+06 0.00e+00 a 0 0 0 0 0
142 3.382 67.821 3.176 1 T 1.739e+06 0.00e+00 a 0 0 0 0 0
143 4.432 67.821 3.187 1 T 1.016e+06 0.00e+00 a 0 0 0 0 0
144 4.433 67.821 2.897 1 T 3.792e+05 0.00e+00 a 0 0 0 0 0
145 3.381 67.821 2.886 1 T 5.015e+05 0.00e+00 a 0 0 0 0 0
146 5.141 58.591 3.171 1 T 1.220e+06 0.00e+00 a 0 0 0 0 0
147 5.138 58.591 2.897 1 T 9.428e+05 0.00e+00 a 0 0 0 0 0
148 5.135 58.632 2.402 1 T 1.427e+06 0.00e+00 a 0 0 0 0 0
149 5.140 58.591 1.296 1 T 8.053e+05 0.00e+00 a 0 0 0 0 0
150 5.138 58.591 1.974 1 T 8.354e+05 0.00e+00 a 0 0 0 0 0
151 5.138 58.591 1.722 1 T 2.753e+06 0.00e+00 a 0 0 0 0 0
152 5.140 58.675 1.552 1 T 1.139e+06 0.00e+00 a 0 0 0 0 0
153 4.434 67.939 3.928 1 T 8.096e+05 0.00e+00 a 0 0 0 0 0
155 4.432 67.821 7.046 1 T 8.745e+05 0.00e+00 a 0 0 0 0 0
156 4.434 67.821 5.133 1 T 2.250e+06 0.00e+00 a 0 0 0 0 0
157 4.432 67.821 8.234 1 T 1.618e+06 0.00e+00 a 0 0 0 0 0
158 4.432 67.821 8.982 1 T 3.651e+05 0.00e+00 a 0 0 0 0 0
159 1.953 38.132 4.621 1 T 2.971e+06 0.00e+00 a 0 0 0 0 0
160 1.708 38.092 4.627 1 T 1.523e+06 0.00e+00 a 0 0 0 0 0
161 1.958 38.020 6.635 1 T 2.179e+06 0.00e+00 a 0 0 0 0 0
162 1.710 38.092 6.623 1 T 1.052e+06 0.00e+00 a 0 0 0 0 0
163 1.709 38.168 1.950 1 T 1.596e+07 0.00e+00 a 0 0 0 0 0
164 1.955 38.085 1.717 1 T 2.106e+07 0.00e+00 a 0 0 0 0 0
165 1.955 38.145 8.284 1 T 1.403e+06 0.00e+00 a 0 0 0 0 0
166 1.709 38.092 8.276 1 T 1.007e+06 0.00e+00 a 0 0 0 0 0
167 1.709 38.092 2.415 1 T 6.127e+05 0.00e+00 a 0 0 0 0 0
168 4.611 56.048 1.752 1 T 9.940e+05 0.00e+00 a 0 0 0 0 0
169 4.612 55.948 1.946 1 T 2.822e+06 0.00e+00 a 0 0 0 0 0
170 4.613 56.006 1.297 1 T 3.218e+06 0.00e+00 a 0 0 0 0 0
171 4.613 56.058 1.427 1 T 7.635e+05 0.00e+00 a 0 0 0 0 0
172 1.956 38.092 1.426 1 T 1.188e+06 0.00e+00 a 0 0 0 0 0
173 1.957 38.092 1.297 1 T 1.105e+06 0.00e+00 a 0 0 0 0 0
174 1.711 38.092 1.297 1 T 1.524e+06 0.00e+00 a 0 0 0 0 0
175 1.709 38.092 1.423 1 T 7.376e+05 0.00e+00 a 0 0 0 0 0
176 1.195 25.310 1.962 1 T 2.172e+06 0.00e+00 a 0 0 0 0 0
177 1.352 25.245 4.622 1 T 1.114e+06 0.00e+00 a 0 0 0 0 0
178 1.298 24.284 4.626 1 T 5.994e+06 0.00e+00 a 0 0 0 0 0
179 1.438 25.681 4.644 1 T 7.940e+05 0.00e+00 a 0 0 0 0 0
180 1.297 25.714 4.637 1 T 5.432e+05 0.00e+00 a 0 0 0 0 0
181 1.439 25.714 1.708 1 T 2.191e+06 0.00e+00 a 0 0 0 0 0
182 1.438 25.714 1.944 1 T 1.003e+06 0.00e+00 a 0 0 0 0 0
183 1.438 25.714 1.297 1 T 1.198e+07 0.00e+00 a 0 0 0 0 0
184 1.295 25.714 1.440 1 T 1.030e+07 0.00e+00 a 0 0 0 0 0
185 1.296 25.714 1.708 1 T 1.271e+06 0.00e+00 a 0 0 0 0 0
186 1.294 25.714 3.028 1 T 8.160e+05 0.00e+00 a 0 0 0 0 0
187 1.441 25.714 3.028 1 T 5.984e+05 0.00e+00 a 0 0 0 0 0
188 1.786 29.461 1.292 1 T 1.491e+06 0.00e+00 a 0 0 0 0 0
189 1.785 29.435 3.030 1 T 3.290e+06 0.00e+00 a 0 0 0 0 0
190 3.020 42.268 1.780 1 T 4.327e+06 0.00e+00 a 0 0 0 0 0
191 3.020 42.249 1.302 1 T 1.468e+06 0.00e+00 a 0 0 0 0 0
192 3.020 42.249 1.412 1 T 1.066e+06 0.00e+00 a 0 0 0 0 0
193 2.793 40.189 3.558 1 T 2.910e+06 0.00e+00 a 0 0 0 0 0
194 2.466 40.151 3.561 1 T 6.081e+06 0.00e+00 a 0 0 0 0 0
195 2.465 40.066 2.795 1 T 2.113e+07 0.00e+00 a 0 0 0 0 0
196 2.792 40.092 1.298 1 T 7.214e+05 0.00e+00 a 0 0 0 0 0
197 2.466 40.092 1.293 1 T 9.690e+05 0.00e+00 a 0 0 0 0 0
198 2.793 40.113 4.283 1 T 8.043e+05 0.00e+00 a 0 0 0 0 0
199 2.792 40.092 4.588 1 T 8.023e+05 0.00e+00 a 0 0 0 0 0
200 2.793 40.092 4.775 1 T 1.402e+06 0.00e+00 a 0 0 0 0 0
201 2.465 40.073 4.775 1 T 2.985e+06 0.00e+00 a 0 0 0 0 0
202 2.466 40.092 4.593 1 T 4.612e+05 0.00e+00 a 0 0 0 0 0
203 2.463 40.110 8.514 1 T 3.413e+06 0.00e+00 a 0 0 0 0 0
204 2.794 40.161 8.524 1 T 3.645e+06 0.00e+00 a 0 0 0 0 0
205 2.794 40.128 2.467 1 T 1.849e+07 0.00e+00 a 0 0 0 0 0
206 2.040 34.497 4.702 1 T 1.207e+06 0.00e+00 a 0 0 0 0 0
207 1.804 34.475 4.690 1 T 9.692e+05 0.00e+00 a 0 0 0 0 0
208 2.040 34.476 1.792 1 T 1.338e+07 0.00e+00 a 0 0 0 0 0
209 1.796 34.476 2.035 1 T 1.354e+07 0.00e+00 a 0 0 0 0 0
210 1.797 34.476 8.884 1 T 1.643e+06 0.00e+00 a 0 0 0 0 0
211 2.040 34.497 8.879 1 T 6.186e+05 0.00e+00 a 0 0 0 0 0
212 2.041 34.497 2.391 1 T 1.863e+06 0.00e+00 a 0 0 0 0 0
213 1.796 34.476 2.379 1 T 2.470e+06 0.00e+00 a 0 0 0 0 0
214 2.393 31.546 4.694 1 T 1.383e+06 0.00e+00 a 0 0 0 0 0
215 2.392 31.560 1.789 1 T 7.034e+06 0.00e+00 a 0 0 0 0 0
216 2.391 31.445 2.037 1 T 3.197e+06 0.00e+00 a 0 0 0 0 0
217 2.390 31.445 1.346 1 T 1.000e+06 0.00e+00 a 0 0 0 0 0
218 2.392 31.468 8.914 1 T 1.196e+06 0.00e+00 a 0 0 0 0 0
219 2.395 31.593 7.628 1 T 1.131e+06 0.00e+00 a 0 0 0 0 0
220 2.076 16.923 6.675 1 T 1.229e+06 0.00e+00 a 0 0 0 0 0
221 2.077 16.935 6.869 1 T 9.291e+05 0.00e+00 a 0 0 0 0 0
222 2.074 16.935 4.640 1 T 5.916e+05 0.00e+00 a 0 0 0 0 0
223 2.076 16.935 2.084 1 T 8.715e+08 0.00e+00 a 0 0 0 0 0
224 2.040 34.497 2.077 1 T 2.644e+07 0.00e+00 a 0 0 0 0 0
225 1.796 34.476 2.075 1 T 1.003e+07 0.00e+00 a 0 0 0 0 0
226 2.392 31.445 2.073 1 T 2.283e+06 0.00e+00 a 0 0 0 0 0
227 4.301 54.253 3.003 1 T 1.935e+07 0.00e+00 a 0 0 0 0 0
229 4.301 54.267 2.701 1 T 8.554e+06 0.00e+00 a 0 0 0 0 0
230 2.714 37.487 4.307 1 T 2.370e+06 0.00e+00 a 0 0 0 0 0
231 3.004 37.467 2.716 1 T 3.020e+07 0.00e+00 a 0 0 0 0 0
232 2.719 37.393 7.621 1 T 1.718e+06 0.00e+00 a 0 0 0 0 0
233 4.300 54.161 8.180 1 T 8.003e+06 0.00e+00 a 0 0 0 0 0
234 4.299 54.228 9.401 1 T 6.967e+06 0.00e+00 a 0 0 0 0 0
235 4.306 54.253 6.926 1 T 7.934e+05 0.00e+00 a 0 0 0 0 0
236 3.003 37.474 4.307 1 T 4.443e+06 0.00e+00 a 0 0 0 0 0
237 2.714 37.424 3.004 1 T 2.981e+07 0.00e+00 a 0 0 0 0 0
238 4.068 45.848 7.655 1 T 2.679e+06 0.00e+00 a 0 0 0 0 0
239 4.065 45.837 8.193 1 T 1.355e+07 0.00e+00 a 0 0 0 0 0
240 4.063 45.832 8.023 1 T 1.488e+06 0.00e+00 a 0 0 0 0 0
241 4.063 45.878 5.268 1 T 1.094e+06 0.00e+00 a 0 0 0 0 0
242 4.069 45.816 2.960 1 T 1.654e+06 0.00e+00 a 0 0 0 0 0
243 4.063 45.780 1.311 1 T 9.493e+05 0.00e+00 a 0 0 0 0 0
244 4.067 45.806 1.651 1 T 6.412e+05 0.00e+00 a 0 0 0 0 0
245 4.067 45.806 1.740 1 T 5.229e+05 0.00e+00 a 0 0 0 0 0
246 5.298 54.398 1.697 1 T 1.615e+07 0.00e+00 a 0 0 0 0 0
247 5.297 54.398 1.349 1 T 6.271e+06 0.00e+00 a 0 0 0 0 0
248 5.298 54.442 8.898 1 T 2.666e+07 0.00e+00 a 0 0 0 0 0
249 5.296 54.328 8.018 1 T 4.195e+06 0.00e+00 a 0 0 0 0 0
250 5.298 54.420 7.644 1 T 5.041e+06 0.00e+00 a 0 0 0 0 0
251 5.294 54.398 8.309 1 T 4.928e+05 0.00e+00 a 0 0 0 0 0
252 1.702 36.157 7.643 1 T 1.467e+06 0.00e+00 a 0 0 0 0 0
253 1.647 36.220 7.637 1 T 1.277e+06 0.00e+00 a 0 0 0 0 0
254 1.702 36.190 8.895 1 T 1.800e+06 0.00e+00 a 0 0 0 0 0
255 1.646 36.205 8.892 1 T 1.706e+06 0.00e+00 a 0 0 0 0 0
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807 3.800 43.310 8.594 1 T 1.060e+06 0.00e+00 a 0 0 0 0 0
809 4.649 56.591 8.033 1 T 1.652e+06 0.00e+00 a 0 0 0 0 0
810 1.758 33.332 8.013 1 T 1.315e+06 0.00e+00 a 0 0 0 0 0
811 1.696 33.217 8.022 1 T 1.088e+06 0.00e+00 a 0 0 0 0 0
812 1.760 33.157 4.648 1 T 1.441e+06 0.00e+00 a 0 0 0 0 0
813 1.696 33.157 4.655 1 T 1.772e+06 0.00e+00 a 0 0 0 0 0
814 4.650 56.476 1.702 1 T 7.865e+05 0.00e+00 a 0 0 0 0 0
815 4.650 56.476 1.760 1 T 1.206e+06 0.00e+00 a 0 0 0 0 0
816 1.758 33.157 8.390 1 T 4.414e+06 0.00e+00 a 0 0 0 0 0
817 1.698 33.157 8.383 1 T 2.966e+06 0.00e+00 a 0 0 0 0 0
818 1.759 33.157 4.132 1 T 5.886e+05 0.00e+00 a 0 0 0 0 0
819 1.761 33.157 4.312 1 T 6.074e+05 0.00e+00 a 0 0 0 0 0
820 1.694 33.157 4.137 1 T 5.270e+05 0.00e+00 a 0 0 0 0 0
821 1.539 29.581 5.307 1 T 5.287e+05 0.00e+00 a 0 0 0 0 0
822 2.321 34.053 7.352 1 T 6.059e+05 0.00e+00 a 0 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 H-aliphatic . . 13.89 ppm . . . 4.708 . . 30538 3
2 . . C 13 C-aliphatic . . 32 ppm . . . 116 . . 30538 3
3 . . H 1 H . . 13.89 ppm . . . 4.708 . . 30538 3
stop_
save_