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 30481
_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 2
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_2
_Spectral_peak_list.Experiment_ID 2
_Spectral_peak_list.Experiment_name '3D 1H-13C NOESY'
_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 H
# INAME 3 C
# SPECTRUM C13NOESY HC H C
1 1.954 0.564 31.704 0 U 9.459E+03 0.000E+00 - 0 0 0 0
3 1.954 0.624 31.704 0 U 1.605E+04 0.000E+00 - 0 0 0 0
4 1.954 3.778 31.704 0 U 4.663E+03 0.000E+00 - 0 0 0 0
5 1.954 0.654 31.704 0 U 1.629E+04 0.000E+00 - 0 0 0 0
6 1.954 8.083 31.704 0 U 2.533E+03 0.000E+00 - 0 0 0 0
7 1.954 7.177 31.704 0 U 5.115E+03 0.000E+00 - 0 0 0 0
8 1.954 0.602 31.704 0 U 1.605E+04 0.000E+00 - 0 0 0 0
9 1.954 0.637 31.704 0 U 1.629E+04 0.000E+00 - 0 0 0 0
10 3.829 1.294 57.861 0 U 6.689E+03 0.000E+00 - 0 0 0 0
11 3.829 1.292 57.861 0 U 6.689E+03 0.000E+00 - 0 0 0 0
12 3.829 2.812 57.861 0 U 3.590E+03 0.000E+00 - 0 0 0 0
13 3.829 7.387 57.861 0 U 5.406E+03 0.000E+00 - 0 0 0 0
15 3.829 1.594 57.861 0 U 1.251E+04 0.000E+00 - 0 0 0 0
16 3.829 1.390 57.861 0 U 6.855E+03 0.000E+00 - 0 0 0 0
17 3.829 1.361 57.861 0 U 7.094E+03 0.000E+00 - 0 0 0 0
18 3.829 1.400 57.861 0 U 6.168E+03 0.000E+00 - 0 0 0 0
19 3.829 2.795 57.861 0 U 3.590E+03 0.000E+00 - 0 0 0 0
20 3.829 1.583 57.861 0 U 1.433E+04 0.000E+00 - 0 0 0 0
21 0.621 1.413 23.735 0 U 2.319E+04 0.000E+00 - 0 0 0 0
22 0.621 1.515 23.735 0 U 1.325E+04 0.000E+00 - 0 0 0 0
23 0.621 0.675 23.735 0 U 2.171E+05 0.000E+00 - 0 0 0 0
24 0.621 1.442 23.735 0 U 2.372E+04 0.000E+00 - 0 0 0 0
25 0.621 4.098 23.735 0 U 5.519E+03 0.000E+00 - 0 0 0 0
26 3.449 1.442 49.822 0 U 4.465E+03 0.000E+00 - 0 0 0 0
27 3.449 3.301 49.822 0 U 5.201E+03 0.000E+00 - 0 0 0 0
28 3.871 1.210 54.572 0 U 1.083E+04 0.000E+00 - 0 0 0 0
29 3.871 3.902 54.572 0 U 1.556E+04 0.000E+00 - 0 0 0 0
30 3.871 3.959 54.572 0 U 5.531E+03 0.000E+00 - 0 0 0 0
31 3.833 3.789 62.177 0 U 1.876E+04 0.000E+00 - 0 0 0 0
32 1.874 3.902 28.192 0 U 3.460E+03 0.000E+00 - 0 0 0 0
33 1.874 1.605 28.192 0 U 6.844E+03 0.000E+00 - 0 0 0 0
34 1.874 1.529 28.192 0 U 4.366E+03 0.000E+00 - 0 0 0 0
35 1.874 2.025 28.192 0 U 5.904E+03 0.000E+00 - 0 0 0 0
36 0.536 7.739 21.925 0 U 1.563E+03 0.000E+00 - 0 0 0 0
37 0.536 0.536 21.925 0 U 3.443E+05 0.000E+00 - 0 0 0 0
38 0.536 8.292 21.925 0 U 3.537E+03 0.000E+00 - 0 0 0 0
39 0.536 1.594 21.925 0 U 2.514E+04 0.000E+00 - 0 0 0 0
40 0.536 1.235 21.925 0 U 1.363E+04 0.000E+00 - 0 0 0 0
41 0.536 2.017 21.925 0 U 5.448E+03 0.000E+00 - 0 0 0 0
42 0.536 3.782 21.925 0 U 1.794E+04 0.000E+00 - 0 0 0 0
43 0.536 1.585 21.925 0 U 2.514E+04 0.000E+00 - 0 0 0 0
44 0.564 1.954 24.606 0 U 4.343E+03 0.000E+00 - 0 0 0 0
45 0.564 1.204 24.606 0 U 1.923E+04 0.000E+00 - 0 0 0 0
46 0.564 3.765 24.606 0 U 6.486E+03 0.000E+00 - 0 0 0 0
47 0.564 1.560 24.606 0 U 2.033E+04 0.000E+00 - 0 0 0 0
48 0.564 0.556 24.606 0 U 3.493E+05 0.000E+00 - 0 0 0 0
49 0.564 0.624 24.606 0 U 2.818E+05 0.000E+00 - 0 0 0 0
50 0.564 1.206 24.606 0 U 1.923E+04 0.000E+00 - 0 0 0 0
51 0.564 1.514 24.606 0 U 2.084E+04 0.000E+00 - 0 0 0 0
52 0.564 1.362 24.606 0 U 1.548E+04 0.000E+00 - 0 0 0 0
53 0.564 1.669 24.606 0 U 5.656E+03 0.000E+00 - 0 0 0 0
54 0.564 0.637 24.606 0 U 1.794E+05 0.000E+00 - 0 0 0 0
55 3.663 7.997 45.759 0 U 3.274E+03 0.000E+00 - 0 0 0 0
56 3.663 3.818 45.759 0 U 8.276E+03 0.000E+00 - 0 0 0 0
58 3.642 1.594 59.049 0 U 9.947E+03 0.000E+00 - 0 0 0 0
59 3.642 1.361 59.049 0 U 6.915E+03 0.000E+00 - 0 0 0 0
60 3.642 1.374 59.049 0 U 7.012E+03 0.000E+00 - 0 0 0 0
61 1.873 3.983 28.990 0 U 5.977E+03 0.000E+00 - 0 0 0 0
62 1.873 1.778 28.990 0 U 2.607E+04 0.000E+00 - 0 0 0 0
63 1.873 1.630 28.990 0 U 8.455E+03 0.000E+00 - 0 0 0 0
64 1.873 2.091 28.990 0 U 1.454E+04 0.000E+00 - 0 0 0 0
65 1.204 0.564 17.948 0 U 3.279E+03 0.000E+00 - 0 0 0 0
66 1.204 1.576 17.948 0 U 3.831E+03 0.000E+00 - 0 0 0 0
67 1.204 3.765 17.948 0 U 8.856E+03 0.000E+00 - 0 0 0 0
68 1.204 1.560 17.948 0 U 3.831E+03 0.000E+00 - 0 0 0 0
69 1.204 0.556 17.948 0 U 3.279E+03 0.000E+00 - 0 0 0 0
70 1.204 3.828 17.948 0 U 2.448E+04 0.000E+00 - 0 0 0 0
71 1.204 0.624 17.948 0 U 5.617E+03 0.000E+00 - 0 0 0 0
72 1.204 0.774 17.948 0 U 6.352E+03 0.000E+00 - 0 0 0 0
73 1.204 7.628 17.948 0 U 1.083E+04 0.000E+00 - 0 0 0 0
74 1.204 7.177 17.948 0 U 6.945E+03 0.000E+00 - 0 0 0 0
75 1.204 1.206 17.948 0 U 1.612E+05 0.000E+00 - 0 0 0 0
76 1.204 0.637 17.948 0 U 5.505E+03 0.000E+00 - 0 0 0 0
77 3.983 1.873 55.980 0 U 9.942E+03 0.000E+00 - 0 0 0 0
78 3.983 1.778 55.980 0 U 8.603E+03 0.000E+00 - 0 0 0 0
79 3.983 3.865 55.980 0 U 6.654E+03 0.000E+00 - 0 0 0 0
80 3.983 2.091 55.980 0 U 7.650E+03 0.000E+00 - 0 0 0 0
81 3.983 7.613 55.980 0 U 8.435E+03 0.000E+00 - 0 0 0 0
82 3.983 7.607 55.980 0 U 8.435E+03 0.000E+00 - 0 0 0 0
83 4.030 4.006 69.612 0 U 2.507E+04 0.000E+00 - 0 0 0 0
84 4.030 4.070 69.612 0 U 2.267E+04 0.000E+00 - 0 0 0 0
85 4.030 1.020 69.612 0 U 1.842E+04 0.000E+00 - 0 0 0 0
86 4.030 3.875 69.612 0 U 1.218E+04 0.000E+00 - 0 0 0 0
87 4.030 1.022 69.612 0 U 1.842E+04 0.000E+00 - 0 0 0 0
88 1.778 1.873 28.990 0 U 2.680E+04 0.000E+00 - 0 0 0 0
89 1.778 3.983 28.990 0 U 6.647E+03 0.000E+00 - 0 0 0 0
90 1.778 2.091 28.990 0 U 1.186E+04 0.000E+00 - 0 0 0 0
91 3.281 0.556 66.308 0 U 7.424E+03 0.000E+00 - 0 0 0 0
92 3.281 0.774 66.308 0 U 9.501E+03 0.000E+00 - 0 0 0 0
93 3.281 0.724 66.308 0 U 1.228E+04 0.000E+00 - 0 0 0 0
94 3.281 2.017 66.308 0 U 7.164E+03 0.000E+00 - 0 0 0 0
95 1.576 1.204 38.354 0 U 4.102E+03 0.000E+00 - 0 0 0 0
96 1.576 3.778 38.354 0 U 4.578E+03 0.000E+00 - 0 0 0 0
97 1.576 0.654 38.354 0 U 1.149E+04 0.000E+00 - 0 0 0 0
98 1.576 0.602 38.354 0 U 1.100E+04 0.000E+00 - 0 0 0 0
99 3.436 3.563 46.954 0 U 1.437E+04 0.000E+00 - 0 0 0 0
100 3.436 8.564 46.954 0 U 2.975E+03 0.000E+00 - 0 0 0 0
101 3.436 0.654 46.954 0 U 3.602E+03 0.000E+00 - 0 0 0 0
102 3.436 3.558 46.954 0 U 1.437E+04 0.000E+00 - 0 0 0 0
103 3.436 3.441 46.954 0 U 1.363E+04 0.000E+00 - 0 0 0 0
104 0.657 0.649 23.019 0 U 1.729E+05 0.000E+00 - 0 0 0 0
105 0.657 1.401 23.019 0 U 1.276E+04 0.000E+00 - 0 0 0 0
106 0.657 1.758 23.019 0 U 9.711E+03 0.000E+00 - 0 0 0 0
107 0.657 3.959 23.019 0 U 6.773E+03 0.000E+00 - 0 0 0 0
108 0.657 0.600 23.019 0 U 1.313E+05 0.000E+00 - 0 0 0 0
109 0.657 1.311 23.019 0 U 1.473E+04 0.000E+00 - 0 0 0 0
110 3.922 1.630 56.423 0 U 5.388E+03 0.000E+00 - 0 0 0 0
111 3.922 1.390 56.423 0 U 4.478E+03 0.000E+00 - 0 0 0 0
112 3.922 1.400 56.423 0 U 5.638E+03 0.000E+00 - 0 0 0 0
113 3.922 1.494 56.423 0 U 6.941E+03 0.000E+00 - 0 0 0 0
114 3.922 7.778 56.423 0 U 5.830E+03 0.000E+00 - 0 0 0 0
115 1.630 1.873 30.135 0 U 1.525E+04 0.000E+00 - 0 0 0 0
116 1.630 3.922 30.135 0 U 3.075E+03 0.000E+00 - 0 0 0 0
117 1.630 1.292 30.135 0 U 5.764E+03 0.000E+00 - 0 0 0 0
118 1.630 2.812 30.135 0 U 3.335E+03 0.000E+00 - 0 0 0 0
119 1.630 1.833 30.135 0 U 2.241E+04 0.000E+00 - 0 0 0 0
120 1.630 1.390 30.135 0 U 5.430E+03 0.000E+00 - 0 0 0 0
121 1.630 1.494 30.135 0 U 1.214E+04 0.000E+00 - 0 0 0 0
122 1.630 2.019 30.135 0 U 8.104E+03 0.000E+00 - 0 0 0 0
123 1.630 7.778 30.135 0 U 2.767E+03 0.000E+00 - 0 0 0 0
124 3.765 0.564 57.885 0 U 1.888E+04 0.000E+00 - 0 0 0 0
125 3.765 1.204 57.885 0 U 7.580E+03 0.000E+00 - 0 0 0 0
126 3.765 1.560 57.885 0 U 1.216E+04 0.000E+00 - 0 0 0 0
127 3.765 0.556 57.885 0 U 1.888E+04 0.000E+00 - 0 0 0 0
128 3.765 0.624 57.885 0 U 1.140E+04 0.000E+00 - 0 0 0 0
129 3.765 0.724 57.885 0 U 4.956E+03 0.000E+00 - 0 0 0 0
130 3.765 1.206 57.885 0 U 7.580E+03 0.000E+00 - 0 0 0 0
131 3.765 0.637 57.885 0 U 8.128E+03 0.000E+00 - 0 0 0 0
132 2.612 1.111 41.536 0 U 9.154E+03 0.000E+00 - 0 0 0 0
133 2.612 0.604 41.536 0 U 7.356E+03 0.000E+00 - 0 0 0 0
135 2.612 1.594 41.536 0 U 4.216E+03 0.000E+00 - 0 0 0 0
136 2.612 1.361 41.536 0 U 2.981E+04 0.000E+00 - 0 0 0 0
138 1.294 3.829 27.150 0 U 3.711E+03 0.000E+00 - 0 0 0 0
139 1.294 7.802 27.150 0 U 3.956E+03 0.000E+00 - 0 0 0 0
140 1.294 1.292 27.150 0 U 3.102E+04 0.000E+00 - 0 0 0 0
141 1.294 1.390 27.150 0 U 2.657E+04 0.000E+00 - 0 0 0 0
142 1.294 1.361 27.150 0 U 2.907E+04 0.000E+00 - 0 0 0 0
143 1.294 1.223 27.150 0 U 1.437E+04 0.000E+00 - 0 0 0 0
144 1.294 1.374 27.150 0 U 2.657E+04 0.000E+00 - 0 0 0 0
145 1.294 1.318 27.150 0 U 3.109E+04 0.000E+00 - 0 0 0 0
146 1.294 1.400 27.150 0 U 2.406E+04 0.000E+00 - 0 0 0 0
147 1.294 2.795 27.150 0 U 8.957E+03 0.000E+00 - 0 0 0 0
148 3.671 1.093 59.631 0 U 5.438E+03 0.000E+00 - 0 0 0 0
149 3.671 1.362 59.631 0 U 5.368E+03 0.000E+00 - 0 0 0 0
150 3.671 1.669 59.631 0 U 1.004E+04 0.000E+00 - 0 0 0 0
151 1.734 3.112 38.061 0 U 2.907E+03 0.000E+00 - 0 0 0 0
152 1.734 0.604 38.061 0 U 1.163E+04 0.000E+00 - 0 0 0 0
153 1.734 8.512 38.061 0 U 2.443E+03 0.000E+00 - 0 0 0 0
154 1.734 1.758 38.061 0 U 7.969E+03 0.000E+00 - 0 0 0 0
155 1.734 8.129 38.061 0 U 1.833E+03 0.000E+00 - 0 0 0 0
157 1.734 0.602 38.061 0 U 1.163E+04 0.000E+00 - 0 0 0 0
158 0.649 0.657 22.840 0 U 1.882E+05 0.000E+00 - 0 0 0 0
159 0.649 1.401 22.840 0 U 1.339E+04 0.000E+00 - 0 0 0 0
160 0.649 1.758 22.840 0 U 1.086E+04 0.000E+00 - 0 0 0 0
161 0.649 3.959 22.840 0 U 8.505E+03 0.000E+00 - 0 0 0 0
162 0.649 0.600 22.840 0 U 1.487E+05 0.000E+00 - 0 0 0 0
163 0.649 1.311 22.840 0 U 1.694E+04 0.000E+00 - 0 0 0 0
164 3.289 1.954 66.128 0 U 8.168E+03 0.000E+00 - 0 0 0 0
165 3.289 0.556 66.128 0 U 7.965E+03 0.000E+00 - 0 0 0 0
166 3.289 0.624 66.128 0 U 1.315E+04 0.000E+00 - 0 0 0 0
167 3.289 7.628 66.128 0 U 4.126E+03 0.000E+00 - 0 0 0 0
168 3.289 0.637 66.128 0 U 1.364E+04 0.000E+00 - 0 0 0 0
169 1.292 3.829 26.760 0 U 1.455E+03 0.000E+00 - 0 0 0 0
170 1.292 1.630 26.760 0 U 3.469E+03 0.000E+00 - 0 0 0 0
171 1.292 1.294 26.760 0 U 1.638E+04 0.000E+00 - 0 0 0 0
172 1.292 7.802 26.760 0 U 1.944E+03 0.000E+00 - 0 0 0 0
173 1.292 2.812 26.760 0 U 3.789E+03 0.000E+00 - 0 0 0 0
175 1.292 1.390 26.760 0 U 1.461E+04 0.000E+00 - 0 0 0 0
176 1.292 1.223 26.760 0 U 7.008E+03 0.000E+00 - 0 0 0 0
177 1.292 1.318 26.760 0 U 1.685E+04 0.000E+00 - 0 0 0 0
178 1.292 1.400 26.760 0 U 1.280E+04 0.000E+00 - 0 0 0 0
179 1.292 2.795 26.760 0 U 3.789E+03 0.000E+00 - 0 0 0 0
180 1.292 1.494 26.760 0 U 6.011E+03 0.000E+00 - 0 0 0 0
181 1.292 1.221 26.760 0 U 7.008E+03 0.000E+00 - 0 0 0 0
182 1.292 7.778 26.760 0 U 2.363E+03 0.000E+00 - 0 0 0 0
183 3.112 1.734 65.658 0 U 4.363E+03 0.000E+00 - 0 0 0 0
184 3.112 0.604 65.658 0 U 8.698E+03 0.000E+00 - 0 0 0 0
185 3.112 3.098 65.658 0 U 9.477E+03 0.000E+00 - 0 0 0 0
186 3.112 0.602 65.658 0 U 8.698E+03 0.000E+00 - 0 0 0 0
187 0.995 0.604 28.225 0 U 1.652E+04 0.000E+00 - 0 0 0 0
188 0.995 1.084 28.225 0 U 2.105E+04 0.000E+00 - 0 0 0 0
189 0.995 0.602 28.225 0 U 1.652E+04 0.000E+00 - 0 0 0 0
190 2.812 3.829 42.906 0 U 3.165E+03 0.000E+00 - 0 0 0 0
191 2.812 1.630 42.906 0 U 8.613E+03 0.000E+00 - 0 0 0 0
192 2.812 1.292 42.906 0 U 1.182E+04 0.000E+00 - 0 0 0 0
193 2.812 1.390 42.906 0 U 1.278E+04 0.000E+00 - 0 0 0 0
194 2.812 2.795 42.906 0 U 1.320E+05 0.000E+00 - 0 0 0 0
195 2.812 1.494 42.906 0 U 8.915E+03 0.000E+00 - 0 0 0 0
196 2.812 7.778 42.906 0 U 2.722E+03 0.000E+00 - 0 0 0 0
197 0.912 1.529 28.823 0 U 3.406E+03 0.000E+00 - 0 0 0 0
198 0.912 0.513 28.823 0 U 5.865E+03 0.000E+00 - 0 0 0 0
199 0.912 0.600 28.823 0 U 1.670E+04 0.000E+00 - 0 0 0 0
200 1.560 0.564 41.627 0 U 1.090E+04 0.000E+00 - 0 0 0 0
201 1.560 1.204 41.627 0 U 9.432E+03 0.000E+00 - 0 0 0 0
202 1.560 3.765 41.627 0 U 5.284E+03 0.000E+00 - 0 0 0 0
203 1.560 0.556 41.627 0 U 1.090E+04 0.000E+00 - 0 0 0 0
204 1.560 0.624 41.627 0 U 6.628E+03 0.000E+00 - 0 0 0 0
205 1.560 1.206 41.627 0 U 9.432E+03 0.000E+00 - 0 0 0 0
206 1.560 1.514 41.627 0 U 1.215E+04 0.000E+00 - 0 0 0 0
207 1.560 0.637 41.627 0 U 3.817E+03 0.000E+00 - 0 0 0 0
208 0.556 0.564 24.540 0 U 3.396E+05 0.000E+00 - 0 0 0 0
209 0.556 1.204 24.540 0 U 1.806E+04 0.000E+00 - 0 0 0 0
211 0.556 3.765 24.540 0 U 6.098E+03 0.000E+00 - 0 0 0 0
213 0.556 1.560 24.540 0 U 2.077E+04 0.000E+00 - 0 0 0 0
214 0.556 0.624 24.540 0 U 2.523E+05 0.000E+00 - 0 0 0 0
215 0.556 7.628 24.540 0 U 4.108E+03 0.000E+00 - 0 0 0 0
216 0.556 8.083 24.540 0 U 3.683E+03 0.000E+00 - 0 0 0 0
217 0.556 1.206 24.540 0 U 1.806E+04 0.000E+00 - 0 0 0 0
218 0.556 1.514 24.540 0 U 1.957E+04 0.000E+00 - 0 0 0 0
219 0.556 7.578 24.540 0 U 3.923E+03 0.000E+00 - 0 0 0 0
220 0.556 1.362 24.540 0 U 1.265E+04 0.000E+00 - 0 0 0 0
221 0.556 1.669 24.540 0 U 5.516E+03 0.000E+00 - 0 0 0 0
222 0.556 0.637 24.540 0 U 1.564E+05 0.000E+00 - 0 0 0 0
223 1.639 1.833 30.607 0 U 3.616E+04 0.000E+00 - 0 0 0 0
224 1.639 3.865 30.607 0 U 5.912E+03 0.000E+00 - 0 0 0 0
226 1.639 1.390 30.607 0 U 6.141E+03 0.000E+00 - 0 0 0 0
227 1.639 2.019 30.607 0 U 1.414E+04 0.000E+00 - 0 0 0 0
228 3.828 1.204 54.764 0 U 1.123E+04 0.000E+00 - 0 0 0 0
229 3.828 7.628 54.764 0 U 2.836E+03 0.000E+00 - 0 0 0 0
230 3.828 1.183 54.764 0 U 1.147E+04 0.000E+00 - 0 0 0 0
231 3.828 1.669 54.764 0 U 5.038E+03 0.000E+00 - 0 0 0 0
232 4.014 3.098 61.425 0 U 4.434E+03 0.000E+00 - 0 0 0 0
233 1.598 0.513 37.254 0 U 3.225E+03 0.000E+00 - 0 0 0 0
235 1.598 0.600 37.254 0 U 5.887E+03 0.000E+00 - 0 0 0 0
236 0.536 0.536 21.717 0 U 3.443E+05 0.000E+00 - 0 0 0 0
237 0.536 8.292 21.717 0 U 3.537E+03 0.000E+00 - 0 0 0 0
238 0.536 1.594 21.717 0 U 2.514E+04 0.000E+00 - 0 0 0 0
239 0.536 1.235 21.717 0 U 1.363E+04 0.000E+00 - 0 0 0 0
240 0.536 2.017 21.717 0 U 5.448E+03 0.000E+00 - 0 0 0 0
241 0.536 3.782 21.717 0 U 1.794E+04 0.000E+00 - 0 0 0 0
242 0.536 1.585 21.717 0 U 2.514E+04 0.000E+00 - 0 0 0 0
243 0.624 1.954 20.174 0 U 1.287E+04 0.000E+00 - 0 0 0 0
244 0.624 0.564 20.174 0 U 6.248E+04 0.000E+00 - 0 0 0 0
245 0.624 1.204 20.174 0 U 3.484E+03 0.000E+00 - 0 0 0 0
246 0.624 3.765 20.174 0 U 5.425E+03 0.000E+00 - 0 0 0 0
248 0.624 1.560 20.174 0 U 6.162E+03 0.000E+00 - 0 0 0 0
249 0.624 0.556 20.174 0 U 6.248E+04 0.000E+00 - 0 0 0 0
250 0.624 8.083 20.174 0 U 1.744E+03 0.000E+00 - 0 0 0 0
251 0.624 1.206 20.174 0 U 3.484E+03 0.000E+00 - 0 0 0 0
252 0.624 1.514 20.174 0 U 3.378E+03 0.000E+00 - 0 0 0 0
253 0.624 0.637 20.174 0 U 1.414E+05 0.000E+00 - 0 0 0 0
254 1.413 0.621 26.845 0 U 1.797E+04 0.000E+00 - 0 0 0 0
255 1.413 1.529 26.845 0 U 1.760E+04 0.000E+00 - 0 0 0 0
256 1.413 1.515 26.845 0 U 1.760E+04 0.000E+00 - 0 0 0 0
257 1.413 0.675 26.845 0 U 1.621E+04 0.000E+00 - 0 0 0 0
258 1.413 1.442 26.845 0 U 4.230E+04 0.000E+00 - 0 0 0 0
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546 4.070 1.020 64.075 0 U 6.456E+03 0.000E+00 - 0 0 0 0
547 4.070 1.022 64.075 0 U 6.456E+03 0.000E+00 - 0 0 0 0
548 2.795 3.829 43.008 0 U 3.916E+03 0.000E+00 - 0 0 0 0
549 2.795 1.294 43.008 0 U 1.373E+04 0.000E+00 - 0 0 0 0
550 2.795 1.292 43.008 0 U 1.373E+04 0.000E+00 - 0 0 0 0
551 2.795 2.812 43.008 0 U 1.405E+05 0.000E+00 - 0 0 0 0
552 2.795 1.390 43.008 0 U 1.474E+04 0.000E+00 - 0 0 0 0
553 2.795 1.400 43.008 0 U 1.378E+04 0.000E+00 - 0 0 0 0
554 1.362 0.564 29.084 0 U 9.022E+03 0.000E+00 - 0 0 0 0
555 1.362 7.739 29.084 0 U 1.549E+03 0.000E+00 - 0 0 0 0
556 1.362 3.671 29.084 0 U 2.270E+03 0.000E+00 - 0 0 0 0
557 1.362 0.556 29.084 0 U 9.022E+03 0.000E+00 - 0 0 0 0
558 1.362 0.774 29.084 0 U 3.447E+03 0.000E+00 - 0 0 0 0
559 1.362 0.724 29.084 0 U 3.853E+03 0.000E+00 - 0 0 0 0
560 1.362 1.235 29.084 0 U 2.286E+04 0.000E+00 - 0 0 0 0
561 1.362 1.093 29.084 0 U 1.305E+04 0.000E+00 - 0 0 0 0
562 1.362 3.782 29.084 0 U 2.563E+03 0.000E+00 - 0 0 0 0
563 1.362 1.669 29.084 0 U 7.091E+03 0.000E+00 - 0 0 0 0
564 1.494 3.922 30.135 0 U 3.560E+03 0.000E+00 - 0 0 0 0
565 1.494 1.630 30.135 0 U 1.148E+04 0.000E+00 - 0 0 0 0
566 1.494 1.292 30.135 0 U 4.981E+03 0.000E+00 - 0 0 0 0
567 1.494 2.812 30.135 0 U 2.925E+03 0.000E+00 - 0 0 0 0
568 1.494 1.390 30.135 0 U 5.711E+03 0.000E+00 - 0 0 0 0
569 1.494 7.778 30.135 0 U 2.232E+03 0.000E+00 - 0 0 0 0
570 0.600 0.657 16.379 0 U 9.727E+04 0.000E+00 - 0 0 0 0
571 0.600 0.649 16.379 0 U 1.478E+05 0.000E+00 - 0 0 0 0
572 0.600 0.912 16.379 0 U 1.354E+04 0.000E+00 - 0 0 0 0
573 0.600 7.654 16.379 0 U 3.458E+03 0.000E+00 - 0 0 0 0
574 0.600 1.598 16.379 0 U 1.448E+04 0.000E+00 - 0 0 0 0
575 0.600 3.789 16.379 0 U 3.125E+03 0.000E+00 - 0 0 0 0
576 0.600 3.959 16.379 0 U 3.915E+03 0.000E+00 - 0 0 0 0
577 0.600 0.513 16.379 0 U 3.021E+04 0.000E+00 - 0 0 0 0
578 0.600 8.353 16.379 0 U 4.418E+03 0.000E+00 - 0 0 0 0
580 0.600 1.311 16.379 0 U 1.278E+04 0.000E+00 - 0 0 0 0
581 3.782 0.536 57.983 0 U 1.971E+04 0.000E+00 - 0 0 0 0
582 3.782 1.594 57.983 0 U 1.169E+04 0.000E+00 - 0 0 0 0
583 3.782 1.235 57.983 0 U 7.942E+03 0.000E+00 - 0 0 0 0
584 3.782 1.362 57.983 0 U 4.539E+03 0.000E+00 - 0 0 0 0
585 3.782 1.585 57.983 0 U 1.169E+04 0.000E+00 - 0 0 0 0
586 3.782 3.875 57.983 0 U 1.424E+04 0.000E+00 - 0 0 0 0
587 1.669 0.564 31.958 0 U 1.886E+03 0.000E+00 - 0 0 0 0
588 1.669 7.739 31.958 0 U 8.086E+03 0.000E+00 - 0 0 0 0
589 1.669 3.671 31.958 0 U 6.682E+03 0.000E+00 - 0 0 0 0
590 1.669 0.556 31.958 0 U 1.886E+03 0.000E+00 - 0 0 0 0
591 1.669 3.828 31.958 0 U 5.018E+03 0.000E+00 - 0 0 0 0
592 1.669 0.774 31.958 0 U 3.127E+03 0.000E+00 - 0 0 0 0
593 1.669 0.724 31.958 0 U 2.708E+03 0.000E+00 - 0 0 0 0
594 1.669 1.235 31.958 0 U 7.017E+03 0.000E+00 - 0 0 0 0
595 1.669 1.093 31.958 0 U 8.427E+03 0.000E+00 - 0 0 0 0
596 1.669 1.206 31.958 0 U 8.547E+03 0.000E+00 - 0 0 0 0
597 1.669 7.578 31.958 0 U 4.821E+03 0.000E+00 - 0 0 0 0
598 1.669 1.362 31.958 0 U 8.068E+03 0.000E+00 - 0 0 0 0
599 1.020 4.030 21.098 0 U 3.324E+04 0.000E+00 - 0 0 0 0
600 1.020 4.006 21.098 0 U 3.061E+04 0.000E+00 - 0 0 0 0
601 1.020 4.070 21.098 0 U 2.917E+04 0.000E+00 - 0 0 0 0
602 1.020 3.875 21.098 0 U 1.841E+04 0.000E+00 - 0 0 0 0
603 1.020 1.022 21.098 0 U 2.652E+05 0.000E+00 - 0 0 0 0
604 2.019 1.630 34.162 0 U 1.582E+04 0.000E+00 - 0 0 0 0
605 2.019 1.639 34.162 0 U 1.633E+04 0.000E+00 - 0 0 0 0
606 2.019 1.833 34.162 0 U 4.070E+04 0.000E+00 - 0 0 0 0
607 2.019 7.613 34.162 0 U 5.000E+03 0.000E+00 - 0 0 0 0
608 1.221 1.292 24.798 0 U 7.222E+03 0.000E+00 - 0 0 0 0
609 1.221 1.111 24.798 0 U 1.107E+04 0.000E+00 - 0 0 0 0
611 1.221 1.390 24.798 0 U 7.130E+03 0.000E+00 - 0 0 0 0
612 1.221 1.361 24.798 0 U 7.834E+03 0.000E+00 - 0 0 0 0
613 1.221 1.223 24.798 0 U 1.662E+04 0.000E+00 - 0 0 0 0
615 1.221 1.318 24.798 0 U 7.172E+03 0.000E+00 - 0 0 0 0
616 3.558 3.436 46.954 0 U 1.160E+04 0.000E+00 - 0 0 0 0
617 3.558 3.563 46.954 0 U 1.219E+04 0.000E+00 - 0 0 0 0
618 3.558 8.564 46.954 0 U 4.649E+03 0.000E+00 - 0 0 0 0
619 3.558 0.654 46.954 0 U 3.894E+03 0.000E+00 - 0 0 0 0
620 3.558 3.441 46.954 0 U 1.160E+04 0.000E+00 - 0 0 0 0
621 1.311 0.657 41.798 0 U 4.807E+03 0.000E+00 - 0 0 0 0
622 1.311 0.649 41.798 0 U 6.039E+03 0.000E+00 - 0 0 0 0
623 1.311 1.401 41.798 0 U 2.816E+03 0.000E+00 - 0 0 0 0
624 1.311 1.758 41.798 0 U 2.914E+03 0.000E+00 - 0 0 0 0
625 1.311 0.513 41.798 0 U 1.211E+03 0.000E+00 - 0 0 0 0
626 1.311 0.600 41.798 0 U 6.682E+03 0.000E+00 - 0 0 0 0
627 1.585 0.536 41.878 0 U 8.732E+03 0.000E+00 - 0 0 0 0
628 1.585 1.594 41.878 0 U 1.121E+04 0.000E+00 - 0 0 0 0
629 1.585 1.235 41.878 0 U 6.881E+03 0.000E+00 - 0 0 0 0
630 1.585 3.782 41.878 0 U 3.166E+03 0.000E+00 - 0 0 0 0
631 3.707 7.802 56.978 0 U 5.987E+03 0.000E+00 - 0 0 0 0
632 3.707 1.111 56.978 0 U 5.321E+03 0.000E+00 - 0 0 0 0
633 3.707 1.223 56.978 0 U 6.837E+03 0.000E+00 - 0 0 0 0
634 3.707 1.318 56.978 0 U 6.661E+03 0.000E+00 - 0 0 0 0
635 3.707 7.778 56.978 0 U 6.656E+03 0.000E+00 - 0 0 0 0
636 3.875 4.030 64.204 0 U 6.189E+03 0.000E+00 - 0 0 0 0
637 3.875 4.006 64.204 0 U 5.261E+03 0.000E+00 - 0 0 0 0
638 3.875 3.782 64.204 0 U 4.593E+03 0.000E+00 - 0 0 0 0
639 3.875 1.020 64.204 0 U 6.670E+03 0.000E+00 - 0 0 0 0
640 3.875 1.022 64.204 0 U 6.670E+03 0.000E+00 - 0 0 0 0
641 3.441 3.436 43.701 0 U 1.404E+04 0.000E+00 - 0 0 0 0
642 3.441 3.563 43.701 0 U 1.132E+04 0.000E+00 - 0 0 0 0
643 3.441 3.558 43.701 0 U 1.132E+04 0.000E+00 - 0 0 0 0
644 0.602 1.954 12.776 0 U 6.730E+03 0.000E+00 - 0 0 0 0
645 0.602 1.576 12.776 0 U 7.249E+03 0.000E+00 - 0 0 0 0
646 0.602 3.778 12.776 0 U 5.061E+03 0.000E+00 - 0 0 0 0
647 0.602 0.654 12.776 0 U 2.877E+05 0.000E+00 - 0 0 0 0
648 1.022 4.030 20.702 0 U 1.910E+04 0.000E+00 - 0 0 0 0
649 1.022 4.006 20.702 0 U 1.847E+04 0.000E+00 - 0 0 0 0
650 1.022 4.070 20.702 0 U 1.595E+04 0.000E+00 - 0 0 0 0
651 1.022 1.020 20.702 0 U 1.541E+05 0.000E+00 - 0 0 0 0
652 1.022 3.875 20.702 0 U 1.049E+04 0.000E+00 - 0 0 0 0
653 1.095 1.183 27.964 0 U 1.696E+04 0.000E+00 - 0 0 0 0
654 1.583 3.829 29.999 0 U 5.912E+03 0.000E+00 - 0 0 0 0
655 1.583 1.833 29.999 0 U 5.334E+03 0.000E+00 - 0 0 0 0
656 1.583 7.387 29.999 0 U 2.665E+03 0.000E+00 - 0 0 0 0
657 1.583 7.778 29.999 0 U 3.344E+03 0.000E+00 - 0 0 0 0
658 0.637 1.954 20.417 0 U 1.635E+04 0.000E+00 - 0 0 0 0
659 0.637 0.564 20.417 0 U 5.593E+04 0.000E+00 - 0 0 0 0
660 0.637 1.204 20.417 0 U 6.162E+03 0.000E+00 - 0 0 0 0
661 0.637 3.765 20.417 0 U 5.608E+03 0.000E+00 - 0 0 0 0
663 0.637 1.560 20.417 0 U 7.997E+03 0.000E+00 - 0 0 0 0
664 0.637 0.556 20.417 0 U 5.593E+04 0.000E+00 - 0 0 0 0
665 0.637 0.624 20.417 0 U 1.657E+05 0.000E+00 - 0 0 0 0
666 0.637 3.778 20.417 0 U 6.701E+03 0.000E+00 - 0 0 0 0
667 0.637 1.206 20.417 0 U 6.162E+03 0.000E+00 - 0 0 0 0
668 0.637 1.514 20.417 0 U 5.132E+03 0.000E+00 - 0 0 0 0
669 0.602 1.734 12.466 0 U 8.517E+03 0.000E+00 - 0 0 0 0
670 0.602 3.112 12.466 0 U 2.170E+03 0.000E+00 - 0 0 0 0
671 0.602 0.995 12.466 0 U 1.580E+04 0.000E+00 - 0 0 0 0
672 0.602 0.604 12.466 0 U 3.099E+05 0.000E+00 - 0 0 0 0
673 0.602 1.084 12.466 0 U 6.927E+03 0.000E+00 - 0 0 0 0
674 3.663 3.782 45.759 0 U 7.786E+03 0.000E+00 - 0 0 0 0
675 3.663 4.063 45.759 0 U 3.492E+03 0.000E+00 - 0 0 0 0
676 3.818 4.063 45.759 0 U 3.055E+03 0.000E+00 - 0 0 0 0
677 4.098 3.461 58.803 0 U 2.129E+03 0.000E+00 - 0 0 0 0
678 3.301 4.098 49.822 0 U 1.560E+03 0.000E+00 - 0 0 0 0
679 3.449 4.098 49.822 0 U 2.447E+03 0.000E+00 - 0 0 0 0
680 2.612 1.362 41.844 0 U 2.981E+04 0.000E+00 - 0 0 0 0
681 2.501 2.406 41.568 0 U 3.669E+04 0.000E+00 - 0 0 0 0
682 2.406 2.501 41.568 0 U 2.999E+04 0.000E+00 - 0 0 0 0
683 2.612 1.093 41.844 0 U 9.154E+03 0.000E+00 - 0 0 0 0
684 3.902 7.701 66.485 0 U 2.507E+03 0.000E+00 - 0 0 0 0
685 1.088 2.406 28.261 0 U 4.761E+03 0.000E+00 - 0 0 0 0
686 1.088 1.111 28.261 0 U 6.595E+04 0.000E+00 - 0 0 0 0
687 1.088 3.707 28.261 0 U 3.810E+03 0.000E+00 - 0 0 0 0
688 1.088 1.223 28.261 0 U 9.387E+03 0.000E+00 - 0 0 0 0
689 1.088 1.318 28.261 0 U 4.659E+03 0.000E+00 - 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 . . 13.9518 ppm . . . 4.701 . . 30481 1
2 . . C 13 C-aliphatic . . 74.9999 ppm . . . 44.000 . . 30481 1
3 . . H 1 H . . 14.0000 ppm . . . 4.701 . . 30481 1
stop_
save_