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 34342
_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.Experiment_ID 3
_Spectral_peak_list.Experiment_name '2D 1H-1H ROESY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 1
_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 2
# INAME 1 H1
# INAME 2 H1
2 8.304 8.229 0 U 4.610e+02 0.00e+00 - 0 141 24 0
# H Q10/H Q11
4 8.373 8.248 0 U 5.043e+02 0.00e+00 - 0 4 14 0
# H Q4/H Q5
5 8.373 8.295 0 U 8.376e+02 0.00e+00 - 0 4 9 0
# H Q4/H Q3
7 8.248 8.096 0 U 4.334e+02 0.00e+00 - 0 14 53 0
# H Q5/H A6
8 8.096 8.248 0 U 1.399e+02 0.00e+00 - 0 53 14 0
# H A6/H Q5
10 8.096 7.988 0 U 6.993e+02 0.00e+00 - 0 53 61 0
# H A6/H F7
11 4.218 7.818 0 U 2.738e+03 0.00e+00 - 0 81 170 0
# HA P12/H Y13
12 7.818 4.218 0 U 1.585e+03 0.00e+00 - 0 170 81 0
# H Y13/HA P12
14 1.771 3.679 0 U 1.554e+02 0.00e+00 - 0 98 97 0
# ?/? 24
18 4.165 4.165 0 U 2.167e+07 0.00e+00 - 0 168 168 0
# HA/HA 37
19 4.165 2.328 0 U 4.563e+02 0.00e+00 - 0 168 142 0
# HA/? 37
20 4.165 8.233 0 U 1.089e+03 0.00e+00 - 0 168 143 0
# HA/? 37
22 2.090 1.736 0 U 1.293e+03 0.00e+00 - 0 158 161 0
# HB/HG3 40
23 2.090 1.814 0 U 4.272e+02 0.00e+00 - 0 158 160 0
# HB/HG2 40
24 2.090 4.098 0 U 1.134e+03 0.00e+00 - 0 158 159 0
# HB/HA 40
27 1.780 3.683 0 U 1.637e+02 0.00e+00 - 0 150 148 0
# HB/HA 38
30 1.780 1.677 0 U 1.993e+04 0.00e+00 - 0 150 151 0
# HB/HG2 38
33 2.028 1.653 0 U 2.215e+03 0.00e+00 - 0 127 125 0
# ?/? 32
38 1.810 4.085 0 U 6.219e+02 0.00e+00 - 0 16 13 0
# HB2/HA Q5
41 4.166 8.373 0 U 2.652e+03 0.00e+00 - 0 8 4 0
# HA Q3/H Q4
42 4.166 1.814 0 U 2.514e+03 0.00e+00 - 0 8 12 0
# HA/HG3 Q3
43 4.166 1.921 0 U 2.664e+03 0.00e+00 - 0 8 11 0
# HA/HG2 Q3
44 4.166 2.196 0 U 2.740e+03 0.00e+00 - 0 8 10 0
# HA/HB Q3
45 4.166 8.295 0 U 2.338e+03 0.00e+00 - 0 8 9 0
# HA/H Q3
47 2.203 1.814 0 U 6.039e+03 0.00e+00 - 0 140 167 0
# HG/HB3 Q10
49 2.203 4.135 0 U 1.278e+03 0.00e+00 - 0 140 144 0
# HG/HA Q10
50 2.203 8.304 0 U 4.718e+02 0.00e+00 - 0 140 141 0
# HG/H Q10
51 6.670 2.837 0 U 1.322e+02 0.00e+00 - 0 132 67 0
# HE/HB3 16
52 6.670 2.923 0 U 1.436e+02 0.00e+00 - 0 132 66 0
# HE/HB2 16
54 2.693 3.008 0 U 1.309e+04 0.00e+00 - 0 124 123 0
# HB3/HB2 31
55 2.693 8.056 0 U 1.677e+01 0.00e+00 - 0 124 122 0
# HB3/H 31
56 2.693 4.742 0 U 4.818e+01 0.00e+00 - 0 124 121 0
# HB3/HA 31
60 2.838 2.916 0 U 1.618e+05 0.00e+00 - 0 108 107 0
# HB3/HB2 26
61 2.838 7.732 0 U 1.240e+02 0.00e+00 - 0 108 106 0
# HB3/H 26
64 3.455 1.756 0 U 8.353e+02 0.00e+00 - 0 92 131 0
# HD3/HG3 P8
65 3.455 3.646 0 U 4.727e+03 0.00e+00 - 0 92 91 0
# HD3/HD2 P8
66 3.455 1.871 0 U 6.604e+02 0.00e+00 - 0 92 130 0
# HD3/HG2 P8
68 3.455 2.181 0 U 5.810e+02 0.00e+00 - 0 92 129 0
# HD3/HB P8
70 3.455 2.989 0 U 1.005e+03 0.00e+00 - 0 92 62 0
# HD3 P8/HB2 F7
71 2.027 2.027 0 U 7.440e+04 0.00e+00 - 0 83 83 0
# HB/HB P12
72 2.027 1.675 0 U 4.842e+03 0.00e+00 - 0 83 157 0
# HB/HG3 P12
73 2.027 3.468 0 U 1.703e+02 0.00e+00 - 0 83 82 0
# HB/HD3 P12
74 2.027 4.218 0 U 4.567e+03 0.00e+00 - 0 83 81 0
# HB/HA P12
75 2.027 3.561 0 U 3.337e+02 0.00e+00 - 0 83 80 0
# HB/HD2 P12
77 4.290 4.290 0 U 3.202e+04 0.00e+00 - 0 75 75 0
# HA/HA P9
78 4.290 1.861 0 U 4.570e+02 0.00e+00 - 0 75 76 0
# HA/HG P9
79 4.290 1.742 0 U 3.227e+02 0.00e+00 - 0 75 77 0
# HA/HB3 P9
80 4.290 2.135 0 U 1.185e+03 0.00e+00 - 0 75 74 0
# HA/HB2 P9
81 4.290 3.641 0 U 7.436e+02 0.00e+00 - 0 75 79 0
# HA/HD2 P9
82 4.290 3.467 0 U 3.818e+02 0.00e+00 - 0 75 78 0
# HA/HD3 P9
83 4.290 8.304 0 U 3.405e+03 0.00e+00 - 0 75 141 0
# HA P9/H Q10
84 4.290 8.110 0 U 8.815e+01 0.00e+00 - 0 75 35 0
# HA P9/H 8
85 2.837 2.837 0 U 4.222e+06 0.00e+00 - 0 67 67 0
# HB3/HB3 16
88 2.801 7.954 0 U 3.300e+02 0.00e+00 - 0 59 58 0
# HB/H 14
90 2.801 7.112 0 U 1.713e+03 0.00e+00 - 0 59 137 0
# HB/HD 14
91 2.801 7.233 0 U 3.152e+02 0.00e+00 - 0 59 136 0
# HB/HE 14
93 8.191 4.199 0 U 3.970e+02 0.00e+00 - 0 51 50 0
# H/HA 11
95 2.880 8.137 0 U 9.693e+01 0.00e+00 - 0 43 41 0
# HB3/H 9
99 1.654 2.166 0 U 3.057e+02 0.00e+00 - 0 34 38 0
# HG3/HB2 8
100 1.654 2.015 0 U 7.109e+02 0.00e+00 - 0 34 37 0
# HG3/HB3 8
103 8.191 4.447 0 U 6.393e+01 0.00e+00 - 0 26 25 0
# H/HA 6
104 8.191 2.180 0 U 1.885e+02 0.00e+00 - 0 26 27 0
# H/HB 6
105 3.679 1.771 0 U 7.824e+02 0.00e+00 - 0 97 98 0
# ?/? 24
107 3.679 1.862 0 U 1.874e+03 0.00e+00 - 0 97 96 0
# ?/? 24
111 2.915 7.818 0 U 4.425e+02 0.00e+00 - 0 171 170 0
# HB2/H Y13
113 2.915 4.384 0 U 1.122e+03 0.00e+00 - 0 171 169 0
# HB2/HA Y13
117 1.814 4.135 0 U 1.006e+03 0.00e+00 - 0 167 144 0
# HB3/HA Q10
118 1.814 8.304 0 U 3.164e+02 0.00e+00 - 0 167 141 0
# HB3/H Q10
119 1.675 2.027 0 U 5.897e+03 0.00e+00 - 0 157 83 0
# HG3/HB P12
121 1.675 3.468 0 U 4.169e+02 0.00e+00 - 0 157 82 0
# HG3/HD3 P12
123 1.675 3.561 0 U 2.536e+02 0.00e+00 - 0 157 80 0
# HG3/HD2 P12
127 3.229 3.683 0 U 7.695e+01 0.00e+00 - 0 149 148 0
# HD3/HA 38
129 3.229 1.555 0 U 4.621e+02 0.00e+00 - 0 149 152 0
# HD3/HG3 38
130 3.229 1.677 0 U 2.020e+02 0.00e+00 - 0 149 151 0
# HD3/HG2 38
131 2.301 2.028 0 U 1.054e+02 0.00e+00 - 0 128 127 0
# ?/? 32
133 2.301 1.653 0 U 4.256e+01 0.00e+00 - 0 128 125 0
# ?/? 32
135 2.328 4.165 0 U 2.630e+02 0.00e+00 - 0 142 168 0
# ?/HA 37
137 2.328 8.233 0 U 3.961e+01 0.00e+00 - 0 142 143 0
# ?/? 37
139 6.624 6.960 0 U 2.602e+03 0.00e+00 - 0 134 135 0
# ?/? 34
143 2.089 1.810 0 U 4.496e+02 0.00e+00 - 0 15 16 0
# HG/HB2 Q5
145 2.089 8.248 0 U 2.096e+02 0.00e+00 - 0 15 14 0
# HG/H Q5
146 2.089 4.085 0 U 7.368e+02 0.00e+00 - 0 15 13 0
# HG/HA Q5
147 2.089 1.738 0 U 1.762e+03 0.00e+00 - 0 15 17 0
# HG/HB3 Q5
150 1.810 2.182 0 U 3.662e+03 0.00e+00 - 0 7 5 0
# HB3/HG Q4
151 1.810 8.373 0 U 1.787e+02 0.00e+00 - 0 7 4 0
# HB3/H Q4
152 1.810 4.134 0 U 8.707e+02 0.00e+00 - 0 7 3 0
# HB3/HA Q4
153 1.756 3.455 0 U 9.199e+02 0.00e+00 - 0 131 92 0
# HG3/HD3 P8
154 1.756 1.756 0 U 9.541e+04 0.00e+00 - 0 131 131 0
# HG3/HG3 P8
155 1.756 3.646 0 U 3.050e+02 0.00e+00 - 0 131 91 0
# HG3/HD2 P8
158 1.756 2.181 0 U 8.595e+03 0.00e+00 - 0 131 129 0
# HG3/HB P8
159 3.008 2.693 0 U 1.179e+04 0.00e+00 - 0 123 124 0
# HB2/HB3 31
160 3.008 3.008 0 U 1.506e+05 0.00e+00 - 0 123 123 0
# HB2/HB2 31
164 8.123 4.520 0 U 1.366e+02 0.00e+00 - 0 115 114 0
# H/HA 28
165 2.916 2.838 0 U 4.259e+02 0.00e+00 - 0 107 108 0
# HB2/HB3 26
166 2.916 2.916 0 U 5.244e+05 0.00e+00 - 0 107 107 0
# HB2/HB2 26
167 2.916 7.732 0 U 1.613e+02 0.00e+00 - 0 107 106 0
# HB2/H 26
169 3.646 3.455 0 U 7.329e+03 0.00e+00 - 0 91 92 0
# HD2/HD3 P8
170 3.646 1.756 0 U 6.507e+02 0.00e+00 - 0 91 131 0
# HD2/HG3 P8
172 3.646 1.871 0 U 1.766e+03 0.00e+00 - 0 91 130 0
# HD2/HG2 P8
174 3.646 2.181 0 U 6.095e+02 0.00e+00 - 0 91 129 0
# HD2/HB P8
176 3.468 2.027 0 U 1.727e+02 0.00e+00 - 0 82 83 0
# HD3/HB P12
177 3.468 1.675 0 U 5.741e+02 0.00e+00 - 0 82 157 0
# HD3/HG3 P12
179 3.468 4.447 0 U 5.148e+01 0.00e+00 - 0 82 25 0
# HD3 P12/HA 6
182 3.468 1.795 0 U 2.239e+03 0.00e+00 - 0 82 84 0
# HD3/HG2 P12
185 7.954 2.801 0 U 3.710e+02 0.00e+00 - 0 58 59 0
# H/HB 14
187 7.954 4.284 0 U 1.083e+02 0.00e+00 - 0 58 57 0
# H/HA 14
188 7.954 7.112 0 U 5.390e+02 0.00e+00 - 0 58 137 0
# H/HD 14
189 7.954 7.233 0 U 1.645e+02 0.00e+00 - 0 58 136 0
# H/HE 14
190 7.954 4.116 0 U 9.240e+02 0.00e+00 - 0 58 68 0
# H 14/HA 13
191 4.199 8.191 0 U 5.864e+02 0.00e+00 - 0 50 51 0
# HA/H 11
192 4.199 4.199 0 U 7.757e+04 0.00e+00 - 0 50 50 0
# HA/HA 11
193 8.137 2.880 0 U 1.741e+02 0.00e+00 - 0 41 43 0
# H/HB3 9
195 8.137 4.426 0 U 1.226e+02 0.00e+00 - 0 41 40 0
# H/HA 9
196 8.137 3.006 0 U 1.580e+02 0.00e+00 - 0 41 44 0
# H/HB2 9
197 4.447 8.191 0 U 1.451e+02 0.00e+00 - 0 25 26 0
# HA/H 6
198 4.447 3.468 0 U 2.236e+03 0.00e+00 - 0 25 82 0
# HA 6/HD3 P12
200 4.447 3.561 0 U 2.935e+03 0.00e+00 - 0 25 80 0
# HA 6/HD2 P12
201 4.447 2.180 0 U 8.135e+02 0.00e+00 - 0 25 27 0
# HA/HB 6
202 1.777 1.777 0 U 4.252e+05 0.00e+00 - 0 104 104 0
# ?/? 25
209 1.862 1.554 0 U 4.705e+02 0.00e+00 - 0 96 100 0
# ?/? 24
210 1.862 1.676 0 U 1.796e+03 0.00e+00 - 0 96 99 0
# ?/? 24
212 8.589 3.847 0 U 2.642e+03 0.00e+00 - 0 2 1 0
# H/HA G2
213 8.589 3.901 0 U 3.033e+03 0.00e+00 - 0 2 70 0
# H G2/HA L1
214 8.589 8.295 0 U 3.918e+02 0.00e+00 - 0 2 9 0
# H G2/H Q3
215 1.921 2.203 0 U 2.042e+04 0.00e+00 - 0 166 140 0
# HB2/HG Q10
217 1.921 1.921 0 U 4.624e+04 0.00e+00 - 0 166 166 0
# HB2/HB2 Q10
218 1.921 4.135 0 U 1.930e+03 0.00e+00 - 0 166 144 0
# HB2/HA Q10
219 1.921 8.304 0 U 1.401e+02 0.00e+00 - 0 166 141 0
# HB2/H Q10
223 1.742 2.137 0 U 3.269e+03 0.00e+00 - 0 156 153 0
# HG3/HB 39
224 3.683 1.780 0 U 1.833e+02 0.00e+00 - 0 148 150 0
# HA/HB 38
225 3.683 3.229 0 U 2.205e+02 0.00e+00 - 0 148 149 0
# HA/HD3 38
226 3.683 3.683 0 U 4.389e+04 0.00e+00 - 0 148 148 0
# HA/HA 38
227 3.683 3.317 0 U 6.171e+02 0.00e+00 - 0 148 147 0
# HA/HD2 38
228 3.683 1.555 0 U 2.447e+03 0.00e+00 - 0 148 152 0
# HA/HG3 38
229 3.683 1.677 0 U 2.812e+03 0.00e+00 - 0 148 151 0
# HA/HG2 38
230 8.233 4.165 0 U 1.101e+03 0.00e+00 - 0 143 168 0
# ?/HA 37
231 8.233 2.328 0 U 1.132e+02 0.00e+00 - 0 143 142 0
# ?/? 37
232 8.233 8.233 0 U 6.289e+03 0.00e+00 - 0 143 143 0
# ?/? 37
233 6.960 6.624 0 U 2.918e+03 0.00e+00 - 0 135 134 0
# ?/? 34
237 3.260 4.408 0 U 4.279e+01 0.00e+00 - 0 95 93 0
# ?/HA 23
239 1.653 2.301 0 U 1.035e+02 0.00e+00 - 0 125 128 0
# ?/? 32
242 1.861 4.290 0 U 2.219e+04 0.00e+00 - 0 76 75 0
# HG/HA P9
243 1.861 1.861 0 U 1.346e+09 0.00e+00 - 0 76 76 0
# HG/HG P9
244 1.861 1.742 0 U 1.212e+05 0.00e+00 - 0 76 77 0
# HG/HB3 P9
245 1.861 2.135 0 U 2.262e+02 0.00e+00 - 0 76 74 0
# HG/HB2 P9
247 1.861 3.467 0 U 7.057e+02 0.00e+00 - 0 76 78 0
# HG/HD3 P9
248 8.248 1.810 0 U 3.241e+02 0.00e+00 - 0 14 16 0
# H/HB2 Q5
249 8.248 2.089 0 U 3.417e+02 0.00e+00 - 0 14 15 0
# H/HG Q5
251 8.248 4.085 0 U 5.616e+02 0.00e+00 - 0 14 13 0
# H/HA Q5
252 8.248 4.134 0 U 7.076e+02 0.00e+00 - 0 14 3 0
# H Q5/HA Q4
253 8.248 1.738 0 U 2.129e+02 0.00e+00 - 0 14 17 0
# H/HB3 Q5
255 1.900 1.900 0 U 3.008e+05 0.00e+00 - 0 6 6 0
# HB2/HB2 Q4
258 1.900 4.134 0 U 2.070e+02 0.00e+00 - 0 6 3 0
# HB2/HA Q4
259 3.847 8.589 0 U 2.094e+03 0.00e+00 - 0 1 2 0
# HA/H G2
261 3.847 2.196 0 U 5.251e+02 0.00e+00 - 0 1 10 0
# HA G2/HB Q3
262 3.852 8.292 0 U 3.396e+03 0.00e+00 - 0 1 9 0
# HA G2/H Q3
263 1.871 3.455 0 U 1.767e+03 0.00e+00 - 0 130 92 0
# HG2/HD3 P8
265 1.871 3.646 0 U 2.429e+03 0.00e+00 - 0 130 91 0
# HG2/HD2 P8
266 1.871 1.871 0 U 2.081e+07 0.00e+00 - 0 130 130 0
# HG2/HG2 P8
268 1.871 2.181 0 U 2.075e+03 0.00e+00 - 0 130 129 0
# HG2/HB P8
269 8.056 2.693 0 U 3.879e+01 0.00e+00 - 0 122 124 0
# H/HB3 31
271 8.056 8.056 0 U 2.025e+04 0.00e+00 - 0 122 122 0
# H/H 31
273 4.520 8.123 0 U 2.379e+01 0.00e+00 - 0 114 115 0
# HA/H 28
275 7.732 2.838 0 U 9.493e+01 0.00e+00 - 0 106 108 0
# H/HB3 26
276 7.732 2.916 0 U 1.041e+02 0.00e+00 - 0 106 107 0
# H/HB2 26
279 4.561 3.455 0 U 8.150e+02 0.00e+00 - 0 90 92 0
# HA/HD3 P8
280 4.561 1.756 0 U 6.147e+02 0.00e+00 - 0 90 131 0
# HA/HG3 P8
281 4.561 3.646 0 U 2.976e+03 0.00e+00 - 0 90 91 0
# HA/HD2 P8
282 4.561 1.871 0 U 8.296e+02 0.00e+00 - 0 90 130 0
# HA/HG2 P8
284 4.561 2.181 0 U 2.337e+03 0.00e+00 - 0 90 129 0
# HA/HB P8
285 4.218 2.027 0 U 2.568e+03 0.00e+00 - 0 81 83 0
# HA/HB P12
286 4.218 1.675 0 U 6.351e+02 0.00e+00 - 0 81 157 0
# HA/HG3 P12
287 4.218 3.468 0 U 7.294e+02 0.00e+00 - 0 81 82 0
# HA/HD3 P12
289 4.218 3.561 0 U 8.621e+02 0.00e+00 - 0 81 80 0
# HA/HD2 P12
290 4.218 1.795 0 U 1.302e+03 0.00e+00 - 0 81 84 0
# HA/HG2 P12
292 4.125 1.035 0 U 5.847e+02 0.00e+00 - 0 73 72 0
# HA/HB 18
294 4.284 2.801 0 U 5.426e+02 0.00e+00 - 0 57 59 0
# HA/HB 14
295 4.284 7.954 0 U 3.878e+02 0.00e+00 - 0 57 58 0
# HA/H 14
296 4.284 4.284 0 U 1.285e+04 0.00e+00 - 0 57 57 0
# HA/HA 14
297 4.284 7.112 0 U 1.092e+02 0.00e+00 - 0 57 137 0
# HA/HD 14
300 4.161 1.811 0 U 5.529e+01 0.00e+00 - 0 49 48 0
# HA/HB3 10
302 4.161 8.332 0 U 5.039e+02 0.00e+00 - 0 49 46 0
# HA/H 10
303 4.161 2.288 0 U 5.618e+02 0.00e+00 - 0 49 45 0
# HA/HB 10
304 4.426 2.880 0 U 6.328e+02 0.00e+00 - 0 40 43 0
# HA/HB3 9
305 4.426 8.137 0 U 6.477e+02 0.00e+00 - 0 40 41 0
# HA/H 9
306 4.426 4.426 0 U 4.830e+04 0.00e+00 - 0 40 40 0
# HA/HA 9
307 4.426 3.006 0 U 4.070e+02 0.00e+00 - 0 40 44 0
# HA/HB2 9
309 8.229 1.730 0 U 2.656e+02 0.00e+00 - 0 24 23 0
# H/HB3 Q11
310 8.229 4.135 0 U 2.623e+03 0.00e+00 - 0 24 144 0
# H Q11/HA Q10
311 8.229 1.880 0 U 2.428e+02 0.00e+00 - 0 24 22 0
# H/HB2 Q11
312 8.229 2.172 0 U 3.258e+02 0.00e+00 - 0 24 21 0
# H/HG Q11
313 8.229 4.437 0 U 4.632e+01 0.00e+00 - 0 24 18 0
# H/HA Q11
316 1.669 3.227 0 U 9.398e+01 0.00e+00 - 0 103 102 0
# ?/? 25
318 4.079 4.079 0 U 1.986e+06 0.00e+00 - 0 163 163 0
# HA/HA 41
319 4.079 2.172 0 U 6.926e+02 0.00e+00 - 0 163 162 0
# HA/HB 41
323 1.860 2.137 0 U 2.167e+02 0.00e+00 - 0 155 153 0
# HG2/HB 39
324 3.317 1.780 0 U 2.207e+02 0.00e+00 - 0 147 150 0
# HD2/HB 38
326 3.317 3.683 0 U 4.508e+01 0.00e+00 - 0 147 148 0
# HD2/HA 38
328 3.317 1.555 0 U 6.396e+02 0.00e+00 - 0 147 152 0
# HD2/HG3 38
329 3.317 1.677 0 U 3.015e+02 0.00e+00 - 0 147 151 0
# HD2/HG2 38
331 1.742 1.861 0 U 1.223e+05 0.00e+00 - 0 77 76 0
# HB3/HG P9
333 1.742 2.135 0 U 3.894e+03 0.00e+00 - 0 77 74 0
# HB3/HB2 P9
334 1.742 3.641 0 U 3.076e+02 0.00e+00 - 0 77 79 0
# HB3/HD2 P9
335 1.742 3.467 0 U 1.021e+03 0.00e+00 - 0 77 78 0
# HB3/HD3 P9
336 7.818 2.915 0 U 3.445e+02 0.00e+00 - 0 170 171 0
# H/HB2 Y13
338 7.818 2.836 0 U 3.726e+02 0.00e+00 - 0 170 172 0
# H/HB3 Y13
339 7.818 4.384 0 U 1.320e+02 0.00e+00 - 0 170 169 0
# H/HA Y13
340 4.085 1.810 0 U 1.230e+03 0.00e+00 - 0 13 16 0
# HA/HB2 Q5
341 4.085 2.089 0 U 1.075e+03 0.00e+00 - 0 13 15 0
# HA/HG Q5
342 4.085 8.248 0 U 1.700e+03 0.00e+00 - 0 13 14 0
# HA/H Q5
344 4.085 1.738 0 U 9.920e+02 0.00e+00 - 0 13 17 0
# HA/HB3 Q5
345 2.182 1.810 0 U 3.699e+03 0.00e+00 - 0 5 7 0
# HG/HB3 Q4
346 2.182 1.900 0 U 2.231e+03 0.00e+00 - 0 5 6 0
# HG/HB2 Q4
349 2.182 4.134 0 U 7.335e+02 0.00e+00 - 0 5 3 0
# HG/HA Q4
350 7.112 2.801 0 U 1.238e+03 0.00e+00 - 0 137 59 0
# HD/HB 14
351 7.112 7.954 0 U 4.018e+02 0.00e+00 - 0 137 58 0
# HD/H 14
352 7.112 4.284 0 U 2.174e+02 0.00e+00 - 0 137 57 0
# HD/HA 14
356 2.181 1.756 0 U 8.619e+03 0.00e+00 - 0 129 131 0
# HB/HG3 P8
357 2.181 3.646 0 U 8.511e+01 0.00e+00 - 0 129 91 0
# HB/HD2 P8
358 2.181 1.871 0 U 5.279e+03 0.00e+00 - 0 129 130 0
# HB/HG2 P8
360 2.181 2.181 0 U 2.413e+08 0.00e+00 - 0 129 129 0
# HB/HB P8
361 4.742 2.693 0 U 1.070e+03 0.00e+00 - 0 121 124 0
# HA/HB3 31
362 4.742 3.008 0 U 1.329e+03 0.00e+00 - 0 121 123 0
# HA/HB2 31
367 7.175 4.708 0 U 2.150e+02 0.00e+00 - 0 113 63 0
# HE/HA F7
368 7.175 2.989 0 U 3.108e+02 0.00e+00 - 0 113 62 0
# HE/HB2 F7
369 7.175 7.988 0 U 3.049e+02 0.00e+00 - 0 113 61 0
# HE/H F7
370 7.175 2.705 0 U 2.847e+02 0.00e+00 - 0 113 60 0
# HE/HB3 F7
371 4.392 2.838 0 U 1.871e+03 0.00e+00 - 0 105 108 0
# HA/HB3 26
372 4.392 2.916 0 U 3.063e+03 0.00e+00 - 0 105 107 0
# HA/HB2 26
373 4.392 7.732 0 U 1.739e+02 0.00e+00 - 0 105 106 0
# HA/H 26
375 3.561 2.027 0 U 5.325e+02 0.00e+00 - 0 80 83 0
# HD2/HB P12
376 3.561 1.675 0 U 3.828e+02 0.00e+00 - 0 80 157 0
# HD2/HG3 P12
378 3.561 4.447 0 U 4.770e+01 0.00e+00 - 0 80 25 0
# HD2 P12/HA 6
381 3.561 1.795 0 U 1.533e+03 0.00e+00 - 0 80 84 0
# HD2/HG2 P12
382 1.035 4.125 0 U 6.043e+01 0.00e+00 - 0 72 73 0
# HB/HA 18
386 8.144 1.171 0 U 2.935e+02 0.00e+00 - 0 56 55 0
# H/HB 13
387 8.144 4.116 0 U 7.796e+02 0.00e+00 - 0 56 68 0
# H/HA 13
389 1.811 1.811 0 U 5.478e+06 0.00e+00 - 0 48 48 0
# HB3/HB3 10
390 1.811 1.917 0 U 4.678e+03 0.00e+00 - 0 48 47 0
# HB3/HB2 10
392 1.811 2.288 0 U 7.777e+02 0.00e+00 - 0 48 45 0
# HB3/HB 10
394 3.981 2.166 0 U 1.841e+02 0.00e+00 - 0 39 38 0
# HA/HB2 8
395 3.981 2.015 0 U 1.362e+02 0.00e+00 - 0 39 37 0
# HA/HB3 8
396 3.981 4.408 0 U 5.302e+01 0.00e+00 - 0 39 93 0
# HA 8/HA 23
397 3.981 8.110 0 U 3.078e+02 0.00e+00 - 0 39 35 0
# HA/H 8
398 1.730 8.229 0 U 2.142e+02 0.00e+00 - 0 23 24 0
# HB3/H Q11
399 1.730 1.730 0 U 5.768e+05 0.00e+00 - 0 23 23 0
# HB3/HB3 Q11
401 1.730 2.172 0 U 7.134e+03 0.00e+00 - 0 23 21 0
# HB3/HG Q11
403 3.227 1.777 0 U 6.758e+02 0.00e+00 - 0 102 104 0
# ?/? 25
404 3.227 1.669 0 U 2.020e+02 0.00e+00 - 0 102 103 0
# ?/? 25
406 3.227 1.552 0 U 4.622e+02 0.00e+00 - 0 102 101 0
# ?/? 25
407 8.373 4.166 0 U 1.985e+03 0.00e+00 - 0 4 8 0
# H Q4/HA Q3
408 8.373 1.810 0 U 4.105e+02 0.00e+00 - 0 4 7 0
# H/HB3 Q4
409 8.373 1.900 0 U 3.647e+02 0.00e+00 - 0 4 6 0
# H/HB2 Q4
410 8.373 2.182 0 U 5.367e+02 0.00e+00 - 0 4 5 0
# H/HG Q4
412 8.373 4.134 0 U 7.002e+02 0.00e+00 - 0 4 3 0
# H/HA Q4
413 2.172 4.079 0 U 2.161e+02 0.00e+00 - 0 162 163 0
# HB/HA 41
414 2.172 2.172 0 U 3.026e+06 0.00e+00 - 0 162 162 0
# HB/HB 41
415 4.289 1.742 0 U 3.227e+02 0.00e+00 - 0 154 156 0
# HA/HG3 39
416 4.289 1.860 0 U 4.570e+02 0.00e+00 - 0 154 155 0
# HA/HG2 39
418 4.289 2.137 0 U 1.185e+03 0.00e+00 - 0 154 153 0
# HA/HB 39
419 2.135 4.290 0 U 1.856e+03 0.00e+00 - 0 74 75 0
# HB2/HA P9
420 2.135 1.861 0 U 2.940e+03 0.00e+00 - 0 74 76 0
# HB2/HG P9
421 2.135 1.742 0 U 7.518e+03 0.00e+00 - 0 74 77 0
# HB2/HB3 P9
423 2.135 3.641 0 U 2.845e+02 0.00e+00 - 0 74 79 0
# HB2/HD2 P9
425 1.814 4.166 0 U 2.515e+03 0.00e+00 - 0 12 8 0
# HG3/HA Q3
428 1.814 2.196 0 U 6.165e+03 0.00e+00 - 0 12 10 0
# HG3/HB Q3
429 1.814 8.295 0 U 2.971e+02 0.00e+00 - 0 12 9 0
# HG3/H Q3
430 4.135 2.203 0 U 1.252e+03 0.00e+00 - 0 144 140 0
# HA/HG Q10
431 4.135 1.814 0 U 6.192e+02 0.00e+00 - 0 144 167 0
# HA/HB3 Q10
432 4.135 1.921 0 U 1.531e+03 0.00e+00 - 0 144 166 0
# HA/HB2 Q10
433 4.135 8.229 0 U 2.794e+03 0.00e+00 - 0 144 24 0
# HA Q10/H Q11
434 4.135 4.135 0 U 2.060e+05 0.00e+00 - 0 144 144 0
# HA/HA Q10
435 4.135 8.304 0 U 1.723e+03 0.00e+00 - 0 144 141 0
# HA/H Q10
436 7.233 2.801 0 U 2.068e+02 0.00e+00 - 0 136 59 0
# HE/HB 14
437 7.233 7.954 0 U 2.070e+02 0.00e+00 - 0 136 58 0
# HE/H 14
438 7.233 4.284 0 U 1.720e+02 0.00e+00 - 0 136 57 0
# HE/HA 14
441 7.999 4.125 0 U 3.709e+02 0.00e+00 - 0 120 73 0
# H/HA 18
442 7.999 1.035 0 U 3.403e+01 0.00e+00 - 0 120 72 0
# H/HB 18
446 7.125 4.708 0 U 2.675e+02 0.00e+00 - 0 112 63 0
# HD/HA F7
447 7.125 2.989 0 U 9.160e+02 0.00e+00 - 0 112 62 0
# HD/HB2 F7
448 7.125 7.988 0 U 7.548e+02 0.00e+00 - 0 112 61 0
# HD/H F7
449 7.125 2.705 0 U 7.790e+02 0.00e+00 - 0 112 60 0
# HD/HB3 F7
453 3.641 4.290 0 U 5.801e+01 0.00e+00 - 0 79 75 0
# HD2/HA P9
454 3.641 1.861 0 U 1.814e+03 0.00e+00 - 0 79 76 0
# HD2/HG P9
455 3.641 1.742 0 U 4.578e+02 0.00e+00 - 0 79 77 0
# HD2/HB3 P9
456 3.641 2.135 0 U 3.814e+02 0.00e+00 - 0 79 74 0
# HD2/HB2 P9
458 3.641 3.467 0 U 5.780e+03 0.00e+00 - 0 79 78 0
# HD2/HD3 P9
460 1.566 3.901 0 U 2.849e+03 0.00e+00 - 0 71 70 0
# HG/HA L1
461 1.566 0.784 0 U 8.377e+03 0.00e+00 - 0 71 69 0
# HG/HD L1
462 4.708 3.455 0 U 5.136e+02 0.00e+00 - 0 63 92 0
# HA F7/HD3 P8
463 4.708 3.646 0 U 1.646e+03 0.00e+00 - 0 63 91 0
# HA F7/HD2 P8
464 4.708 7.175 0 U 1.054e+03 0.00e+00 - 0 63 113 0
# HA/HE F7
465 4.708 7.125 0 U 2.121e+03 0.00e+00 - 0 63 112 0
# HA/HD F7
466 4.708 4.708 0 U 2.928e+04 0.00e+00 - 0 63 63 0
# HA/HA F7
467 4.708 2.989 0 U 7.722e+02 0.00e+00 - 0 63 62 0
# HA/HB2 F7
468 4.708 7.988 0 U 1.304e+03 0.00e+00 - 0 63 61 0
# HA/H F7
470 1.171 8.144 0 U 2.796e+01 0.00e+00 - 0 55 56 0
# HB/H 13
472 1.171 4.116 0 U 9.650e+02 0.00e+00 - 0 55 68 0
# HB/HA 13
473 1.917 4.161 0 U 7.148e+02 0.00e+00 - 0 47 49 0
# HB2/HA 10
477 1.917 2.288 0 U 5.548e+02 0.00e+00 - 0 47 45 0
# HB2/HB 10
483 8.157 4.512 0 U 6.056e+01 0.00e+00 - 0 30 29 0
# H/HA 7
484 8.157 2.290 0 U 1.227e+02 0.00e+00 - 0 30 31 0
# H/? 7
485 8.157 1.669 0 U 1.126e+02 0.00e+00 - 0 30 33 0
# H/? 7
486 8.157 1.845 0 U 1.480e+02 0.00e+00 - 0 30 32 0
# H/? 7
494 1.552 3.227 0 U 3.134e+02 0.00e+00 - 0 101 102 0
# ?/? 25
496 1.736 2.090 0 U 1.931e+03 0.00e+00 - 0 161 158 0
# HG3/HB 40
499 1.736 4.098 0 U 1.040e+03 0.00e+00 - 0 161 159 0
# HG3/HA 40
501 2.137 1.860 0 U 2.074e+02 0.00e+00 - 0 153 155 0
# HB/HG2 39
502 2.137 4.289 0 U 1.856e+03 0.00e+00 - 0 153 154 0
# HB/HA 39
503 2.137 2.137 0 U 8.594e+04 0.00e+00 - 0 153 153 0
# HB/HB 39
504 2.293 2.293 0 U 7.941e+06 0.00e+00 - 0 138 138 0
# ?/? 35
506 1.921 4.166 0 U 1.240e+03 0.00e+00 - 0 11 8 0
# HG2/HA Q3
508 1.921 1.921 0 U 4.624e+04 0.00e+00 - 0 11 11 0
# HG2/HG2 Q3
510 1.921 8.295 0 U 1.263e+02 0.00e+00 - 0 11 9 0
# HG2/H Q3
511 4.134 1.810 0 U 1.828e+03 0.00e+00 - 0 3 7 0
# HA/HB3 Q4
512 4.134 8.248 0 U 2.181e+03 0.00e+00 - 0 3 14 0
# HA Q4/H Q5
513 4.134 1.900 0 U 2.596e+03 0.00e+00 - 0 3 6 0
# HA/HB2 Q4
514 4.134 2.182 0 U 2.237e+03 0.00e+00 - 0 3 5 0
# HA/HG Q4
515 4.134 8.373 0 U 1.500e+03 0.00e+00 - 0 3 4 0
# HA/H Q4
517 8.117 8.117 0 U 1.181e+04 0.00e+00 - 0 119 119 0
# H/H 30
518 8.117 4.239 0 U 3.852e+02 0.00e+00 - 0 119 118 0
# H/HA 30
519 3.000 3.000 0 U 1.180e+05 0.00e+00 - 0 111 111 0
# HB2/HB2 27
520 3.000 8.049 0 U 1.800e+01 0.00e+00 - 0 111 110 0
# HB2/H 27
522 4.197 3.293 0 U 5.134e+02 0.00e+00 - 0 87 88 0
# HA/HD3 21
524 4.197 3.382 0 U 5.828e+02 0.00e+00 - 0 87 86 0
# HA/HD2 21
526 3.467 1.861 0 U 3.336e+03 0.00e+00 - 0 78 76 0
# HD3/HG P9
527 3.467 1.742 0 U 1.238e+03 0.00e+00 - 0 78 77 0
# HD3/HB3 P9
528 3.467 2.135 0 U 1.305e+02 0.00e+00 - 0 78 74 0
# HD3/HB2 P9
530 3.467 3.467 0 U 2.136e+05 0.00e+00 - 0 78 78 0
# HD3/HD3 P9
531 3.901 8.589 0 U 2.104e+03 0.00e+00 - 0 70 2 0
# HA L1/H G2
532 3.901 1.566 0 U 2.720e+03 0.00e+00 - 0 70 71 0
# HA/HG L1
534 3.901 0.784 0 U 3.070e+03 0.00e+00 - 0 70 69 0
# HA/HD L1
535 2.989 3.455 0 U 4.765e+02 0.00e+00 - 0 62 92 0
# HB2 F7/HD3 P8
536 2.989 7.175 0 U 5.144e+02 0.00e+00 - 0 62 113 0
# HB2/HE F7
537 2.989 7.125 0 U 1.518e+03 0.00e+00 - 0 62 112 0
# HB2/HD F7
540 2.989 7.988 0 U 5.507e+01 0.00e+00 - 0 62 61 0
# HB2/H F7
541 2.989 2.705 0 U 4.323e+03 0.00e+00 - 0 62 60 0
# HB2/HB3 F7
544 1.097 4.078 0 U 3.221e+03 0.00e+00 - 0 54 52 0
# HB/HA A6
545 8.332 4.161 0 U 4.062e+02 0.00e+00 - 0 46 49 0
# H/HA 10
546 8.332 1.811 0 U 1.694e+01 0.00e+00 - 0 46 48 0
# H/HB3 10
547 8.332 1.917 0 U 5.998e+01 0.00e+00 - 0 46 47 0
# H/HB2 10
549 8.332 2.288 0 U 7.315e+01 0.00e+00 - 0 46 45 0
# H/HB 10
550 2.015 3.981 0 U 9.422e+01 0.00e+00 - 0 37 39 0
# HB3/HA 8
554 4.512 8.157 0 U 1.430e+02 0.00e+00 - 0 29 30 0
# HA/H 7
556 4.512 2.290 0 U 2.620e+02 0.00e+00 - 0 29 31 0
# HA/? 7
557 4.512 1.669 0 U 2.358e+02 0.00e+00 - 0 29 33 0
# HA/? 7
558 4.512 1.845 0 U 3.589e+02 0.00e+00 - 0 29 32 0
# HA/? 7
559 2.172 8.229 0 U 7.705e+01 0.00e+00 - 0 21 24 0
# HG/H Q11
560 2.172 1.730 0 U 2.656e+03 0.00e+00 - 0 21 23 0
# HG/HB3 Q11
561 2.172 1.880 0 U 4.312e+02 0.00e+00 - 0 21 22 0
# HG/HB2 Q11
562 2.172 2.172 0 U 3.026e+06 0.00e+00 - 0 21 21 0
# HG/HG Q11
564 1.554 1.771 0 U 9.597e+02 0.00e+00 - 0 100 98 0
# ?/? 24
565 1.554 3.679 0 U 3.863e+01 0.00e+00 - 0 100 97 0
# ?/? 24
567 1.554 1.554 0 U 6.827e+05 0.00e+00 - 0 100 100 0
# ?/? 24
568 1.554 1.676 0 U 2.963e+04 0.00e+00 - 0 100 99 0
# ?/? 24
572 1.814 4.098 0 U 7.955e+02 0.00e+00 - 0 160 159 0
# HG2/HA 40
573 1.555 1.780 0 U 5.351e+03 0.00e+00 - 0 152 150 0
# HG3/HB 38
574 1.555 3.229 0 U 3.134e+02 0.00e+00 - 0 152 149 0
# HG3/HD3 38
575 1.555 3.683 0 U 3.863e+01 0.00e+00 - 0 152 148 0
# HG3/HA 38
576 1.555 3.317 0 U 8.065e+02 0.00e+00 - 0 152 147 0
# HG3/HD2 38
584 2.290 1.669 0 U 1.143e+02 0.00e+00 - 0 31 33 0
# ?/? 7
585 2.290 1.845 0 U 1.013e+03 0.00e+00 - 0 31 32 0
# ?/? 7
586 2.196 4.166 0 U 1.910e+03 0.00e+00 - 0 10 8 0
# HB/HA Q3
589 2.196 1.921 0 U 4.118e+03 0.00e+00 - 0 10 11 0
# HB/HG2 Q3
590 2.196 2.196 0 U 9.021e+05 0.00e+00 - 0 10 10 0
# HB/HB Q3
592 8.083 2.028 0 U 4.385e+01 0.00e+00 - 0 126 127 0
# H/? 32
593 8.083 2.301 0 U 9.242e+01 0.00e+00 - 0 126 128 0
# H/? 32
594 8.083 1.653 0 U 8.348e+01 0.00e+00 - 0 126 125 0
# H/? 32
596 4.239 8.117 0 U 2.913e+02 0.00e+00 - 0 118 119 0
# HA/H 30
598 8.049 3.000 0 U 6.129e+01 0.00e+00 - 0 110 111 0
# H/HB2 27
600 8.049 2.885 0 U 3.649e+01 0.00e+00 - 0 110 109 0
# H/HB3 27
601 3.382 3.293 0 U 2.018e+03 0.00e+00 - 0 86 88 0
# HD2/HD3 21
602 3.382 4.197 0 U 3.596e+01 0.00e+00 - 0 86 87 0
# HD2/HA 21
604 0.784 1.566 0 U 1.468e+03 0.00e+00 - 0 69 71 0
# HD/HG L1
605 0.784 3.901 0 U 3.141e+03 0.00e+00 - 0 69 70 0
# HD/HA L1
607 7.988 7.175 0 U 5.245e+02 0.00e+00 - 0 61 113 0
# H/HE F7
608 7.988 7.125 0 U 1.197e+03 0.00e+00 - 0 61 112 0
# H/HD F7
609 7.988 4.708 0 U 1.329e+02 0.00e+00 - 0 61 63 0
# H/HA F7
610 7.988 2.989 0 U 7.797e+01 0.00e+00 - 0 61 62 0
# H/HB2 F7
612 7.988 2.705 0 U 3.755e+02 0.00e+00 - 0 61 60 0
# H/HB3 F7
613 7.988 4.078 0 U 2.890e+03 0.00e+00 - 0 61 52 0
# H F7/HA A6
614 8.096 1.097 0 U 6.774e+02 0.00e+00 - 0 53 54 0
# H/HB A6
616 8.096 4.078 0 U 1.840e+03 0.00e+00 - 0 53 52 0
# H/HA A6
617 2.288 4.161 0 U 1.641e+02 0.00e+00 - 0 45 49 0
# HB/HA 10
619 2.288 1.917 0 U 6.525e+02 0.00e+00 - 0 45 47 0
# HB/HB2 10
621 2.288 2.288 0 U 8.918e+06 0.00e+00 - 0 45 45 0
# HB/HB 10
629 4.437 8.229 0 U 7.487e+02 0.00e+00 - 0 18 24 0
# HA/H Q11
630 4.437 1.730 0 U 7.104e+02 0.00e+00 - 0 18 23 0
# HA/HB3 Q11
631 4.437 1.880 0 U 9.083e+02 0.00e+00 - 0 18 22 0
# HA/HB2 Q11
632 4.437 2.172 0 U 8.135e+02 0.00e+00 - 0 18 21 0
# HA/HG Q11
635 2.836 7.818 0 U 5.786e+02 0.00e+00 - 0 172 170 0
# HB3/H Y13
639 1.676 3.679 0 U 1.424e+02 0.00e+00 - 0 99 97 0
# ?/? 24
640 1.676 1.862 0 U 8.652e+02 0.00e+00 - 0 99 96 0
# ?/? 24
641 1.676 1.554 0 U 1.605e+04 0.00e+00 - 0 99 100 0
# ?/? 24
642 1.676 1.676 0 U 1.255e+06 0.00e+00 - 0 99 99 0
# ?/? 24
645 1.669 2.290 0 U 2.242e+02 0.00e+00 - 0 33 31 0
# ?/? 7
648 4.098 2.090 0 U 1.075e+03 0.00e+00 - 0 159 158 0
# HA/HB 40
649 4.098 1.736 0 U 9.920e+02 0.00e+00 - 0 159 161 0
# HA/HG3 40
650 4.098 1.814 0 U 2.320e+02 0.00e+00 - 0 159 160 0
# HA/HG2 40
653 1.677 3.229 0 U 9.398e+01 0.00e+00 - 0 151 149 0
# HG2/HD3 38
654 1.677 3.683 0 U 1.424e+02 0.00e+00 - 0 151 148 0
# HG2/HA 38
655 1.677 3.317 0 U 1.757e+02 0.00e+00 - 0 151 147 0
# HG2/HD2 38
661 1.845 1.669 0 U 1.346e+02 0.00e+00 - 0 32 33 0
# ?/? 7
662 1.845 1.845 0 U 3.653e+06 0.00e+00 - 0 32 32 0
# ?/? 7
664 4.384 7.818 0 U 3.080e+02 0.00e+00 - 0 169 170 0
# HA/H Y13
668 1.738 2.089 0 U 1.960e+03 0.00e+00 - 0 17 15 0
# HB3/HG Q5
669 1.738 8.248 0 U 5.535e+01 0.00e+00 - 0 17 14 0
# HB3/H Q5
670 1.738 4.085 0 U 5.563e+02 0.00e+00 - 0 17 13 0
# HB3/HA Q5
671 1.738 1.738 0 U 5.679e+06 0.00e+00 - 0 17 17 0
# HB3/HB3 Q5
672 8.295 4.166 0 U 1.111e+03 0.00e+00 - 0 9 8 0
# H/HA Q3
673 8.295 8.589 0 U 1.202e+02 0.00e+00 - 0 9 2 0
# H Q3/H G2
674 8.295 3.847 0 U 4.777e+03 0.00e+00 - 0 9 1 0
# H Q3/HA G2
675 8.295 1.814 0 U 2.796e+02 0.00e+00 - 0 9 12 0
# H/HG3 Q3
676 8.295 1.921 0 U 2.933e+02 0.00e+00 - 0 9 11 0
# H/HG2 Q3
677 8.295 2.196 0 U 4.135e+02 0.00e+00 - 0 9 10 0
# H/HB Q3
678 8.295 8.295 0 U 2.103e+04 0.00e+00 - 0 9 9 0
# H/H Q3
679 8.304 2.203 0 U 4.135e+02 0.00e+00 - 0 141 140 0
# H/HG Q10
680 8.304 4.290 0 U 1.154e+03 0.00e+00 - 0 141 75 0
# H Q10/HA P9
681 8.304 1.814 0 U 3.296e+02 0.00e+00 - 0 141 167 0
# H/HB3 Q10
682 8.304 1.921 0 U 2.016e+02 0.00e+00 - 0 141 166 0
# H/HB2 Q10
683 8.304 4.135 0 U 6.915e+02 0.00e+00 - 0 141 144 0
# H/HA Q10
685 6.990 2.837 0 U 1.566e+03 0.00e+00 - 0 133 67 0
# HD/HB3 16
686 6.990 2.923 0 U 1.837e+03 0.00e+00 - 0 133 66 0
# HD/HB2 16
688 8.048 8.048 0 U 1.778e+05 0.00e+00 - 0 117 117 0
# H/H 29
691 2.885 2.885 0 U 1.874e+03 0.00e+00 - 0 109 109 0
# HB3/HB3 27
692 4.408 3.325 0 U 1.728e+02 0.00e+00 - 0 93 94 0
# HA/? 23
693 4.408 3.260 0 U 1.709e+02 0.00e+00 - 0 93 95 0
# HA/? 23
694 4.408 3.981 0 U 1.283e+03 0.00e+00 - 0 93 39 0
# HA 23/HA 8
698 1.795 3.468 0 U 1.831e+03 0.00e+00 - 0 84 82 0
# HG2/HD3 P12
699 1.795 4.218 0 U 8.329e+02 0.00e+00 - 0 84 81 0
# HG2/HA P12
700 1.795 3.561 0 U 1.310e+03 0.00e+00 - 0 84 80 0
# HG2/HD2 P12
701 1.795 1.795 0 U 2.333e+04 0.00e+00 - 0 84 84 0
# HG2/HG2 P12
702 4.116 7.954 0 U 1.057e+03 0.00e+00 - 0 68 58 0
# HA 13/H 14
703 4.116 8.144 0 U 4.430e+02 0.00e+00 - 0 68 56 0
# HA/H 13
704 4.116 1.171 0 U 2.881e+03 0.00e+00 - 0 68 55 0
# HA/HB 13
706 2.705 7.175 0 U 7.342e+02 0.00e+00 - 0 60 113 0
# HB3/HE F7
707 2.705 7.125 0 U 1.987e+03 0.00e+00 - 0 60 112 0
# HB3/HD F7
709 2.705 2.989 0 U 8.473e+03 0.00e+00 - 0 60 62 0
# HB3/HB2 F7
710 2.705 7.988 0 U 7.017e+02 0.00e+00 - 0 60 61 0
# HB3/H F7
712 4.078 1.097 0 U 7.541e+03 0.00e+00 - 0 52 54 0
# HA/HB A6
713 4.078 7.988 0 U 2.700e+03 0.00e+00 - 0 52 61 0
# HA A6/H F7
714 4.078 8.096 0 U 2.489e+03 0.00e+00 - 0 52 53 0
# HA/H A6
720 8.110 4.290 0 U 2.135e+02 0.00e+00 - 0 35 75 0
# H 8/HA P9
721 8.110 3.981 0 U 2.942e+02 0.00e+00 - 0 35 39 0
# H/HA 8
722 8.110 2.166 0 U 2.238e+02 0.00e+00 - 0 35 38 0
# H/HB2 8
723 8.110 2.015 0 U 1.733e+02 0.00e+00 - 0 35 37 0
# H/HB3 8
;
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 . folded 6000 Hz . . . 4.76 . . 34342 1
stop_
save_