Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12403 | 1sxe RC | 5399 | cing | 1-original | 3 | XPLOR/CNS | peak |
! 3Dim peaks from experiment 15n13cerg_noesyaro.mat
! peaks entity xpk:aronoesy
! rough distances bound limits as distance = (&mycal/(volume^(1/6))
!# peak 229-----------------------------------------------
assi (attr store1 < 7.201 and attr store1 > 7.081)
((attr store1 < 7.740 and attr store1 > 7.680)
and bondedto (attr store1 < 137.930 and attr store1 > 137.330))
6 6 0 peak 229 volume 26398208 hpm1 137.630 ppm1 7.710 ppm2 7.141
!# peak 236-----------------------------------------------
assi (attr store1 < 6.612 and attr store1 > 6.492)
((attr store1 < 7.762 and attr store1 > 7.702)
and bondedto (attr store1 < 137.984 and attr store1 > 137.384))
6 6 0 peak 236 volume 11977750 hpm1 137.684 ppm1 7.732 ppm2 6.552
!# peak 251-----------------------------------------------
assi (attr store1 < 4.790 and attr store1 > 4.670)
((attr store1 < 7.960 and attr store1 > 7.900)
and bondedto (attr store1 < 138.159 and attr store1 > 137.559))
6 6 0 peak 251 volume 21574490 hpm1 137.859 ppm1 7.930 ppm2 4.730
!# peak 253-----------------------------------------------
assi (attr store1 < 4.790 and attr store1 > 4.670)
((attr store1 < 7.740 and attr store1 > 7.680)
and bondedto (attr store1 < 137.983 and attr store1 > 137.383))
6 6 0 peak 253 volume 24885620 hpm1 137.683 ppm1 7.710 ppm2 4.730
!# peak 668-----------------------------------------------
assi (attr store1 < 6.889 and attr store1 > 6.769)
((attr store1 < 7.123 and attr store1 > 7.063)
and bondedto (attr store1 < 133.794 and attr store1 > 133.194))
6 6 0 peak 668 volume 1706944000 hpm1 133.494 ppm1 7.093 ppm2 6.829
!# peak 699-----------------------------------------------
assi (attr store1 < 4.788 and attr store1 > 4.668)
((attr store1 < 7.126 and attr store1 > 7.066)
and bondedto (attr store1 < 133.845 and attr store1 > 133.245))
6 6 0 peak 699 volume 57126152 hpm1 133.545 ppm1 7.096 ppm2 4.728
!# peak 721-----------------------------------------------
assi (attr store1 < 8.103 and attr store1 > 7.983)
((attr store1 < 7.105 and attr store1 > 7.045)
and bondedto (attr store1 < 133.466 and attr store1 > 132.866))
6 6 0 peak 721 volume 126083600 hpm1 133.166 ppm1 7.075 ppm2 8.043
!# peak 724-----------------------------------------------
assi (attr store1 < 7.846 and attr store1 > 7.726)
((attr store1 < 7.104 and attr store1 > 7.044)
and bondedto (attr store1 < 133.482 and attr store1 > 132.882))
6 6 0 peak 724 volume 105322200 hpm1 133.182 ppm1 7.074 ppm2 7.786
!# peak 765-----------------------------------------------
assi (attr store1 < 7.981 and attr store1 > 7.861)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.966 and attr store1 > 132.366))
6 6 0 peak 765 volume 158835600 hpm1 132.666 ppm1 7.138 ppm2 7.921
!# peak 770-----------------------------------------------
assi (attr store1 < 7.709 and attr store1 > 7.589)
((attr store1 < 7.169 and attr store1 > 7.109)
and bondedto (attr store1 < 132.959 and attr store1 > 132.359))
6 6 0 peak 770 volume 25532020 hpm1 132.659 ppm1 7.139 ppm2 7.649
!# peak 812-----------------------------------------------
assi (attr store1 < 7.885 and attr store1 > 7.765)
((attr store1 < 6.875 and attr store1 > 6.815)
and bondedto (attr store1 < 132.611 and attr store1 > 132.011))
6 6 0 peak 812 volume 54450500 hpm1 132.311 ppm1 6.845 ppm2 7.825
!# peak 830-----------------------------------------------
assi (attr store1 < 6.571 and attr store1 > 6.451)
((attr store1 < 6.874 and attr store1 > 6.814)
and bondedto (attr store1 < 132.595 and attr store1 > 131.995))
6 6 0 peak 830 volume 403788672 hpm1 132.295 ppm1 6.844 ppm2 6.511
!# peak 974-----------------------------------------------
assi (attr store1 < 8.507 and attr store1 > 8.387)
((attr store1 < 7.344 and attr store1 > 7.284)
and bondedto (attr store1 < 131.350 and attr store1 > 130.750))
6 6 0 peak 974 volume 17172470 hpm1 131.050 ppm1 7.314 ppm2 8.447
!# peak 984-----------------------------------------------
assi (attr store1 < 7.430 and attr store1 > 7.310)
((attr store1 < 6.987 and attr store1 > 6.927)
and bondedto (attr store1 < 131.207 and attr store1 > 130.607))
6 6 0 peak 984 volume 327024704 hpm1 130.907 ppm1 6.957 ppm2 7.370
!# peak 993-----------------------------------------------
assi (attr store1 < 7.017 and attr store1 > 6.897)
((attr store1 < 7.350 and attr store1 > 7.290)
and bondedto (attr store1 < 131.304 and attr store1 > 130.704))
6 6 0 peak 993 volume 27767300 hpm1 131.004 ppm1 7.320 ppm2 6.957
!# peak 1026-----------------------------------------------
assi (attr store1 < 7.977 and attr store1 > 7.857)
((attr store1 < 6.993 and attr store1 > 6.933)
and bondedto (attr store1 < 130.795 and attr store1 > 130.195))
6 6 0 peak 1026 volume 11473840 hpm1 130.495 ppm1 6.963 ppm2 7.917
!# peak 1237-----------------------------------------------
assi (attr store1 < 7.426 and attr store1 > 7.306)
((attr store1 < 6.918 and attr store1 > 6.858)
and bondedto (attr store1 < 129.200 and attr store1 > 128.600))
6 6 0 peak 1237 volume 164933808 hpm1 128.900 ppm1 6.888 ppm2 7.366
!# peak 1404-----------------------------------------------
assi (attr store1 < 9.933 and attr store1 > 9.813)
((attr store1 < 7.196 and attr store1 > 7.136)
and bondedto (attr store1 < 127.301 and attr store1 > 126.701))
6 6 0 peak 1404 volume 136182496 hpm1 127.001 ppm1 7.166 ppm2 9.873
!# peak 1464-----------------------------------------------
assi (attr store1 < 7.878 and attr store1 > 7.758)
((attr store1 < 7.195 and attr store1 > 7.135)
and bondedto (attr store1 < 127.051 and attr store1 > 126.451))
6 6 0 peak 1464 volume 41443352 hpm1 126.751 ppm1 7.165 ppm2 7.818
!# peak 1467-----------------------------------------------
assi (attr store1 < 7.797 and attr store1 > 7.677)
((attr store1 < 7.144 and attr store1 > 7.084)
and bondedto (attr store1 < 126.979 and attr store1 > 126.379))
6 6 0 peak 1467 volume 32208300 hpm1 126.679 ppm1 7.114 ppm2 7.737
!# peak 1502-----------------------------------------------
assi (attr store1 < 5.834 and attr store1 > 5.714)
((attr store1 < 7.144 and attr store1 > 7.084)
and bondedto (attr store1 < 126.950 and attr store1 > 126.350))
6 6 0 peak 1502 volume 18464550 hpm1 126.650 ppm1 7.114 ppm2 5.774
!# peak 1622-----------------------------------------------
assi (attr store1 < 7.106 and attr store1 > 6.986)
((attr store1 < 5.765 and attr store1 > 5.705)
and bondedto (attr store1 < 125.669 and attr store1 > 125.069))
6 6 0 peak 1622 volume 175882096 hpm1 125.369 ppm1 5.735 ppm2 7.046
!# peak 1629-----------------------------------------------
assi (attr store1 < 6.148 and attr store1 > 6.028)
((attr store1 < 5.782 and attr store1 > 5.722)
and bondedto (attr store1 < 125.662 and attr store1 > 125.062))
6 6 0 peak 1629 volume 227029104 hpm1 125.362 ppm1 5.752 ppm2 6.088
!# peak 1665-----------------------------------------------
assi (attr store1 < 7.165 and attr store1 > 7.045)
((attr store1 < 6.097 and attr store1 > 6.037)
and bondedto (attr store1 < 125.402 and attr store1 > 124.802))
6 6 0 peak 1665 volume 16502060 hpm1 125.102 ppm1 6.067 ppm2 7.105
!# peak 1695-----------------------------------------------
assi (attr store1 < 7.334 and attr store1 > 7.214)
((attr store1 < 7.056 and attr store1 > 6.996)
and bondedto (attr store1 < 124.753 and attr store1 > 124.153))
6 6 0 peak 1695 volume 854449600 hpm1 124.453 ppm1 7.026 ppm2 7.274
!# peak 1709-----------------------------------------------
assi (attr store1 < 6.651 and attr store1 > 6.531)
((attr store1 < 7.058 and attr store1 > 6.998)
and bondedto (attr store1 < 124.760 and attr store1 > 124.160))
6 6 0 peak 1709 volume 173677696 hpm1 124.460 ppm1 7.028 ppm2 6.591
!# peak 1728-----------------------------------------------
assi (attr store1 < 4.785 and attr store1 > 4.665)
((attr store1 < 7.058 and attr store1 > 6.998)
and bondedto (attr store1 < 124.722 and attr store1 > 124.122))
6 6 0 peak 1728 volume 10691430 hpm1 124.422 ppm1 7.028 ppm2 4.725
!# peak 1817-----------------------------------------------
assi (attr store1 < 9.653 and attr store1 > 9.533)
((attr store1 < 6.306 and attr store1 > 6.246)
and bondedto (attr store1 < 123.535 and attr store1 > 122.935))
6 6 0 peak 1817 volume 10536780 hpm1 123.235 ppm1 6.276 ppm2 9.593
!# peak 1824-----------------------------------------------
assi (attr store1 < 8.569 and attr store1 > 8.449)
((attr store1 < 7.141 and attr store1 > 7.081)
and bondedto (attr store1 < 123.599 and attr store1 > 122.999))
6 6 0 peak 1824 volume 10548810 hpm1 123.299 ppm1 7.111 ppm2 8.509
!# peak 1830-----------------------------------------------
assi (attr store1 < 7.844 and attr store1 > 7.724)
((attr store1 < 7.128 and attr store1 > 7.068)
and bondedto (attr store1 < 123.632 and attr store1 > 123.032))
6 6 0 peak 1830 volume 182543200 hpm1 123.332 ppm1 7.098 ppm2 7.784
!# peak 1923-----------------------------------------------
assi (attr store1 < 6.143 and attr store1 > 6.023)
((attr store1 < 7.164 and attr store1 > 7.104)
and bondedto (attr store1 < 122.736 and attr store1 > 122.136))
6 6 0 peak 1923 volume 2322630 hpm1 122.436 ppm1 7.134 ppm2 6.083
!# peak 1935-----------------------------------------------
assi (attr store1 < 10.297 and attr store1 > 10.177)
((attr store1 < 6.370 and attr store1 > 6.310)
and bondedto (attr store1 < 122.342 and attr store1 > 121.742))
6 6 0 peak 1935 volume 104488400 hpm1 122.042 ppm1 6.340 ppm2 10.237
!# peak 1962-----------------------------------------------
assi (attr store1 < 7.881 and attr store1 > 7.761)
((attr store1 < 6.986 and attr store1 > 6.926)
and bondedto (attr store1 < 122.185 and attr store1 > 121.585))
6 6 0 peak 1962 volume 116101896 hpm1 121.885 ppm1 6.956 ppm2 7.821
!# peak 1966-----------------------------------------------
assi (attr store1 < 7.567 and attr store1 > 7.447)
((attr store1 < 6.369 and attr store1 > 6.309)
and bondedto (attr store1 < 122.339 and attr store1 > 121.739))
6 6 0 peak 1966 volume 63020880 hpm1 122.039 ppm1 6.339 ppm2 7.507
!# peak 1980-----------------------------------------------
assi (attr store1 < 7.068 and attr store1 > 6.948)
((attr store1 < 7.827 and attr store1 > 7.767)
and bondedto (attr store1 < 122.226 and attr store1 > 121.626))
6 6 0 peak 1980 volume 8002758 hpm1 121.926 ppm1 7.797 ppm2 7.008
!# peak 1982-----------------------------------------------
assi (attr store1 < 6.651 and attr store1 > 6.531)
((attr store1 < 7.284 and attr store1 > 7.224)
and bondedto (attr store1 < 122.256 and attr store1 > 121.656))
6 6 0 peak 1982 volume 45236160 hpm1 121.956 ppm1 7.254 ppm2 6.591
!# peak 1993-----------------------------------------------
assi (attr store1 < 5.645 and attr store1 > 5.525)
((attr store1 < 6.370 and attr store1 > 6.310)
and bondedto (attr store1 < 122.338 and attr store1 > 121.738))
6 6 0 peak 1993 volume 101514600 hpm1 122.038 ppm1 6.340 ppm2 5.585
!# peak 1999-----------------------------------------------
assi (attr store1 < 4.785 and attr store1 > 4.665)
((attr store1 < 6.352 and attr store1 > 6.292)
and bondedto (attr store1 < 122.281 and attr store1 > 121.681))
6 6 0 peak 1999 volume 11834330 hpm1 121.981 ppm1 6.322 ppm2 4.725
!# peak 2020-----------------------------------------------
assi (attr store1 < 7.879 and attr store1 > 7.759)
((attr store1 < 6.082 and attr store1 > 6.022)
and bondedto (attr store1 < 121.991 and attr store1 > 121.391))
6 6 0 peak 2020 volume 39085428 hpm1 121.691 ppm1 6.052 ppm2 7.819
!# peak 2021-----------------------------------------------
assi (attr store1 < 7.745 and attr store1 > 7.625)
((attr store1 < 7.183 and attr store1 > 7.123)
and bondedto (attr store1 < 121.829 and attr store1 > 121.229))
6 6 0 peak 2021 volume 12776390 hpm1 121.529 ppm1 7.153 ppm2 7.685
!# peak 2053-----------------------------------------------
assi (attr store1 < 5.837 and attr store1 > 5.717)
((attr store1 < 6.083 and attr store1 > 6.023)
and bondedto (attr store1 < 121.986 and attr store1 > 121.386))
6 6 0 peak 2053 volume 185240112 hpm1 121.686 ppm1 6.053 ppm2 5.777
!# peak 2092-----------------------------------------------
assi (attr store1 < 7.113 and attr store1 > 6.993)
((attr store1 < 6.602 and attr store1 > 6.542)
and bondedto (attr store1 < 121.485 and attr store1 > 120.885))
6 6 0 peak 2092 volume 201707904 hpm1 121.185 ppm1 6.572 ppm2 7.053
!# peak 2145-----------------------------------------------
assi (attr store1 < 7.337 and attr store1 > 7.217)
((attr store1 < 6.602 and attr store1 > 6.542)
and bondedto (attr store1 < 121.468 and attr store1 > 120.968))
6 6 0 peak 2145 volume 218556496 hpm1 120.868 ppm1 6.572 ppm2 7.277
!# peak 2149-----------------------------------------------
assi (attr store1 < 7.159 and attr store1 > 7.039)
((attr store1 < 7.829 and attr store1 > 7.769)
and bondedto (attr store1 < 121.052 and attr store1 > 120.452))
6 6 0 peak 2149 volume 149755408 hpm1 120.752 ppm1 7.799 ppm2 7.099
!# peak 2153-----------------------------------------------
assi (attr store1 < 6.652 and attr store1 > 6.532)
((attr store1 < 7.284 and attr store1 > 7.224)
and bondedto (attr store1 < 121.064 and attr store1 > 120.420))
6 6 0 peak 2153 volume 148739296 hpm1 120.764 ppm1 7.254 ppm2 6.592
!# peak 2180-----------------------------------------------
assi (attr store1 < 9.146 and attr store1 > 9.026)
((attr store1 < 7.285 and attr store1 > 7.225)
and bondedto (attr store1 < 120.673 and attr store1 > 120.073))
6 6 0 peak 2180 volume 36392332 hpm1 120.373 ppm1 7.255 ppm2 9.086
!# peak 2182-----------------------------------------------
assi (attr store1 < 8.740 and attr store1 > 8.620)
((attr store1 < 7.827 and attr store1 > 7.767)
and bondedto (attr store1 < 120.652 and attr store1 > 120.052))
6 6 0 peak 2182 volume 57221560 hpm1 120.352 ppm1 7.797 ppm2 8.680
!# peak 2205-----------------------------------------------
assi (attr store1 < 6.150 and attr store1 > 6.030)
((attr store1 < 7.828 and attr store1 > 7.768)
and bondedto (attr store1 < 120.633 and attr store1 > 120.033))
6 6 0 peak 2205 volume 40069400 hpm1 120.333 ppm1 7.798 ppm2 6.090
!# peak 2250-----------------------------------------------
assi (attr store1 < 7.882 and attr store1 > 7.762)
((attr store1 < 6.981 and attr store1 > 6.921)
and bondedto (attr store1 < 120.170 and attr store1 > 119.570))
6 6 0 peak 2250 volume 66684592 hpm1 119.870 ppm1 6.951 ppm2 7.822
!# peak 2264-----------------------------------------------
assi (attr store1 < 7.111 and attr store1 > 6.991)
((attr store1 < 7.260 and attr store1 > 7.200)
and bondedto (attr store1 < 120.244 and attr store1 > 119.644))
6 6 0 peak 2264 volume 892887616 hpm1 119.944 ppm1 7.230 ppm2 7.051
!# peak 2324-----------------------------------------------
assi (attr store1 < 8.750 and attr store1 > 8.630)
((attr store1 < 7.165 and attr store1 > 7.105)
and bondedto (attr store1 < 119.801 and attr store1 > 119.201))
6 6 0 peak 2324 volume 23497120 hpm1 119.501 ppm1 7.135 ppm2 8.690
!# peak 2329-----------------------------------------------
assi (attr store1 < 8.331 and attr store1 > 8.211)
((attr store1 < 6.924 and attr store1 > 6.864)
and bondedto (attr store1 < 119.639 and attr store1 > 119.039))
6 6 0 peak 2329 volume 16855730 hpm1 119.339 ppm1 6.894 ppm2 8.271
!# peak 2333-----------------------------------------------
assi (attr store1 < 8.112 and attr store1 > 7.992)
((attr store1 < 7.151 and attr store1 > 7.091)
and bondedto (attr store1 < 119.707 and attr store1 > 119.107))
6 6 0 peak 2333 volume 41025580 hpm1 119.407 ppm1 7.121 ppm2 8.052
!# peak 2361-----------------------------------------------
assi (attr store1 < 6.148 and attr store1 > 6.028)
((attr store1 < 7.165 and attr store1 > 7.105)
and bondedto (attr store1 < 119.824 and attr store1 > 119.224))
6 6 0 peak 2361 volume 149794912 hpm1 119.524 ppm1 7.135 ppm2 6.088
!# peak 2362-----------------------------------------------
assi (attr store1 < 5.841 and attr store1 > 5.721)
((attr store1 < 7.165 and attr store1 > 7.105)
and bondedto (attr store1 < 119.753 and attr store1 > 119.153))
6 6 0 peak 2362 volume 0.6740711e+07 hpm1 119.453 ppm1 7.135 ppm2 5.781
!# peak 2376-----------------------------------------------
assi (attr store1 < 4.789 and attr store1 > 4.669)
((attr store1 < 6.936 and attr store1 > 6.876)
and bondedto (attr store1 < 119.643 and attr store1 > 119.043))
6 6 0 peak 2376 volume 55624748 hpm1 119.343 ppm1 6.906 ppm2 4.729
!# peak 2447-----------------------------------------------
assi (attr store1 < 4.786 and attr store1 > 4.666)
((attr store1 < 7.150 and attr store1 > 7.090)
and bondedto (attr store1 < 119.356 and attr store1 > 118.756))
6 6 0 peak 2447 volume 92205432 hpm1 119.056 ppm1 7.120 ppm2 4.726
!# peak 2463-----------------------------------------------
assi (attr store1 < 7.162 and attr store1 > 7.042)
((attr store1 < 6.847 and attr store1 > 6.787)
and bondedto (attr store1 < 118.781 and attr store1 > 118.181))
6 6 0 peak 2463 volume 1766418048 hpm1 118.481 ppm1 6.817 ppm2 7.102
!# peak 2503-----------------------------------------------
assi (attr store1 < 4.787 and attr store1 > 4.667)
((attr store1 < 6.846 and attr store1 > 6.786)
and bondedto (attr store1 < 118.806 and attr store1 > 118.206))
6 6 0 peak 2503 volume 172293200 hpm1 118.506 ppm1 6.816 ppm2 4.727
!# peak 2516-----------------------------------------------
assi (attr store1 < 8.104 and attr store1 > 7.984)
((attr store1 < 6.846 and attr store1 > 6.786)
and bondedto (attr store1 < 118.561 and attr store1 > 117.961))
6 6 0 peak 2516 volume 26141990 hpm1 118.261 ppm1 6.816 ppm2 8.044
!# peak 2523-----------------------------------------------
assi (attr store1 < 7.882 and attr store1 > 7.762)
((attr store1 < 6.531 and attr store1 > 6.471)
and bondedto (attr store1 < 118.375 and attr store1 > 117.775))
6 6 0 peak 2523 volume 24709660 hpm1 118.075 ppm1 6.501 ppm2 7.822
!# peak 2649-----------------------------------------------
assi (attr store1 < 7.204 and attr store1 > 7.084)
((attr store1 < 6.857 and attr store1 > 6.797)
and bondedto (attr store1 < 117.394 and attr store1 > 116.794))
6 6 0 peak 2649 volume 161008112 hpm1 117.094 ppm1 6.827 ppm2 7.144
!# peak 2907-----------------------------------------------
assi (attr store1 < 4.787 and attr store1 > 4.667)
((attr store1 < 6.936 and attr store1 > 6.876)
and bondedto (attr store1 < 115.473 and attr store1 > 114.873))
6 6 0 peak 2907 volume 113598696 hpm1 115.173 ppm1 6.906 ppm2 4.727
!# peak 2962-----------------------------------------------
assi (attr store1 < 9.932 and attr store1 > 9.812)
((attr store1 < 7.280 and attr store1 > 7.220)
and bondedto (attr store1 < 114.508 and attr store1 > 113.908))
6 6 0 peak 2962 volume 64674580 hpm1 114.208 ppm1 7.250 ppm2 9.872
!# peak 2969-----------------------------------------------
assi (attr store1 < 8.569 and attr store1 > 8.449)
((attr store1 < 7.804 and attr store1 > 7.744)
and bondedto (attr store1 < 114.523 and attr store1 > 113.923))
6 6 0 peak 2969 volume 30348450 hpm1 114.223 ppm1 7.774 ppm2 8.509
!# peak 2977-----------------------------------------------
assi (attr store1 < 7.874 and attr store1 > 7.754)
((attr store1 < 7.029 and attr store1 > 6.969)
and bondedto (attr store1 < 114.532 and attr store1 > 113.932))
6 6 0 peak 2977 volume 24598680 hpm1 114.232 ppm1 6.999 ppm2 7.814
!# peak 2993-----------------------------------------------
assi (attr store1 < 7.328 and attr store1 > 7.208)
((attr store1 < 7.491 and attr store1 > 7.431)
and bondedto (attr store1 < 114.580 and attr store1 > 113.980))
6 6 0 peak 2993 volume 87210176 hpm1 114.280 ppm1 7.461 ppm2 7.268
!# peak 2995-----------------------------------------------
assi (attr store1 < 7.334 and attr store1 > 7.214)
((attr store1 < 7.071 and attr store1 > 7.011)
and bondedto (attr store1 < 114.528 and attr store1 > 113.928))
6 6 0 peak 2995 volume 178463200 hpm1 114.228 ppm1 7.041 ppm2 7.274
!# peak 3001-----------------------------------------------
assi (attr store1 < 7.195 and attr store1 > 7.075)
((attr store1 < 7.804 and attr store1 > 7.744)
and bondedto (attr store1 < 114.513 and attr store1 > 113.913))
6 6 0 peak 3001 volume 219769696 hpm1 114.213 ppm1 7.774 ppm2 7.135
!# peak 3002-----------------------------------------------
assi (attr store1 < 7.109 and attr store1 > 6.989)
((attr store1 < 7.280 and attr store1 > 7.220)
and bondedto (attr store1 < 114.5 and attr store1 > 113.9))
6 6 0 peak 3002 volume 440285216 hpm1 114.2 ppm1 7.250 ppm2 7.049
!# peak 3005-----------------------------------------------
assi (attr store1 < 6.648 and attr store1 > 6.528)
((attr store1 < 7.281 and attr store1 > 7.221)
and bondedto (attr store1 < 114.534 and attr store1 > 113.934))
6 6 0 peak 3005 volume 47483640 hpm1 114.234 ppm1 7.251 ppm2 6.588
!# peak 3007-----------------------------------------------
assi (attr store1 < 6.608 and attr store1 > 6.488)
((attr store1 < 7.803 and attr store1 > 7.743)
and bondedto (attr store1 < 114.621 and attr store1 > 114.021))
6 6 0 peak 3007 volume 12415200 hpm1 114.321 ppm1 7.773 ppm2 6.548
!# peak 3024-----------------------------------------------
assi (attr store1 < 10.296 and attr store1 > 10.176)
((attr store1 < 7.038 and attr store1 > 6.978)
and bondedto (attr store1 < 114.219 and attr store1 > 113.619))
6 6 0 peak 3024 volume 69817816 hpm1 113.919 ppm1 7.008 ppm2 10.236
!# peak 3049-----------------------------------------------
assi (attr store1 < 7.840 and attr store1 > 7.720)
((attr store1 < 7.142 and attr store1 > 7.082)
and bondedto (attr store1 < 114.291 and attr store1 > 113.691))
6 6 0 peak 3049 volume 37059040 hpm1 113.991 ppm1 7.112 ppm2 7.780
!# peak 3078-----------------------------------------------
assi (attr store1 < 6.147 and attr store1 > 6.027)
((attr store1 < 7.124 and attr store1 > 7.064)
and bondedto (attr store1 < 114.114 and attr store1 > 113.514))
6 6 0 peak 3078 volume 21170770 hpm1 113.814 ppm1 7.094 ppm2 6.087
!# peak 3079-----------------------------------------------
assi (attr store1 < 6.148 and attr store1 > 6.028)
((attr store1 < 7.038 and attr store1 > 6.978)
and bondedto (attr store1 < 114.250 and attr store1 > 113.650))
6 6 0 peak 3079 volume 25087360 hpm1 113.950 ppm1 7.008 ppm2 6.088
!# peak 3083-----------------------------------------------
assi (attr store1 < 5.837 and attr store1 > 5.717)
((attr store1 < 7.037 and attr store1 > 6.977)
and bondedto (attr store1 < 114.236 and attr store1 > 113.636))
6 6 0 peak 3083 volume 149437696 hpm1 113.936 ppm1 7.007 ppm2 5.777
!# peak 3482-----------------------------------------------
assi (attr store1 < 0.931 and attr store1 > 0.811)
((attr store1 < 7.739 and attr store1 > 7.679)
and bondedto (attr store1 < 137.971 and attr store1 > 137.371))
6 6 0 peak 3482 volume 88347720 hpm1 137.671 ppm1 7.709 ppm2 0.871
!# peak 3483-----------------------------------------------
assi (attr store1 < 0.835 and attr store1 > 0.715)
((attr store1 < 7.949 and attr store1 > 7.889)
and bondedto (attr store1 < 138.080 and attr store1 > 137.480))
6 6 0 peak 3483 volume 12358550 hpm1 137.780 ppm1 7.919 ppm2 0.775
!# peak 3490-----------------------------------------------
assi (attr store1 < -0.021 and attr store1 > -0.141)
((attr store1 < 7.734 and attr store1 > 7.674)
and bondedto (attr store1 < 137.904 and attr store1 > 137.304))
6 6 0 peak 3490 volume 7063847 hpm1 137.604 ppm1 7.704 ppm2 -0.081
!# peak 4109-----------------------------------------------
assi (attr store1 < 4.426 and attr store1 > 4.306)
((attr store1 < 7.126 and attr store1 > 7.066)
and bondedto (attr store1 < 133.831 and attr store1 > 133.231))
6 6 0 peak 4109 volume 223504400 hpm1 133.531 ppm1 7.096 ppm2 4.366
!# peak 4118-----------------------------------------------
assi (attr store1 < 3.976 and attr store1 > 3.856)
((attr store1 < 7.124 and attr store1 > 7.064)
and bondedto (attr store1 < 133.771 and attr store1 > 133.171))
6 6 0 peak 4118 volume 96618816 hpm1 133.471 ppm1 7.094 ppm2 3.916
!# peak 4124-----------------------------------------------
assi (attr store1 < 3.244 and attr store1 > 3.124)
((attr store1 < 7.126 and attr store1 > 7.066)
and bondedto (attr store1 < 133.830 and attr store1 > 133.230))
6 6 0 peak 4124 volume 457610176 hpm1 133.530 ppm1 7.096 ppm2 3.184
!# peak 4127-----------------------------------------------
assi (attr store1 < 2.967 and attr store1 > 2.847)
((attr store1 < 7.146 and attr store1 > 7.086)
and bondedto (attr store1 < 133.817 and attr store1 > 133.217))
6 6 0 peak 4127 volume 310234816 hpm1 133.517 ppm1 7.116 ppm2 2.907
!# peak 4213-----------------------------------------------
assi (attr store1 < 4.522 and attr store1 > 4.402)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 133.021 and attr store1 > 132.421))
6 6 0 peak 4213 volume 137903408 hpm1 132.721 ppm1 7.138 ppm2 4.462
!# peak 4215-----------------------------------------------
assi (attr store1 < 4.242 and attr store1 > 4.122)
((attr store1 < 7.167 and attr store1 > 7.107)
and bondedto (attr store1 < 133.043 and attr store1 > 132.443))
6 6 0 peak 4215 volume 135996192 hpm1 132.743 ppm1 7.137 ppm2 4.182
!# peak 4219-----------------------------------------------
assi (attr store1 < 3.783 and attr store1 > 3.663)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.997 and attr store1 > 132.397))
6 6 0 peak 4219 volume 86069736 hpm1 132.697 ppm1 7.138 ppm2 3.723
!# peak 4224-----------------------------------------------
assi (attr store1 < 3.427 and attr store1 > 3.307)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.980 and attr store1 > 132.380))
6 6 0 peak 4224 volume 303207104 hpm1 132.680 ppm1 7.138 ppm2 3.367
!# peak 4228-----------------------------------------------
assi (attr store1 < 2.290 and attr store1 > 2.170)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.954 and attr store1 > 132.354))
6 6 0 peak 4228 volume 47074632 hpm1 132.654 ppm1 7.138 ppm2 2.230
!# peak 4231-----------------------------------------------
assi (attr store1 < 1.925 and attr store1 > 1.805)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.964 and attr store1 > 132.364))
6 6 0 peak 4231 volume 108615800 hpm1 132.664 ppm1 7.138 ppm2 1.865
!# peak 4232-----------------------------------------------
assi (attr store1 < 1.742 and attr store1 > 1.622)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.963 and attr store1 > 132.363))
6 6 0 peak 4232 volume 84887728 hpm1 132.663 ppm1 7.138 ppm2 1.682
!# peak 4238-----------------------------------------------
assi (attr store1 < 1.376 and attr store1 > 1.256)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.98 and attr store1 > 132.38))
6 6 0 peak 4238 volume 214200704 hpm1 132.68 ppm1 7.138 ppm2 1.316
!# peak 4241-----------------------------------------------
assi (attr store1 < 1.155 and attr store1 > 1.035)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.962 and attr store1 > 132.362))
6 6 0 peak 4241 volume 210578000 hpm1 132.662 ppm1 7.138 ppm2 1.095
!# peak 4286-----------------------------------------------
assi (attr store1 < 1.522 and attr store1 > 1.402)
((attr store1 < 7.170 and attr store1 > 7.110)
and bondedto (attr store1 < 132.965 and attr store1 > 132.365))
6 6 0 peak 4286 volume 184575008 hpm1 132.665 ppm1 7.140 ppm2 1.462
!# peak 4299-----------------------------------------------
assi (attr store1 < 0.207 and attr store1 > 0.087)
((attr store1 < 7.163 and attr store1 > 7.103)
and bondedto (attr store1 < 132.964 and attr store1 > 132.364))
6 6 0 peak 4299 volume 104543000 hpm1 132.664 ppm1 7.133 ppm2 0.147
!# peak 4311-----------------------------------------------
assi (attr store1 < 4.569 and attr store1 > 4.449)
((attr store1 < 6.874 and attr store1 > 6.814)
and bondedto (attr store1 < 132.599 and attr store1 > 131.999))
6 6 0 peak 4311 volume 140841696 hpm1 132.299 ppm1 6.844 ppm2 4.509
!# peak 4369-----------------------------------------------
assi (attr store1 < 3.283 and attr store1 > 3.163)
((attr store1 < 6.874 and attr store1 > 6.814)
and bondedto (attr store1 < 132.598 and attr store1 > 131.998))
6 6 0 peak 4369 volume 142644400 hpm1 132.298 ppm1 6.844 ppm2 3.223
!# peak 4371-----------------------------------------------
assi (attr store1 < 2.927 and attr store1 > 2.807)
((attr store1 < 6.876 and attr store1 > 6.816)
and bondedto (attr store1 < 132.614 and attr store1 > 132.014))
6 6 0 peak 4371 volume 59565472 hpm1 132.314 ppm1 6.846 ppm2 2.867
!# peak 4373-----------------------------------------------
assi (attr store1 < 2.510 and attr store1 > 2.390)
((attr store1 < 6.875 and attr store1 > 6.815)
and bondedto (attr store1 < 132.601 and attr store1 > 132.001))
6 6 0 peak 4373 volume 144230208 hpm1 132.301 ppm1 6.845 ppm2 2.450
!# peak 4377-----------------------------------------------
assi (attr store1 < 1.650 and attr store1 > 1.530)
((attr store1 < 6.875 and attr store1 > 6.815)
and bondedto (attr store1 < 132.595 and attr store1 > 131.995))
6 6 0 peak 4377 volume 78295896 hpm1 132.295 ppm1 6.845 ppm2 1.590
!# peak 4380-----------------------------------------------
assi (attr store1 < 1.422 and attr store1 > 1.302)
((attr store1 < 6.874 and attr store1 > 6.814)
and bondedto (attr store1 < 132.528 and attr store1 > 131.928))
6 6 0 peak 4380 volume 91301176 hpm1 132.228 ppm1 6.844 ppm2 1.362
!# peak 4385-----------------------------------------------
assi (attr store1 < 0.707 and attr store1 > 0.587)
((attr store1 < 6.874 and attr store1 > 6.814)
and bondedto (attr store1 < 132.588 and attr store1 > 131.988))
6 6 0 peak 4385 volume 256071808 hpm1 132.288 ppm1 6.844 ppm2 0.647
!# peak 4389-----------------------------------------------
assi (attr store1 < 0.430 and attr store1 > 0.310)
((attr store1 < 6.874 and attr store1 > 6.814)
and bondedto (attr store1 < 132.602 and attr store1 > 132.002))
6 6 0 peak 4389 volume 136149488 hpm1 132.302 ppm1 6.844 ppm2 0.370
!# peak 4392-----------------------------------------------
assi (attr store1 < 0.196 and attr store1 > 0.076)
((attr store1 < 6.875 and attr store1 > 6.815)
and bondedto (attr store1 < 132.594 and attr store1 > 131.994))
6 6 0 peak 4392 volume 56181376 hpm1 132.294 ppm1 6.845 ppm2 0.136
!# peak 4414-----------------------------------------------
assi (attr store1 < 3.100 and attr store1 > 2.980)
((attr store1 < 7.459 and attr store1 > 7.399)
and bondedto (attr store1 < 131.987 and attr store1 > 131.387))
6 6 0 peak 4414 volume 26631420 hpm1 131.687 ppm1 7.429 ppm2 3.040
!# peak 4419-----------------------------------------------
assi (attr store1 < 2.375 and attr store1 > 2.255)
((attr store1 < 7.462 and attr store1 > 7.402)
and bondedto (attr store1 < 132.149 and attr store1 > 131.549))
6 6 0 peak 4419 volume 13687620 hpm1 131.849 ppm1 7.432 ppm2 2.315
!# peak 4421-----------------------------------------------
assi (attr store1 < 2.109 and attr store1 > 1.989)
((attr store1 < 7.460 and attr store1 > 7.400)
and bondedto (attr store1 < 131.962 and attr store1 > 131.362))
6 6 0 peak 4421 volume 13126200 hpm1 131.662 ppm1 7.430 ppm2 2.049
!# peak 4426-----------------------------------------------
assi (attr store1 < 1.694 and attr store1 > 1.574)
((attr store1 < 7.460 and attr store1 > 7.400)
and bondedto (attr store1 < 132.128 and attr store1 > 131.528))
6 6 0 peak 4426 volume 58389688 hpm1 131.828 ppm1 7.430 ppm2 1.634
!# peak 4428-----------------------------------------------
assi (attr store1 < 1.380 and attr store1 > 1.260)
((attr store1 < 7.459 and attr store1 > 7.399)
and bondedto (attr store1 < 132.067 and attr store1 > 131.467))
6 6 0 peak 4428 volume 162897200 hpm1 131.767 ppm1 7.429 ppm2 1.320
!# peak 4432-----------------------------------------------
assi (attr store1 < 0.832 and attr store1 > 0.712)
((attr store1 < 7.461 and attr store1 > 7.401)
and bondedto (attr store1 < 132.094 and attr store1 > 131.494))
6 6 0 peak 4432 volume 159830704 hpm1 131.794 ppm1 7.431 ppm2 0.772
!# peak 4434-----------------------------------------------
assi (attr store1 < 0.427 and attr store1 > 0.307)
((attr store1 < 7.464 and attr store1 > 7.404)
and bondedto (attr store1 < 132.103 and attr store1 > 131.503))
6 6 0 peak 4434 volume 24953180 hpm1 131.803 ppm1 7.434 ppm2 0.367
!# peak 4452-----------------------------------------------
assi (attr store1 < 4.065 and attr store1 > 3.945)
((attr store1 < 7.460 and attr store1 > 7.400)
and bondedto (attr store1 < 132.167 and attr store1 > 131.167))
6 6 0 peak 4452 volume 20367370 hpm1 131.467 ppm1 7.430 ppm2 4.005
!# peak 4453-----------------------------------------------
assi (attr store1 < 4.064 and attr store1 > 3.944)
((attr store1 < 7.344 and attr store1 > 7.284)
and bondedto (attr store1 < 131.594 and attr store1 > 130.994))
6 6 0 peak 4453 volume 53076660 hpm1 131.294 ppm1 7.314 ppm2 4.004
!# peak 4459-----------------------------------------------
assi (attr store1 < 3.282 and attr store1 > 3.162)
((attr store1 < 7.458 and attr store1 > 7.398)
and bondedto (attr store1 < 132.147 and attr store1 > 131.147))
6 6 0 peak 4459 volume 13640940 hpm1 131.447 ppm1 7.428 ppm2 3.222
!# peak 4460-----------------------------------------------
assi (attr store1 < 3.287 and attr store1 > 3.167)
((attr store1 < 7.346 and attr store1 > 7.286)
and bondedto (attr store1 < 131.604 and attr store1 > 131.004))
6 6 0 peak 4460 volume 65990220 hpm1 131.304 ppm1 7.316 ppm2 3.227
!# peak 4463-----------------------------------------------
assi (attr store1 < 3.099 and attr store1 > 2.979)
((attr store1 < 7.345 and attr store1 > 7.285)
and bondedto (attr store1 < 131.590 and attr store1 > 130.990))
6 6 0 peak 4463 volume 86864000 hpm1 131.290 ppm1 7.315 ppm2 3.039
!# peak 4475-----------------------------------------------
assi (attr store1 < 2.383 and attr store1 > 2.263)
((attr store1 < 7.344 and attr store1 > 7.284)
and bondedto (attr store1 < 131.656 and attr store1 > 131.056))
6 6 0 peak 4475 volume 17391210 hpm1 131.356 ppm1 7.314 ppm2 2.323
!# peak 4479-----------------------------------------------
assi (attr store1 < 1.693 and attr store1 > 1.573)
((attr store1 < 7.345 and attr store1 > 7.285)
and bondedto (attr store1 < 131.689 and attr store1 > 131.089))
6 6 0 peak 4479 volume 102470000 hpm1 131.389 ppm1 7.315 ppm2 1.633
!# peak 4484-----------------------------------------------
assi (attr store1 < 1.379 and attr store1 > 1.259)
((attr store1 < 7.347 and attr store1 > 7.287)
and bondedto (attr store1 < 131.628 and attr store1 > 131.028))
6 6 0 peak 4484 volume 227675792 hpm1 131.328 ppm1 7.317 ppm2 1.319
!# peak 4503-----------------------------------------------
assi (attr store1 < 0.832 and attr store1 > 0.712)
((attr store1 < 7.346 and attr store1 > 7.286)
and bondedto (attr store1 < 131.659 and attr store1 > 131.059))
6 6 0 peak 4503 volume 169829504 hpm1 131.359 ppm1 7.316 ppm2 0.772
!# peak 4506-----------------------------------------------
assi (attr store1 < 0.563 and attr store1 > 0.443)
((attr store1 < 7.462 and attr store1 > 7.402)
and bondedto (attr store1 < 132.136 and attr store1 > 131.136))
6 6 0 peak 4506 volume 116846096 hpm1 131.436 ppm1 7.432 ppm2 0.503
!# peak 4519-----------------------------------------------
assi (attr store1 < 0.472 and attr store1 > 0.352)
((attr store1 < 7.349 and attr store1 > 7.289)
and bondedto (attr store1 < 131.742 and attr store1 > 131.142))
6 6 0 peak 4519 volume 40691660 hpm1 131.442 ppm1 7.319 ppm2 0.412
!# peak 4544-----------------------------------------------
assi (attr store1 < 2.109 and attr store1 > 1.989)
((attr store1 < 7.345 and attr store1 > 7.285)
and bondedto (attr store1 < 131.332 and attr store1 > 130.732))
6 6 0 peak 4544 volume 20598500 hpm1 131.032 ppm1 7.315 ppm2 2.049
!# peak 4593-----------------------------------------------
assi (attr store1 < 4.285 and attr store1 > 4.165)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 130.871 and attr store1 > 130.271))
6 6 0 peak 4593 volume 56865448 hpm1 130.571 ppm1 6.958 ppm2 4.225
!# peak 4597-----------------------------------------------
assi (attr store1 < 3.787 and attr store1 > 3.667)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 130.901 and attr store1 > 130.301))
6 6 0 peak 4597 volume 10908230 hpm1 130.601 ppm1 6.958 ppm2 3.727
!# peak 4603-----------------------------------------------
assi (attr store1 < 3.434 and attr store1 > 3.314)
((attr store1 < 6.992 and attr store1 > 6.932)
and bondedto (attr store1 < 130.845 and attr store1 > 130.245))
6 6 0 peak 4603 volume 12785020 hpm1 130.545 ppm1 6.962 ppm2 3.374
!# peak 4604-----------------------------------------------
assi (attr store1 < 2.966 and attr store1 > 2.846)
((attr store1 < 6.987 and attr store1 > 6.927)
and bondedto (attr store1 < 130.883 and attr store1 > 130.283))
6 6 0 peak 4604 volume 17847850 hpm1 130.583 ppm1 6.957 ppm2 2.906
!# peak 4610-----------------------------------------------
assi (attr store1 < 1.925 and attr store1 > 1.805)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 130.893 and attr store1 > 130.293))
6 6 0 peak 4610 volume 35529788 hpm1 130.593 ppm1 6.958 ppm2 1.865
!# peak 4612-----------------------------------------------
assi (attr store1 < 1.695 and attr store1 > 1.575)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 130.896 and attr store1 > 130.296))
6 6 0 peak 4612 volume 59438420 hpm1 130.596 ppm1 6.958 ppm2 1.635
!# peak 4615-----------------------------------------------
assi (attr store1 < 1.377 and attr store1 > 1.257)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 130.897 and attr store1 > 130.297))
6 6 0 peak 4615 volume 238370112 hpm1 130.597 ppm1 6.958 ppm2 1.317
!# peak 4627-----------------------------------------------
assi (attr store1 < 1.197 and attr store1 > 1.077)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 130.893 and attr store1 > 130.293))
6 6 0 peak 4627 volume 109094200 hpm1 130.593 ppm1 6.958 ppm2 1.137
!# peak 4635-----------------------------------------------
assi (attr store1 < 0.193 and attr store1 > 0.073)
((attr store1 < 6.989 and attr store1 > 6.929)
and bondedto (attr store1 < 130.895 and attr store1 > 130.295))
6 6 0 peak 4635 volume 101212400 hpm1 130.595 ppm1 6.959 ppm2 0.133
!# peak 4743-----------------------------------------------
assi (attr store1 < 1.790 and attr store1 > 1.670)
((attr store1 < 7.348 and attr store1 > 7.288)
and bondedto (attr store1 < 129.983 and attr store1 > 129.383))
6 6 0 peak 4743 volume 72992216 hpm1 129.683 ppm1 7.318 ppm2 1.730
!# peak 4745-----------------------------------------------
assi (attr store1 < 1.379 and attr store1 > 1.259)
((attr store1 < 7.348 and attr store1 > 7.288)
and bondedto (attr store1 < 129.955 and attr store1 > 129.355))
6 6 0 peak 4745 volume 182847600 hpm1 129.655 ppm1 7.318 ppm2 1.319
!# peak 4747-----------------------------------------------
assi (attr store1 < 1.062 and attr store1 > 0.942)
((attr store1 < 7.349 and attr store1 > 7.289)
and bondedto (attr store1 < 130.038 and attr store1 > 129.438))
6 6 0 peak 4747 volume 54036240 hpm1 129.738 ppm1 7.319 ppm2 1.002
!# peak 4751-----------------------------------------------
assi (attr store1 < 0.789 and attr store1 > 0.669)
((attr store1 < 7.348 and attr store1 > 7.288)
and bondedto (attr store1 < 130.020 and attr store1 > 129.420))
6 6 0 peak 4751 volume 162030704 hpm1 129.720 ppm1 7.318 ppm2 0.729
!# peak 4755-----------------------------------------------
assi (attr store1 < 0.610 and attr store1 > 0.490)
((attr store1 < 7.348 and attr store1 > 7.288)
and bondedto (attr store1 < 129.980 and attr store1 > 129.380))
6 6 0 peak 4755 volume 91079064 hpm1 129.680 ppm1 7.318 ppm2 0.550
!# peak 4756-----------------------------------------------
assi (attr store1 < 0.427 and attr store1 > 0.307)
((attr store1 < 7.347 and attr store1 > 7.287)
and bondedto (attr store1 < 129.909 and attr store1 > 129.309))
6 6 0 peak 4756 volume 29965142 hpm1 129.609 ppm1 7.317 ppm2 0.367
!# peak 4806-----------------------------------------------
assi (attr store1 < 4.289 and attr store1 > 4.169)
((attr store1 < 6.917 and attr store1 > 6.857)
and bondedto (attr store1 < 129.136 and attr store1 > 128.536))
6 6 0 peak 4806 volume 48467100 hpm1 128.836 ppm1 6.887 ppm2 4.229
!# peak 4821-----------------------------------------------
assi (attr store1 < 1.655 and attr store1 > 1.535)
((attr store1 < 6.915 and attr store1 > 6.855)
and bondedto (attr store1 < 129.159 and attr store1 > 128.559))
6 6 0 peak 4821 volume 46390788 hpm1 128.859 ppm1 6.885 ppm2 1.595
!# peak 4822-----------------------------------------------
assi (attr store1 < 1.336 and attr store1 > 1.216)
((attr store1 < 6.916 and attr store1 > 6.856)
and bondedto (attr store1 < 129.144 and attr store1 > 128.544))
6 6 0 peak 4822 volume 133794800 hpm1 128.844 ppm1 6.886 ppm2 1.276
!# peak 4828-----------------------------------------------
assi (attr store1 < 1.153 and attr store1 > 1.033)
((attr store1 < 6.913 and attr store1 > 6.853)
and bondedto (attr store1 < 129.141 and attr store1 > 128.541))
6 6 0 peak 4828 volume 19011000 hpm1 128.841 ppm1 6.883 ppm2 1.093
!# peak 4831-----------------------------------------------
assi (attr store1 < 0.740 and attr store1 > 0.620)
((attr store1 < 6.916 and attr store1 > 6.856)
and bondedto (attr store1 < 129.181 and attr store1 > 128.581))
6 6 0 peak 4831 volume 91986552 hpm1 128.881 ppm1 6.886 ppm2 0.680
!# peak 4837-----------------------------------------------
assi (attr store1 < 0.193 and attr store1 > 0.073)
((attr store1 < 6.915 and attr store1 > 6.855)
and bondedto (attr store1 < 129.156 and attr store1 > 128.556))
6 6 0 peak 4837 volume 32148022 hpm1 128.856 ppm1 6.885 ppm2 0.133
!# peak 4994-----------------------------------------------
assi (attr store1 < 3.703 and attr store1 > 3.583)
((attr store1 < 7.198 and attr store1 > 7.138)
and bondedto (attr store1 < 127.299 and attr store1 > 126.699))
6 6 0 peak 4994 volume 33172322 hpm1 126.999 ppm1 7.168 ppm2 3.643
!# peak 5001-----------------------------------------------
assi (attr store1 < 3.287 and attr store1 > 3.167)
((attr store1 < 7.196 and attr store1 > 7.136)
and bondedto (attr store1 < 127.276 and attr store1 > 126.676))
6 6 0 peak 5001 volume 71391336 hpm1 126.976 ppm1 7.166 ppm2 3.227
!# peak 5039-----------------------------------------------
assi (attr store1 < 4.333 and attr store1 > 4.213)
((attr store1 < 7.193 and attr store1 > 7.133)
and bondedto (attr store1 < 126.982 and attr store1 > 126.382))
6 6 0 peak 5039 volume 96180720 hpm1 126.682 ppm1 7.163 ppm2 4.273
!# peak 5040-----------------------------------------------
assi (attr store1 < 4.330 and attr store1 > 4.210)
((attr store1 < 7.147 and attr store1 > 7.087)
and bondedto (attr store1 < 126.973 and attr store1 > 126.373))
6 6 0 peak 5040 volume 73927704 hpm1 126.673 ppm1 7.117 ppm2 4.270
!# peak 5044-----------------------------------------------
assi (attr store1 < 4.103 and attr store1 > 3.983)
((attr store1 < 7.197 and attr store1 > 7.137)
and bondedto (attr store1 < 127.109 and attr store1 > 126.509))
6 6 0 peak 5044 volume 60477972 hpm1 126.809 ppm1 7.167 ppm2 4.043
!# peak 5048-----------------------------------------------
assi (attr store1 < 3.421 and attr store1 > 3.301)
((attr store1 < 7.146 and attr store1 > 7.086)
and bondedto (attr store1 < 126.935 and attr store1 > 126.335))
6 6 0 peak 5048 volume 48366632 hpm1 126.635 ppm1 7.116 ppm2 3.361
!# peak 5058-----------------------------------------------
assi (attr store1 < 2.607 and attr store1 > 2.487)
((attr store1 < 7.145 and attr store1 > 7.085)
and bondedto (attr store1 < 126.938 and attr store1 > 126.338))
6 6 0 peak 5058 volume 46655048 hpm1 126.638 ppm1 7.115 ppm2 2.547
!# peak 5064-----------------------------------------------
assi (attr store1 < 1.831 and attr store1 > 1.711)
((attr store1 < 7.195 and attr store1 > 7.135)
and bondedto (attr store1 < 127.142 and attr store1 > 126.542))
6 6 0 peak 5064 volume 40855760 hpm1 126.842 ppm1 7.165 ppm2 1.771
!# peak 5067-----------------------------------------------
assi (attr store1 < 0.879 and attr store1 > 0.759)
((attr store1 < 7.148 and attr store1 > 7.088)
and bondedto (attr store1 < 126.983 and attr store1 > 126.383))
6 6 0 peak 5067 volume 169112288 hpm1 126.683 ppm1 7.118 ppm2 0.819
!# peak 5078-----------------------------------------------
assi (attr store1 < 0.838 and attr store1 > 0.718)
((attr store1 < 7.193 and attr store1 > 7.133)
and bondedto (attr store1 < 127.044 and attr store1 > 126.444))
6 6 0 peak 5078 volume 174876608 hpm1 126.744 ppm1 7.163 ppm2 0.778
!# peak 5099-----------------------------------------------
assi (attr store1 < 0.154 and attr store1 > 0.034)
((attr store1 < 7.195 and attr store1 > 7.135)
and bondedto (attr store1 < 126.992 and attr store1 > 126.392))
6 6 0 peak 5099 volume 102251200 hpm1 126.692 ppm1 7.165 ppm2 0.094
!# peak 5100-----------------------------------------------
assi (attr store1 < 0.010 and attr store1 > -0.109)
((attr store1 < 7.144 and attr store1 > 7.084)
and bondedto (attr store1 < 126.965 and attr store1 > 126.365))
6 6 0 peak 5100 volume 79340960 hpm1 126.665 ppm1 7.114 ppm2 -0.049
!# peak 5272-----------------------------------------------
assi (attr store1 < 2.604 and attr store1 > 2.484)
((attr store1 < 5.762 and attr store1 > 5.702)
and bondedto (attr store1 < 125.757 and attr store1 > 125.157))
6 6 0 peak 5272 volume 18055110 hpm1 125.457 ppm1 5.732 ppm2 2.544
!# peak 5292-----------------------------------------------
assi (attr store1 < 0.930 and attr store1 > 0.810)
((attr store1 < 5.782 and attr store1 > 5.722)
and bondedto (attr store1 < 125.666 and attr store1 > 125.066))
6 6 0 peak 5292 volume 154429200 hpm1 125.366 ppm1 5.752 ppm2 0.870
!# peak 5294-----------------------------------------------
assi (attr store1 < 0.605 and attr store1 > 0.485)
((attr store1 < 5.823 and attr store1 > 5.723)
and bondedto (attr store1 < 125.653 and attr store1 > 125.053))
6 6 0 peak 5294 volume 33337220 hpm1 125.353 ppm1 5.793 ppm2 0.545
!# peak 5296-----------------------------------------------
assi (attr store1 < 0.470 and attr store1 > 0.350)
((attr store1 < 5.765 and attr store1 > 5.705)
and bondedto (attr store1 < 125.699 and attr store1 > 125.099))
6 6 0 peak 5296 volume 43771072 hpm1 125.399 ppm1 5.735 ppm2 0.410
!# peak 5358-----------------------------------------------
assi (attr store1 < 0.968 and attr store1 > 0.848)
((attr store1 < 6.081 and attr store1 > 6.021)
and bondedto (attr store1 < 125.407 and attr store1 > 124.807))
6 6 0 peak 5358 volume 20356400 hpm1 125.107 ppm1 6.051 ppm2 0.908
!# peak 5401-----------------------------------------------
assi (attr store1 < 1.420 and attr store1 > 1.300)
((attr store1 < 7.059 and attr store1 > 6.999)
and bondedto (attr store1 < 124.725 and attr store1 > 124.125))
6 6 0 peak 5401 volume 102031000 hpm1 124.425 ppm1 7.029 ppm2 1.360
!# peak 5403-----------------------------------------------
assi (attr store1 < 0.962 and attr store1 > 0.842)
((attr store1 < 7.054 and attr store1 > 6.994)
and bondedto (attr store1 < 124.773 and attr store1 > 124.173))
6 6 0 peak 5403 volume 46807060 hpm1 124.473 ppm1 7.024 ppm2 0.902
!# peak 5562-----------------------------------------------
assi (attr store1 < 4.103 and attr store1 > 3.983)
((attr store1 < 7.144 and attr store1 > 7.084)
and bondedto (attr store1 < 123.642 and attr store1 > 123.042))
6 6 0 peak 5562 volume 25585062 hpm1 123.342 ppm1 7.114 ppm2 4.043
!# peak 5582-----------------------------------------------
assi (attr store1 < 1.742 and attr store1 > 1.622)
((attr store1 < 7.129 and attr store1 > 7.069)
and bondedto (attr store1 < 123.633 and attr store1 > 123.033))
6 6 0 peak 5582 volume 123039200 hpm1 123.333 ppm1 7.099 ppm2 1.682
!# peak 5600-----------------------------------------------
assi (attr store1 < 1.514 and attr store1 > 1.394)
((attr store1 < 7.128 and attr store1 > 7.068)
and bondedto (attr store1 < 123.635 and attr store1 > 123.035))
6 6 0 peak 5600 volume 157435808 hpm1 123.335 ppm1 7.098 ppm2 1.454
!# peak 5602-----------------------------------------------
assi (attr store1 < 1.063 and attr store1 > 0.943)
((attr store1 < 7.127 and attr store1 > 7.067)
and bondedto (attr store1 < 123.623 and attr store1 > 123.023))
6 6 0 peak 5602 volume 42151220 hpm1 123.323 ppm1 7.097 ppm2 1.003
!# peak 5603-----------------------------------------------
assi (attr store1 < 0.786 and attr store1 > 0.666)
((attr store1 < 7.141 and attr store1 > 7.081)
and bondedto (attr store1 < 123.596 and attr store1 > 122.996))
6 6 0 peak 5603 volume 86247936 hpm1 123.296 ppm1 7.111 ppm2 0.726
!# peak 5605-----------------------------------------------
assi (attr store1 < 0.465 and attr store1 > 0.345)
((attr store1 < 7.129 and attr store1 > 7.069)
and bondedto (attr store1 < 123.618 and attr store1 > 123.018))
6 6 0 peak 5605 volume 98784400 hpm1 123.318 ppm1 7.099 ppm2 0.405
!# peak 5607-----------------------------------------------
assi (attr store1 < 0.247 and attr store1 > 0.127)
((attr store1 < 7.126 and attr store1 > 7.066)
and bondedto (attr store1 < 123.658 and attr store1 > 123.058))
6 6 0 peak 5607 volume 16303471 hpm1 123.358 ppm1 7.096 ppm2 0.187
!# peak 5713-----------------------------------------------
assi (attr store1 < 4.287 and attr store1 > 4.167)
((attr store1 < 6.374 and attr store1 > 6.314)
and bondedto (attr store1 < 122.372 and attr store1 > 121.772))
6 6 0 peak 5713 volume 24479260 hpm1 122.072 ppm1 6.344 ppm2 4.227
!# peak 5719-----------------------------------------------
assi (attr store1 < 3.646 and attr store1 > 3.526)
((attr store1 < 6.369 and attr store1 > 6.309)
and bondedto (attr store1 < 122.313 and attr store1 > 121.713))
6 6 0 peak 5719 volume 14717080 hpm1 122.013 ppm1 6.339 ppm2 3.586
!# peak 5731-----------------------------------------------
assi (attr store1 < 3.428 and attr store1 > 3.308)
((attr store1 < 6.989 and attr store1 > 6.929)
and bondedto (attr store1 < 122.246 and attr store1 > 121.646))
6 6 0 peak 5731 volume 20833230 hpm1 121.946 ppm1 6.959 ppm2 3.368
!# peak 5732-----------------------------------------------
assi (attr store1 < 3.428 and attr store1 > 3.308)
((attr store1 < 6.371 and attr store1 > 6.311)
and bondedto (attr store1 < 122.324 and attr store1 > 121.724))
6 6 0 peak 5732 volume 53895096 hpm1 122.024 ppm1 6.341 ppm2 3.368
!# peak 5738-----------------------------------------------
assi (attr store1 < 2.922 and attr store1 > 2.802)
((attr store1 < 6.369 and attr store1 > 6.309)
and bondedto (attr store1 < 122.353 and attr store1 > 121.753))
6 6 0 peak 5738 volume 87082672 hpm1 122.053 ppm1 6.339 ppm2 2.862
!# peak 5741-----------------------------------------------
assi (attr store1 < 2.751 and attr store1 > 2.631)
((attr store1 < 6.369 and attr store1 > 6.309)
and bondedto (attr store1 < 122.326 and attr store1 > 121.726))
6 6 0 peak 5741 volume 107695896 hpm1 122.026 ppm1 6.339 ppm2 2.691
!# peak 5743-----------------------------------------------
assi (attr store1 < 2.522 and attr store1 > 2.402)
((attr store1 < 6.370 and attr store1 > 6.310)
and bondedto (attr store1 < 122.333 and attr store1 > 121.733))
6 6 0 peak 5743 volume 55554092 hpm1 122.033 ppm1 6.340 ppm2 2.462
!# peak 5745-----------------------------------------------
assi (attr store1 < 2.245 and attr store1 > 2.125)
((attr store1 < 6.371 and attr store1 > 6.311)
and bondedto (attr store1 < 122.307 and attr store1 > 121.707))
6 6 0 peak 5745 volume 9309481 hpm1 122.007 ppm1 6.341 ppm2 2.185
!# peak 5747-----------------------------------------------
assi (attr store1 < 1.875 and attr store1 > 1.755)
((attr store1 < 6.370 and attr store1 > 6.310)
and bondedto (attr store1 < 122.330 and attr store1 > 121.730))
6 6 0 peak 5747 volume 206578112 hpm1 122.030 ppm1 6.340 ppm2 1.815
!# peak 5752-----------------------------------------------
assi (attr store1 < 1.465 and attr store1 > 1.345)
((attr store1 < 6.370 and attr store1 > 6.310)
and bondedto (attr store1 < 122.319 and attr store1 > 121.719))
6 6 0 peak 5752 volume 78072560 hpm1 122.019 ppm1 6.340 ppm2 1.405
!# peak 5757-----------------------------------------------
assi (attr store1 < 1.377 and attr store1 > 1.257)
((attr store1 < 7.825 and attr store1 > 7.765)
and bondedto (attr store1 < 122.291 and attr store1 > 121.691))
6 6 0 peak 5757 volume 26947960 hpm1 121.991 ppm1 7.795 ppm2 1.317
!# peak 5760-----------------------------------------------
assi (attr store1 < 1.019 and attr store1 > 0.899)
((attr store1 < 6.373 and attr store1 > 6.313)
and bondedto (attr store1 < 122.288 and attr store1 > 121.688))
6 6 0 peak 5760 volume 38117640 hpm1 121.988 ppm1 6.343 ppm2 0.959
!# peak 5762-----------------------------------------------
assi (attr store1 < 0.831 and attr store1 > 0.711)
((attr store1 < 6.373 and attr store1 > 6.313)
and bondedto (attr store1 < 122.296 and attr store1 > 121.696))
6 6 0 peak 5762 volume 82404144 hpm1 121.996 ppm1 6.343 ppm2 0.771
!# peak 5765-----------------------------------------------
assi (attr store1 < 0.565 and attr store1 > 0.445)
((attr store1 < 6.356 and attr store1 > 6.296)
and bondedto (attr store1 < 122.275 and attr store1 > 121.675))
6 6 0 peak 5765 volume 40969980 hpm1 121.975 ppm1 6.326 ppm2 0.505
!# peak 5771-----------------------------------------------
assi (attr store1 < -0.172 and attr store1 > -0.292)
((attr store1 < 6.369 and attr store1 > 6.309)
and bondedto (attr store1 < 122.348 and attr store1 > 121.748))
6 6 0 peak 5771 volume 6402914 hpm1 122.048 ppm1 6.339 ppm2 -0.232
!# peak 5800-----------------------------------------------
assi (attr store1 < 0.789 and attr store1 > 0.669)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 121.828 and attr store1 > 121.228))
6 6 0 peak 5800 volume 137745200 hpm1 121.528 ppm1 6.958 ppm2 0.729
!# peak 5845-----------------------------------------------
assi (attr store1 < 1.829 and attr store1 > 1.709)
((attr store1 < 6.986 and attr store1 > 6.926)
and bondedto (attr store1 < 121.443 and attr store1 > 120.843))
6 6 0 peak 5845 volume 37495088 hpm1 121.143 ppm1 6.956 ppm2 1.769
!# peak 5848-----------------------------------------------
assi (attr store1 < 1.377 and attr store1 > 1.257)
((attr store1 < 6.986 and attr store1 > 6.926)
and bondedto (attr store1 < 121.478 and attr store1 > 120.878))
6 6 0 peak 5848 volume 101956600 hpm1 121.178 ppm1 6.956 ppm2 1.317
!# peak 5850-----------------------------------------------
assi (attr store1 < 1.062 and attr store1 > 0.942)
((attr store1 < 6.986 and attr store1 > 6.926)
and bondedto (attr store1 < 121.490 and attr store1 > 120.890))
6 6 0 peak 5850 volume 54975628 hpm1 121.190 ppm1 6.956 ppm2 1.002
!# peak 5851-----------------------------------------------
assi (attr store1 < 0.834 and attr store1 > 0.714)
((attr store1 < 6.602 and attr store1 > 6.542)
and bondedto (attr store1 < 121.445 and attr store1 > 120.845))
6 6 0 peak 5851 volume 116540400 hpm1 121.145 ppm1 6.572 ppm2 0.774
!# peak 5858-----------------------------------------------
assi (attr store1 < 0.424 and attr store1 > 0.304)
((attr store1 < 6.984 and attr store1 > 6.924)
and bondedto (attr store1 < 121.551 and attr store1 > 120.951))
6 6 0 peak 5858 volume 75419184 hpm1 121.251 ppm1 6.954 ppm2 0.364
!# peak 5859-----------------------------------------------
assi (attr store1 < 0.245 and attr store1 > 0.125)
((attr store1 < 6.985 and attr store1 > 6.925)
and bondedto (attr store1 < 121.521 and attr store1 > 120.921))
6 6 0 peak 5859 volume 78491360 hpm1 121.221 ppm1 6.955 ppm2 0.185
!# peak 5869-----------------------------------------------
assi (attr store1 < 4.336 and attr store1 > 4.216)
((attr store1 < 7.286 and attr store1 > 7.226)
and bondedto (attr store1 < 120.974 and attr store1 > 120.374))
6 6 0 peak 5869 volume 28308090 hpm1 120.674 ppm1 7.256 ppm2 4.276
!# peak 5879-----------------------------------------------
assi (attr store1 < 3.882 and attr store1 > 3.762)
((attr store1 < 7.827 and attr store1 > 7.767)
and bondedto (attr store1 < 120.916 and attr store1 > 120.316))
6 6 0 peak 5879 volume 51409928 hpm1 120.616 ppm1 7.797 ppm2 3.822
!# peak 5890-----------------------------------------------
assi (attr store1 < 2.930 and attr store1 > 2.810)
((attr store1 < 7.284 and attr store1 > 7.224)
and bondedto (attr store1 < 120.94 and attr store1 > 120.34))
6 6 0 peak 5890 volume 21801320 hpm1 120.64 ppm1 7.254 ppm2 2.870
!# peak 5905-----------------------------------------------
assi (attr store1 < 1.374 and attr store1 > 1.254)
((attr store1 < 7.828 and attr store1 > 7.768)
and bondedto (attr store1 < 120.961 and attr store1 > 120.361))
6 6 0 peak 5905 volume 83839712 hpm1 120.661 ppm1 7.798 ppm2 1.314
!# peak 5917-----------------------------------------------
assi (attr store1 < 0.284 and attr store1 > 0.164)
((attr store1 < 7.826 and attr store1 > 7.766)
and bondedto (attr store1 < 120.947 and attr store1 > 120.347))
6 6 0 peak 5917 volume 66639740 hpm1 120.647 ppm1 7.796 ppm2 0.224
!# peak 5954-----------------------------------------------
assi (attr store1 < 3.700 and attr store1 > 3.580)
((attr store1 < 7.283 and attr store1 > 7.223)
and bondedto (attr store1 < 120.671 and attr store1 > 120.071))
6 6 0 peak 5954 volume 73628936 hpm1 120.371 ppm1 7.253 ppm2 3.640
!# peak 5955-----------------------------------------------
assi (attr store1 < 3.422 and attr store1 > 3.302)
((attr store1 < 7.827 and attr store1 > 7.767)
and bondedto (attr store1 < 120.673 and attr store1 > 120.073))
6 6 0 peak 5955 volume 108725304 hpm1 120.373 ppm1 7.797 ppm2 3.362
!# peak 5956-----------------------------------------------
assi (attr store1 < 3.290 and attr store1 > 3.170)
((attr store1 < 7.285 and attr store1 > 7.225)
and bondedto (attr store1 < 120.721 and attr store1 > 120.121))
6 6 0 peak 5956 volume 35399600 hpm1 120.421 ppm1 7.255 ppm2 3.230
!# peak 5963-----------------------------------------------
assi (attr store1 < 2.608 and attr store1 > 2.488)
((attr store1 < 7.828 and attr store1 > 7.768)
and bondedto (attr store1 < 120.650 and attr store1 > 120.050))
6 6 0 peak 5963 volume 33772800 hpm1 120.350 ppm1 7.798 ppm2 2.548
!# peak 5971-----------------------------------------------
assi (attr store1 < 1.836 and attr store1 > 1.716)
((attr store1 < 7.827 and attr store1 > 7.767)
and bondedto (attr store1 < 120.670 and attr store1 > 120.070))
6 6 0 peak 5971 volume 98281128 hpm1 120.370 ppm1 7.797 ppm2 1.776
!# peak 5972-----------------------------------------------
assi (attr store1 < 1.059 and attr store1 > 0.939)
((attr store1 < 7.829 and attr store1 > 7.769)
and bondedto (attr store1 < 120.671 and attr store1 > 120.071))
6 6 0 peak 5972 volume 41286768 hpm1 120.371 ppm1 7.799 ppm2 0.999
!# peak 5974-----------------------------------------------
assi (attr store1 < 0.837 and attr store1 > 0.717)
((attr store1 < 7.285 and attr store1 > 7.225)
and bondedto (attr store1 < 120.674 and attr store1 > 120.074))
6 6 0 peak 5974 volume 110882696 hpm1 120.374 ppm1 7.255 ppm2 0.777
!# peak 6041-----------------------------------------------
assi (attr store1 < 4.648 and attr store1 > 4.528)
((attr store1 < 7.167 and attr store1 > 7.107)
and bondedto (attr store1 < 119.690 and attr store1 > 119.090))
6 6 0 peak 6041 volume 156693904 hpm1 119.390 ppm1 7.137 ppm2 4.588
!# peak 6048-----------------------------------------------
assi (attr store1 < 4.239 and attr store1 > 4.119)
((attr store1 < 6.934 and attr store1 > 6.874)
and bondedto (attr store1 < 119.648 and attr store1 > 119.048))
6 6 0 peak 6048 volume 42131160 hpm1 119.348 ppm1 6.904 ppm2 4.179
!# peak 6052-----------------------------------------------
assi (attr store1 < 3.882 and attr store1 > 3.762)
((attr store1 < 7.166 and attr store1 > 7.106)
and bondedto (attr store1 < 119.828 and attr store1 > 119.228))
6 6 0 peak 6052 volume 122067896 hpm1 119.528 ppm1 7.136 ppm2 3.822
!# peak 6055-----------------------------------------------
assi (attr store1 < 3.654 and attr store1 > 3.534)
((attr store1 < 7.165 and attr store1 > 7.105)
and bondedto (attr store1 < 119.803 and attr store1 > 119.203))
6 6 0 peak 6055 volume 193160592 hpm1 119.503 ppm1 7.135 ppm2 3.594
!# peak 6059-----------------------------------------------
assi (attr store1 < 3.426 and attr store1 > 3.306)
((attr store1 < 7.164 and attr store1 > 7.104)
and bondedto (attr store1 < 119.780 and attr store1 > 119.180))
6 6 0 peak 6059 volume 131446200 hpm1 119.480 ppm1 7.134 ppm2 3.366
!# peak 6060-----------------------------------------------
assi (attr store1 < 3.282 and attr store1 > 3.162)
((attr store1 < 6.935 and attr store1 > 6.875)
and bondedto (attr store1 < 119.605 and attr store1 > 119.005))
6 6 0 peak 6060 volume 48048880 hpm1 119.305 ppm1 6.905 ppm2 3.222
!# peak 6061-----------------------------------------------
assi (attr store1 < 2.651 and attr store1 > 2.531)
((attr store1 < 7.150 and attr store1 > 7.090)
and bondedto (attr store1 < 119.811 and attr store1 > 119.211))
6 6 0 peak 6061 volume 5655645 hpm1 119.511 ppm1 7.120 ppm2 2.591
!# peak 6073-----------------------------------------------
assi (attr store1 < 1.829 and attr store1 > 1.709)
((attr store1 < 7.151 and attr store1 > 7.091)
and bondedto (attr store1 < 119.720 and attr store1 > 119.120))
6 6 0 peak 6073 volume 25752670 hpm1 119.420 ppm1 7.121 ppm2 1.769
!# peak 6076-----------------------------------------------
assi (attr store1 < 1.747 and attr store1 > 1.627)
((attr store1 < 6.934 and attr store1 > 6.874)
and bondedto (attr store1 < 119.623 and attr store1 > 119.023))
6 6 0 peak 6076 volume 7239895 hpm1 119.323 ppm1 6.904 ppm2 1.687
!# peak 6081-----------------------------------------------
assi (attr store1 < 1.506 and attr store1 > 1.386)
((attr store1 < 7.165 and attr store1 > 7.105)
and bondedto (attr store1 < 119.852 and attr store1 > 119.252))
6 6 0 peak 6081 volume 258531088 hpm1 119.552 ppm1 7.135 ppm2 1.446
!# peak 6082-----------------------------------------------
assi (attr store1 < 1.464 and attr store1 > 1.344)
((attr store1 < 6.924 and attr store1 > 6.864)
and bondedto (attr store1 < 119.716 and attr store1 > 119.116))
6 6 0 peak 6082 volume 66602880 hpm1 119.416 ppm1 6.894 ppm2 1.404
!# peak 6086-----------------------------------------------
assi (attr store1 < 1.062 and attr store1 > 0.942)
((attr store1 < 7.164 and attr store1 > 7.104)
and bondedto (attr store1 < 119.837 and attr store1 > 119.237))
6 6 0 peak 6086 volume 108125704 hpm1 119.537 ppm1 7.134 ppm2 1.002
!# peak 6087-----------------------------------------------
assi (attr store1 < 0.836 and attr store1 > 0.716)
((attr store1 < 6.927 and attr store1 > 6.867)
and bondedto (attr store1 < 119.668 and attr store1 > 119.068))
6 6 0 peak 6087 volume 31842742 hpm1 119.368 ppm1 6.897 ppm2 0.776
!# peak 6145-----------------------------------------------
assi (attr store1 < 3.972 and attr store1 > 3.852)
((attr store1 < 6.847 and attr store1 > 6.787)
and bondedto (attr store1 < 118.794 and attr store1 > 118.194))
6 6 0 peak 6145 volume 97126208 hpm1 118.494 ppm1 6.817 ppm2 3.912
!# peak 6171-----------------------------------------------
assi (attr store1 < 3.249 and attr store1 > 3.129)
((attr store1 < 6.847 and attr store1 > 6.787)
and bondedto (attr store1 < 118.793 and attr store1 > 118.193))
6 6 0 peak 6171 volume 64954752 hpm1 118.493 ppm1 6.817 ppm2 3.189
!# peak 6172-----------------------------------------------
assi (attr store1 < 2.965 and attr store1 > 2.845)
((attr store1 < 6.833 and attr store1 > 6.773)
and bondedto (attr store1 < 118.848 and attr store1 > 118.248))
6 6 0 peak 6172 volume 27311600 hpm1 118.548 ppm1 6.803 ppm2 2.905
!# peak 6182-----------------------------------------------
assi (attr store1 < 1.652 and attr store1 > 1.532)
((attr store1 < 6.834 and attr store1 > 6.774)
and bondedto (attr store1 < 118.799 and attr store1 > 118.199))
6 6 0 peak 6182 volume 54753520 hpm1 118.499 ppm1 6.804 ppm2 1.592
!# peak 6184-----------------------------------------------
assi (attr store1 < 1.422 and attr store1 > 1.302)
((attr store1 < 6.834 and attr store1 > 6.774)
and bondedto (attr store1 < 118.846 and attr store1 > 118.246))
6 6 0 peak 6184 volume 42115448 hpm1 118.546 ppm1 6.804 ppm2 1.362
!# peak 6190-----------------------------------------------
assi (attr store1 < 0.925 and attr store1 > 0.805)
((attr store1 < 6.845 and attr store1 > 6.785)
and bondedto (attr store1 < 118.810 and attr store1 > 118.210))
6 6 0 peak 6190 volume 137641504 hpm1 118.510 ppm1 6.815 ppm2 0.865
!# peak 6194-----------------------------------------------
assi (attr store1 < 0.696 and attr store1 > 0.576)
((attr store1 < 6.835 and attr store1 > 6.775)
and bondedto (attr store1 < 118.859 and attr store1 > 118.259))
6 6 0 peak 6194 volume 43831088 hpm1 118.559 ppm1 6.805 ppm2 0.636
!# peak 6221-----------------------------------------------
assi (attr store1 < 3.703 and attr store1 > 3.583)
((attr store1 < 6.530 and attr store1 > 6.470)
and bondedto (attr store1 < 118.413 and attr store1 > 117.813))
6 6 0 peak 6221 volume 38246532 hpm1 118.113 ppm1 6.500 ppm2 3.643
!# peak 6223-----------------------------------------------
assi (attr store1 < 3.474 and attr store1 > 3.354)
((attr store1 < 6.530 and attr store1 > 6.470)
and bondedto (attr store1 < 118.35 and attr store1 > 117.75))
6 6 0 peak 6223 volume 52809412 hpm1 118.05 ppm1 6.500 ppm2 3.414
!# peak 6226-----------------------------------------------
assi (attr store1 < 3.285 and attr store1 > 3.165)
((attr store1 < 6.530 and attr store1 > 6.470)
and bondedto (attr store1 < 118.329 and attr store1 > 117.729))
6 6 0 peak 6226 volume 33573900 hpm1 118.029 ppm1 6.500 ppm2 3.225
!# peak 6230-----------------------------------------------
assi (attr store1 < 2.927 and attr store1 > 2.807)
((attr store1 < 6.529 and attr store1 > 6.469)
and bondedto (attr store1 < 118.356 and attr store1 > 117.756))
6 6 0 peak 6230 volume 45591412 hpm1 118.056 ppm1 6.499 ppm2 2.867
!# peak 6277-----------------------------------------------
assi (attr store1 < 1.423 and attr store1 > 1.303)
((attr store1 < 6.531 and attr store1 > 6.471)
and bondedto (attr store1 < 118.359 and attr store1 > 117.759))
6 6 0 peak 6277 volume 39183988 hpm1 118.059 ppm1 6.501 ppm2 1.363
!# peak 6375-----------------------------------------------
assi (attr store1 < 0.877 and attr store1 > 0.757)
((attr store1 < 6.530 and attr store1 > 6.470)
and bondedto (attr store1 < 118.152 and attr store1 > 117.552))
6 6 0 peak 6375 volume 106181600 hpm1 117.852 ppm1 6.500 ppm2 0.817
!# peak 6383-----------------------------------------------
assi (attr store1 < 0.429 and attr store1 > 0.309)
((attr store1 < 6.529 and attr store1 > 6.469)
and bondedto (attr store1 < 118.159 and attr store1 > 117.559))
6 6 0 peak 6383 volume 48629712 hpm1 117.859 ppm1 6.499 ppm2 0.369
!# peak 6384-----------------------------------------------
assi (attr store1 < 0.201 and attr store1 > 0.081)
((attr store1 < 6.531 and attr store1 > 6.471)
and bondedto (attr store1 < 118.039 and attr store1 > 117.439))
6 6 0 peak 6384 volume 29097020 hpm1 117.739 ppm1 6.501 ppm2 0.141
!# peak 6671-----------------------------------------------
assi (attr store1 < 4.160 and attr store1 > 4.040)
((attr store1 < 6.926 and attr store1 > 6.866)
and bondedto (attr store1 < 115.454 and attr store1 > 114.854))
6 6 0 peak 6671 volume 135823696 hpm1 115.154 ppm1 6.896 ppm2 4.100
!# peak 6678-----------------------------------------------
assi (attr store1 < 3.466 and attr store1 > 3.346)
((attr store1 < 6.925 and attr store1 > 6.865)
and bondedto (attr store1 < 115.440 and attr store1 > 114.840))
6 6 0 peak 6678 volume 25846070 hpm1 115.140 ppm1 6.895 ppm2 3.406
!# peak 6681-----------------------------------------------
assi (attr store1 < 2.928 and attr store1 > 2.808)
((attr store1 < 6.927 and attr store1 > 6.867)
and bondedto (attr store1 < 115.445 and attr store1 > 114.845))
6 6 0 peak 6681 volume 23896850 hpm1 115.145 ppm1 6.897 ppm2 2.868
!# peak 6683-----------------------------------------------
assi (attr store1 < 2.744 and attr store1 > 2.624)
((attr store1 < 6.924 and attr store1 > 6.864)
and bondedto (attr store1 < 115.470 and attr store1 > 114.870))
6 6 0 peak 6683 volume 18982480 hpm1 115.170 ppm1 6.894 ppm2 2.684
!# peak 6688-----------------------------------------------
assi (attr store1 < 2.248 and attr store1 > 2.128)
((attr store1 < 6.928 and attr store1 > 6.868)
and bondedto (attr store1 < 115.480 and attr store1 > 114.880))
6 6 0 peak 6688 volume 22795780 hpm1 115.180 ppm1 6.898 ppm2 2.188
!# peak 6691-----------------------------------------------
assi (attr store1 < 2.106 and attr store1 > 1.986)
((attr store1 < 6.935 and attr store1 > 6.875)
and bondedto (attr store1 < 115.437 and attr store1 > 114.837))
6 6 0 peak 6691 volume 0.2028021e+07 hpm1 115.137 ppm1 6.905 ppm2 2.046
!# peak 6695-----------------------------------------------
assi (attr store1 < 1.461 and attr store1 > 1.341)
((attr store1 < 6.929 and attr store1 > 6.869)
and bondedto (attr store1 < 115.412 and attr store1 > 114.812))
6 6 0 peak 6695 volume 1942837 hpm1 115.112 ppm1 6.899 ppm2 1.401
!# peak 6701-----------------------------------------------
assi (attr store1 < 0.565 and attr store1 > 0.445)
((attr store1 < 6.935 and attr store1 > 6.875)
and bondedto (attr store1 < 115.468 and attr store1 > 114.868))
6 6 0 peak 6701 volume 76889128 hpm1 115.168 ppm1 6.905 ppm2 0.505
!# peak 6797-----------------------------------------------
assi (attr store1 < 3.707 and attr store1 > 3.587)
((attr store1 < 7.804 and attr store1 > 7.744)
and bondedto (attr store1 < 114.534 and attr store1 > 113.934))
6 6 0 peak 6797 volume 54912136 hpm1 114.234 ppm1 7.774 ppm2 3.647
!# peak 6799-----------------------------------------------
assi (attr store1 < 3.470 and attr store1 > 3.350)
((attr store1 < 7.807 and attr store1 > 7.747)
and bondedto (attr store1 < 114.531 and attr store1 > 113.931))
6 6 0 peak 6799 volume 33870132 hpm1 114.231 ppm1 7.777 ppm2 3.410
!# peak 6818-----------------------------------------------
assi (attr store1 < 1.787 and attr store1 > 1.667)
((attr store1 < 7.805 and attr store1 > 7.745)
and bondedto (attr store1 < 114.5 and attr store1 > 113.9))
6 6 0 peak 6818 volume 57824744 hpm1 114.2 ppm1 7.775 ppm2 1.727
!# peak 6828-----------------------------------------------
assi (attr store1 < 1.511 and attr store1 > 1.391)
((attr store1 < 7.805 and attr store1 > 7.745)
and bondedto (attr store1 < 114.512 and attr store1 > 113.912))
6 6 0 peak 6828 volume 53974964 hpm1 114.212 ppm1 7.775 ppm2 1.451
!# peak 6832-----------------------------------------------
assi (attr store1 < 0.967 and attr store1 > 0.847)
((attr store1 < 7.281 and attr store1 > 7.221)
and bondedto (attr store1 < 114.507 and attr store1 > 113.907))
6 6 0 peak 6832 volume 31917950 hpm1 114.207 ppm1 7.251 ppm2 0.907
!# peak 6833-----------------------------------------------
assi (attr store1 < 0.879 and attr store1 > 0.759)
((attr store1 < 7.806 and attr store1 > 7.746)
and bondedto (attr store1 < 114.497 and attr store1 > 113.897))
6 6 0 peak 6833 volume 64734532 hpm1 114.197 ppm1 7.776 ppm2 0.819
!# peak 6837-----------------------------------------------
assi (attr store1 < 0.464 and attr store1 > 0.344)
((attr store1 < 7.804 and attr store1 > 7.744)
and bondedto (attr store1 < 114.501 and attr store1 > 113.901))
6 6 0 peak 6837 volume 57293320 hpm1 114.201 ppm1 7.774 ppm2 0.404
!# peak 6839-----------------------------------------------
assi (attr store1 < 0.148 and attr store1 > 0.028)
((attr store1 < 7.806 and attr store1 > 7.746)
and bondedto (attr store1 < 114.540 and attr store1 > 113.940))
6 6 0 peak 6839 volume 56340920 hpm1 114.240 ppm1 7.776 ppm2 0.088
!# peak 6840-----------------------------------------------
assi (attr store1 < 0.013 and attr store1 > -0.106)
((attr store1 < 7.788 and attr store1 > 7.728)
and bondedto (attr store1 < 114.523 and attr store1 > 113.923))
6 6 0 peak 6840 volume 74624992 hpm1 114.223 ppm1 7.758 ppm2 -0.046
!# peak 6943-----------------------------------------------
assi (attr store1 < 1.423 and attr store1 > 1.303)
((attr store1 < 7.279 and attr store1 > 7.219)
and bondedto (attr store1 < 114.293 and attr store1 > 113.693))
6 6 0 peak 6943 volume 51560360 hpm1 113.993 ppm1 7.249 ppm2 1.363
!# peak 6944-----------------------------------------------
assi (attr store1 < 1.428 and attr store1 > 1.308)
((attr store1 < 7.037 and attr store1 > 6.977)
and bondedto (attr store1 < 114.213 and attr store1 > 113.613))
6 6 0 peak 6944 volume 45246000 hpm1 113.913 ppm1 7.007 ppm2 1.368
!# peak 6945-----------------------------------------------
assi (attr store1 < 0.965 and attr store1 > 0.845)
((attr store1 < 7.038 and attr store1 > 6.978)
and bondedto (attr store1 < 114.220 and attr store1 > 113.620))
6 6 0 peak 6945 volume 146306496 hpm1 113.920 ppm1 7.008 ppm2 0.905
!# peak 6950-----------------------------------------------
assi (attr store1 < 0.650 and attr store1 > 0.530)
((attr store1 < 7.038 and attr store1 > 6.978)
and bondedto (attr store1 < 114.221 and attr store1 > 113.621))
6 6 0 peak 6950 volume 131288392 hpm1 113.921 ppm1 7.008 ppm2 0.590
!# peak 6961-----------------------------------------------
assi (attr store1 < -0.083 and attr store1 > -0.203)
((attr store1 < 7.039 and attr store1 > 6.979)
and bondedto (attr store1 < 114.295 and attr store1 > 113.695))
6 6 0 peak 6961 volume 2493948 hpm1 113.995 ppm1 7.009 ppm2 -0.143
!# peak 7008-----------------------------------------------
assi (attr store1 < 4.104 and attr store1 > 3.984)
((attr store1 < 7.803 and attr store1 > 7.743)
and bondedto (attr store1 < 114.304 and attr store1 > 113.704))
6 6 0 peak 7008 volume 51655632 hpm1 114.004 ppm1 7.773 ppm2 4.044
!# peak 7009-----------------------------------------------
assi (attr store1 < 3.925 and attr store1 > 3.805)
((attr store1 < 7.806 and attr store1 > 7.746)
and bondedto (attr store1 < 114.321 and attr store1 > 113.721))
6 6 0 peak 7009 volume 82633720 hpm1 114.021 ppm1 7.776 ppm2 3.865
!# peak 7011-----------------------------------------------
assi (attr store1 < 3.735 and attr store1 > 3.615)
((attr store1 < 7.804 and attr store1 > 7.744)
and bondedto (attr store1 < 114.334 and attr store1 > 113.734))
6 6 0 peak 7011 volume 61373728 hpm1 114.034 ppm1 7.774 ppm2 3.675
!# peak 7012-----------------------------------------------
assi (attr store1 < 2.511 and attr store1 > 2.391)
((attr store1 < 6.529 and attr store1 > 6.469)
and bondedto (attr store1 < 118.249 and attr store1 > 117.649))
6 6 0 peak 7012 volume 2419012 hpm1 117.949 ppm1 6.499 ppm2 2.451
!# peak 7013-----------------------------------------------
assi (attr store1 < 4.787 and attr store1 > 4.667)
((attr store1 < 6.530 and attr store1 > 6.470)
and bondedto (attr store1 < 118.337 and attr store1 > 117.737))
6 6 0 peak 7013 volume 122271296 hpm1 118.037 ppm1 6.500 ppm2 4.727
!# peak 7014-----------------------------------------------
assi (attr store1 < 2.062 and attr store1 > 1.942)
((attr store1 < 6.835 and attr store1 > 6.775)
and bondedto (attr store1 < 118.621 and attr store1 > 118.021))
6 6 0 peak 7014 volume 41309760 hpm1 118.321 ppm1 6.805 ppm2 2.002
!# peak 7015-----------------------------------------------
assi (attr store1 < 1.787 and attr store1 > 1.667)
((attr store1 < 6.847 and attr store1 > 6.787)
and bondedto (attr store1 < 118.572 and attr store1 > 117.972))
6 6 0 peak 7015 volume 69467304 hpm1 118.272 ppm1 6.817 ppm2 1.727
!# peak 7016-----------------------------------------------
assi (attr store1 < 4.470 and attr store1 > 4.350)
((attr store1 < 6.849 and attr store1 > 6.789)
and bondedto (attr store1 < 118.399 and attr store1 > 117.799))
6 6 0 peak 7016 volume 433268192 hpm1 118.099 ppm1 6.819 ppm2 4.410
!# peak 7017-----------------------------------------------
assi (attr store1 < 1.506 and attr store1 > 1.386)
((attr store1 < 7.165 and attr store1 > 7.105)
and bondedto (attr store1 < 119.852 and attr store1 > 119.252))
6 6 0 peak 7017 volume 258531088 hpm1 119.552 ppm1 7.135 ppm2 1.446
!# peak 7018-----------------------------------------------
assi (attr store1 < 1.062 and attr store1 > 0.942)
((attr store1 < 7.164 and attr store1 > 7.104)
and bondedto (attr store1 < 119.837 and attr store1 > 119.237))
6 6 0 peak 7018 volume 108125704 hpm1 119.537 ppm1 7.134 ppm2 1.002
!# peak 7019-----------------------------------------------
assi (attr store1 < 7.024 and attr store1 > 6.904)
((attr store1 < 7.826 and attr store1 > 7.766)
and bondedto (attr store1 < 121.052 and attr store1 > 120.152))
6 6 0 peak 7019 volume 172812512 hpm1 120.752 ppm1 7.796 ppm2 6.964
!# peak 7020-----------------------------------------------
assi (attr store1 < 3.885 and attr store1 > 3.765)
((attr store1 < 6.098 and attr store1 > 6.038)
and bondedto (attr store1 < 122.197 and attr store1 > 121.597))
6 6 0 peak 7020 volume 68799904 hpm1 121.897 ppm1 6.068 ppm2 3.825
!# peak 7021-----------------------------------------------
assi (attr store1 < 3.425 and attr store1 > 3.305)
((attr store1 < 6.082 and attr store1 > 6.022)
and bondedto (attr store1 < 122.222 and attr store1 > 121.622))
6 6 0 peak 7021 volume 63079768 hpm1 121.922 ppm1 6.052 ppm2 3.365
!# peak 7022-----------------------------------------------
assi (attr store1 < 2.610 and attr store1 > 2.490)
((attr store1 < 6.083 and attr store1 > 6.023)
and bondedto (attr store1 < 122.135 and attr store1 > 121.535))
6 6 0 peak 7022 volume 13912000 hpm1 121.835 ppm1 6.053 ppm2 2.550
!# peak 7023-----------------------------------------------
assi (attr store1 < 1.829 and attr store1 > 1.709)
((attr store1 < 6.082 and attr store1 > 6.022)
and bondedto (attr store1 < 122.194 and attr store1 > 121.594))
6 6 0 peak 7023 volume 13362560 hpm1 121.894 ppm1 6.052 ppm2 1.769
!# peak 7024-----------------------------------------------
assi (attr store1 < 1.469 and attr store1 > 1.349)
((attr store1 < 6.081 and attr store1 > 6.021)
and bondedto (attr store1 < 122.201 and attr store1 > 121.601))
6 6 0 peak 7024 volume 70049648 hpm1 121.901 ppm1 6.051 ppm2 1.409
!# peak 7025-----------------------------------------------
assi (attr store1 < 1.058 and attr store1 > 0.938)
((attr store1 < 6.082 and attr store1 > 6.022)
and bondedto (attr store1 < 122.167 and attr store1 > 121.567))
6 6 0 peak 7025 volume 137971200 hpm1 121.867 ppm1 6.052 ppm2 0.998
!# peak 7026-----------------------------------------------
assi (attr store1 < 0.602 and attr store1 > 0.482)
((attr store1 < 6.081 and attr store1 > 6.021)
and bondedto (attr store1 < 122.169 and attr store1 > 121.569))
6 6 0 peak 7026 volume 60072600 hpm1 121.869 ppm1 6.051 ppm2 0.542
!# peak 7027-----------------------------------------------
assi (attr store1 < 0.426 and attr store1 > 0.306)
((attr store1 < 6.084 and attr store1 > 6.024)
and bondedto (attr store1 < 122.192 and attr store1 > 121.592))
6 6 0 peak 7027 volume 51838796 hpm1 121.892 ppm1 6.054 ppm2 0.366
!# peak 7029-----------------------------------------------
assi (attr store1 < 7.201 and attr store1 > 7.081)
((attr store1 < 6.082 and attr store1 > 6.022)
and bondedto (attr store1 < 122.214 and attr store1 > 121.614))
6 6 0 peak 7029 volume 173577600 hpm1 121.914 ppm1 6.052 ppm2 7.141
!# peak 7030-----------------------------------------------
assi (attr store1 < 0.702 and attr store1 > 0.582)
((attr store1 < 6.988 and attr store1 > 6.928)
and bondedto (attr store1 < 130.864 and attr store1 > 130.264))
6 6 0 peak 7030 volume 185874800 hpm1 130.564 ppm1 6.958 ppm2 0.642
!# peak 7031-----------------------------------------------
assi (attr store1 < 0.877 and attr store1 > 0.757)
((attr store1 < 6.875 and attr store1 > 6.815)
and bondedto (attr store1 < 132.588 and attr store1 > 131.988))
6 6 0 peak 7031 volume 285730496 hpm1 132.288 ppm1 6.845 ppm2 0.817
!# peak 7032-----------------------------------------------
assi (attr store1 < 0.748 and attr store1 > 0.628)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.965 and attr store1 > 132.365))
6 6 0 peak 7032 volume 179303712 hpm1 132.665 ppm1 7.138 ppm2 0.688
!# peak 7034-----------------------------------------------
assi (attr store1 < 0.329 and attr store1 > 0.209)
((attr store1 < 7.168 and attr store1 > 7.108)
and bondedto (attr store1 < 132.964 and attr store1 > 132.364))
6 6 0 peak 7034 volume 120709200 hpm1 132.664 ppm1 7.138 ppm2 0.269
!# peak 7035-----------------------------------------------
assi (attr store1 < 2.976 and attr store1 > 2.856)
((attr store1 < 7.167 and attr store1 > 7.107)
and bondedto (attr store1 < 132.997 and attr store1 > 132.397))
6 6 0 peak 7035 volume 279750496 hpm1 132.697 ppm1 7.137 ppm2 2.916
!# peak 7036-----------------------------------------------
assi (attr store1 < 1.790 and attr store1 > 1.670)
((attr store1 < 7.103 and attr store1 > 7.043)
and bondedto (attr store1 < 133.715 and attr store1 > 133.115))
6 6 0 peak 7036 volume 153114896 hpm1 133.415 ppm1 7.073 ppm2 1.730