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26.0971069 H 25.4517021 6.09808588 24.7425404 O 25.6564236 5.06811285 23.1654663 H 25.6802368 4.21458435 23.6218338 H 26.4250660 5.07828474 22.5983448 18 Ord_Energy -45.6464653 O 22.7620087 1.38598228 26.6374340 H 22.1198902 2.10404038 26.7225208 H 22.7641106 1.14451981 25.7001095 O 25.1059685 2.65587926 27.0361748 H 24.2908001 2.12385654 26.9657135 H 25.6515331 2.23740268 27.6949425 O 23.7995377 5.01888037 26.2781868 H 24.2016048 5.81158018 26.6254997 H 24.3063202 4.27338457 26.6408329 O 23.0235004 1.09732258 23.8629742 H 23.6628094 1.82696784 23.8412933 H 23.2626801 0.519177914 23.1428967 O 21.2705517 3.78363109 26.6414394 H 20.6588840 4.02824783 25.9496155 H 22.0653229 4.31625700 26.4903660 O 24.8630276 3.17643523 24.2134113 H 25.2157898 2.83149576 25.0441628 H 24.4178066 3.98676562 24.4814034 18 Ord_Energy -45.6437302 O 26.1396866 5.39363194 24.0252628 H 26.6878681 4.78060055 23.5417767 H 25.7817917 4.90305471 24.7836170 O 24.0525990 6.94758034 26.4848156 H 24.1880512 5.99687099 26.5589294 H 23.8269138 7.09813929 25.5555706 O 23.9074173 7.10158730 23.6656952 H 24.6901989 6.53100586 23.6443329 H 24.1023502 7.83274937 23.0830288 O 26.8301697 7.23143482 26.2377701 H 26.8518028 6.80215883 25.3761921 H 25.8853722 7.34421968 26.4252243 O 27.1563339 5.09549809 27.9263363 H 27.1710587 5.92115974 27.4114571 H 27.4717388 5.32053614 28.7972069 O 25.1428070 4.17137480 26.3401775 H 24.7328091 3.37128949 26.6570148 H 25.8465843 4.39893818 26.9734268 18 Ord_Energy -45.5965805 O 24.4798527 2.52878857 24.2744637 H 25.1963482 3.09108043 24.5868721 H 23.8886509 2.43878841 25.0327492 O 21.3297825 4.75674248 25.4139252 H 20.4226036 4.49596262 25.2703609 H 21.7483692 4.01556969 25.8764858 O 23.5161247 5.13327837 23.6809216 H 23.7035198 4.18906116 23.5860043 H 22.7056465 5.17437935 24.2066383 O 25.7958031 5.10793924 25.1712780 H 24.9960117 5.26613855 24.6383057 H 26.5167217 5.52710772 24.7098236 O 22.8256893 2.70088315 26.6706581 H 22.6881428 1.95996511 27.2552128 H 23.5028553 3.26259875 27.0870857 O 24.7748623 4.35920382 27.6244049 H 25.2050037 4.66917896 26.8106594 H 24.7936058 5.09687662 28.2293587 18 Ord_Energy -45.5756760 O 23.3440819 2.32365704 24.6006241 H 23.0746250 1.41950357 24.4591293 H 23.3592129 2.45552206 25.5625629 O 25.0198231 4.93725634 27.6775589 H 24.7924252 5.44688892 26.8797283 H 25.8094482 5.33546257 28.0313263 O 21.7151070 4.66180563 25.5342712 H 21.9652328 4.02697706 24.8552837 H 21.9901962 4.23052216 26.3521404 O 25.0275803 4.26021719 23.4365749 H 24.4962749 3.52474999 23.7773705 H 25.0583000 4.14569569 22.4895992 O 23.2501411 2.91935658 27.3378792 H 23.0316277 2.52747965 28.1786995 H 23.9230976 3.60076118 27.5159130 O 24.1794872 6.11287689 25.3705750 H 24.5740318 5.60240936 24.6494694 H 23.2503681 5.84918261 25.3895149 18 Ord_Energy -45.5610428 O 25.6620083 3.04551196 24.9360046 H 25.8322029 3.41202021 25.8089066 H 24.9255829 3.57704687 24.6098347 O 23.2442741 4.70034313 24.8919315 H 22.6492405 3.92908049 24.8898277 H 22.9001656 5.31156826 24.2467480 O 24.1816177 2.14533257 28.4838505 H 23.7253284 2.23171663 29.3174610 H 24.3390388 3.04960442 28.1719437 O 21.7741547 2.42836881 24.9229145 H 21.0600376 1.86492395 24.6404743 H 22.4607868 1.83781254 25.2809086 O 23.8817215 1.03187966 25.9234276 H 23.9588699 1.25288796 26.8622856 H 24.5999069 1.51085746 25.4899139 O 24.6627674 4.65475988 27.3132820 H 24.1218872 4.73830318 26.5118008 H 24.9676971 5.53370142 27.5247440 18 Ord_Energy -45.5437164 O 25.2454643 2.78181338 24.2099838 H 25.9791088 2.88056993 24.8172321 H 24.7036610 3.57109046 24.3444424 O 23.5250473 4.98869991 24.9584656 H 23.2572937 5.68406296 24.3640079 H 22.7426300 4.42561102 25.1014977 O 24.6574287 1.99013710 28.0571880 H 24.8377762 2.91951394 27.8450890 H 24.5660248 1.95094156 29.0060005 O 21.4959297 3.25070667 25.3623524 H 22.0595531 2.46870995 25.5031586 H 20.6016922 2.92799807 25.3062115 O 23.3284874 1.27637196 25.6980858 H 23.9908066 1.58298302 25.0652199 H 23.7400913 1.38558626 26.5672417 O 25.1073399 4.62463760 27.2482567 H 25.4693890 5.45944071 27.5353966 H 24.5396748 4.82643414 26.4892197