Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987v2_Cu__MO_762798677854_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Cu Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.615000367164612 cohesive_energy=3.518260241115693 mass=63.546 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=60.0 Max. denominator: max_denominator=8 Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5 Min. number unit cell repetitions along x direction: x_repeat=1 Min. number unit cell repetitions along z direction: z_repeat=1 Min. cell height (Angstroms): min_cell_height=10.0 Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25 Isolated atom energy: 0.0 eV ======================================== theta = 0.0 ======================================== Energy: 0.016659219270071735 Energy: 1.2170660712579766 Energy: 0.9152870632069701 Energy: 0.4364613068402299 Energy: 0.016659219271067522 Energy: 1.2170660712582324 Energy: 0.9152870632069701 Energy: 0.506820740053938 Energy: 0.017234202181709003 Energy: 0.22815771148331934 Energy: 0.01726458324547593 Energy: 0.5068207400549337 Energy: 0.017234202180713216 Energy: 0.22815771148457115 Energy: 0.016659219270327794 Energy: 1.2170660712577488 Energy: 0.915287063206714 Energy: 0.43646130683971773 Energy: 0.016659219271323585 Energy: 1.2170660712582324 Energy: 0.9152870632062303 Energy: 0.506820740054194 Energy: 0.017234202181481396 Energy: 0.2281577114835469 Energy: 0.01726458324547593 Energy: 0.5068207400551897 Energy: 0.017234202180969275 Energy: 0.22815771148457115 Energy: 0.016659219270583853 Energy: 1.2170660712584886 Energy: 0.9152870632062303 Energy: 0.4364613068404859 Energy: 0.016659219271579647 Energy: 1.2170660712587447 Energy: 0.9152870632062303 Energy: 0.5068207400546777 Energy: 0.017234202181709003 Energy: 0.2281577114835469 Energy: 0.01726458324547593 Energy: 0.5068207400554458 Energy: 0.017234202180713216 Energy: 0.22815771148479877 minimum gb energy = 0.016659219270071735 eV minimum distance = 2.53460450119896 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 1.0876136886196726 Energy: 1.1089851186064137 Energy: 1.1052179484033113 Energy: 1.1083256235004426 Energy: 1.0876136886074377 Energy: 1.1089851186155901 Energy: 1.1052179484033113 Energy: 1.062353928962336 Energy: 1.0620105282688002 Energy: 1.082273260374779 Energy: 1.0801271312990766 Energy: 1.0623539289592772 Energy: 1.0620105282749177 Energy: 1.0822732603594853 Energy: 1.0396625243680806 Energy: 1.0405063799035752 Energy: 1.0874946884487626 Energy: 1.0648557160749559 Energy: 1.039662524365022 Energy: 1.0405063798882814 Energy: 1.0874946884457037 Energy: 1.1179918981022205 Energy: 1.0552557319936027 Energy: 1.0779013171950627 Energy: 1.0544998654155195 Energy: 1.117991898096103 Energy: 1.0552557319997202 Energy: 1.0779013171828276 Energy: 1.0447490387917202 Energy: 1.032294522437625 Energy: 1.079302916650244 Energy: 1.0717584658405446 Energy: 1.044749038794779 Energy: 1.03229452242539 Energy: 1.0793029166441264 Energy: 1.081660104334168 Energy: 1.084893135832994 Energy: 1.0650127720517353 Energy: 1.0536739041082699 Energy: 1.0816601043372265 Energy: 1.0848931358299354 Energy: 1.0650127720456177 Energy: 1.039514479316968 Energy: 1.0865430545143338 Energy: 1.0975677384498006 Energy: 1.0977038456216783 Energy: 1.039514479329203 Energy: 1.0865430545143338 Energy: 1.0975677384498006 Energy: 1.0370735561830338 Energy: 1.0404067152406273 Energy: 1.0959203124892865 Energy: 1.0747066435176227 Energy: 1.0370735561830338 Energy: 1.0404067152345098 Energy: 1.0959203124923451 Energy: 1.0212917560681758 Energy: 1.0507603681081246 Energy: 1.1131177164349046 Energy: 1.0463927338276626 Energy: 1.0212917560620582 Energy: 1.0507603681203037 Energy: 1.1131177164349046 Energy: 1.0490386345267817 Energy: 1.0962854980536703 Energy: 1.0723405862200985 Energy: 1.0574210664952184 Energy: 1.049038634532899 Energy: 1.0962854980475527 Energy: 1.0723405862292748 Energy: 1.0680645093461503 Energy: 1.0507541287846145 Energy: 1.0838305760701246 Energy: 1.0891010386314277 Energy: 1.068064509340033 Energy: 1.050754128790732 Energy: 1.0838305760640068 Energy: 1.0901059610591544 Energy: 1.1334630508985906 Energy: 1.0687676923275975 Energy: 1.0743636130236645 Energy: 1.0901059610622128 Energy: 1.1334630509169432 Energy: 1.0687676923184213 Energy: 1.199398399585548 Energy: 1.1087529914313639 Energy: 1.073717177855752 Energy: 1.0736105710305734 Energy: 1.1993983995916657 Energy: 1.108752991419129 Energy: 1.0737171778618695 Energy: 1.0387672001958403 Energy: 1.105471868391401 Energy: 1.0756634826789748 Energy: 1.0637558827847649 Energy: 1.038767200192782 Energy: 1.105471868382225 Energy: 1.07566348269121 Energy: 1.0603649971137485 Energy: 1.050422437455526 Energy: 1.0526613314723146 Energy: 1.0514916409678758 Energy: 1.0603649971198663 Energy: 1.0504224374524673 Energy: 1.0526613314723146 Energy: 1.0931689435247298 Energy: 1.126330246946528 Energy: 1.0677579227208767 Energy: 1.1262052247341523 Energy: 1.0931689435308474 Energy: 1.126330246946528 Energy: 1.0677579227239353 Energy: 1.075193974613538 Energy: 1.0591632844090513 Energy: 1.0976158113045682 Energy: 1.0895325890974419 Energy: 1.0751939746196557 Energy: 1.05916328441211 Energy: 1.0976158112953918 Energy: 1.04102059994835 Energy: 1.0321636722448855 Energy: 1.1122144706626007 Energy: 1.0645843601141445 Energy: 1.0410205999452915 Energy: 1.0321636722326504 Energy: 1.1122144706626007 Energy: 1.074662403373672 Energy: 1.0460992865073653 Energy: 1.1435887415205026 Energy: 1.0504382457463806 Energy: 1.0746624033797894 Energy: 1.0460992865043066 Energy: 1.1435887415143855 Energy: 1.0464232975883758 Energy: 1.0318320549678253 Energy: 1.0649230502421738 Energy: 1.0716786574099448 Energy: 1.0464232975761407 Energy: 1.0318320549525317 Energy: 1.0649230502299387 Energy: 1.0394361437070598 Energy: 1.09937939460854 Energy: 1.0659094460355683 Energy: 1.0493847705015584 Energy: 1.0394361437131774 Energy: 1.0993793946054813 Energy: 1.0659094460325094 Energy: 1.0379085796026857 Energy: 1.0783654622373873 Energy: 1.140286473884506 Energy: 1.0465460495714722 Energy: 1.0379085795904506 Energy: 1.07836546223127 Energy: 1.1402864738906233 Energy: 1.0431086728329646 Energy: 1.0407316978507029 Energy: 1.0959392395527996 Energy: 1.074247072037075 Energy: 1.0431086728360233 Energy: 1.040731697847644 Energy: 1.0959392395527996 Energy: 1.0721110760365695 Energy: 1.0663826450963887 Energy: 1.0648131125669553 Energy: 1.0862556810582908 Energy: 1.072111076030452 Energy: 1.066382645081095 Energy: 1.0648131125516616 Energy: 1.0476484337537477 Energy: 1.0970860291014783 Energy: 1.0998608738321694 Energy: 1.0499442313910685 Energy: 1.0476484337568064 Energy: 1.0970860291014783 Energy: 1.0909728036669386 Energy: 1.063047138521605 Energy: 1.0520388886403018 Energy: 1.0622466548909795 Energy: 1.1224088999200748 Energy: 1.0630471385246636 Energy: 1.0520388886403018 Energy: 1.0622466548818035 Energy: 1.0983619151264343 Energy: 1.0479863228806001 Energy: 1.0946531388442187 Energy: 1.0722682468816036 Energy: 1.0983619151233757 Energy: 1.0479863228928348 Energy: 1.094653138853395 Energy: 1.082560697092514 Energy: 1.144600794876359 Energy: 1.0990571908312363 Energy: 1.144579461637777 Energy: 1.0825606970955728 Energy: 1.1446007948733006 Energy: 1.0990571908251188 Energy: 1.0931385059202947 Energy: 1.0792793230995836 Energy: 1.0791016639668691 Energy: 1.048048019160852 Energy: 1.0931385059172358 Energy: 1.0792793231026425 Energy: 1.0791016639607516 Energy: 1.03201301937829 Energy: 1.0836700277501403 Energy: 1.113385022717573 Energy: 1.0455391112329524 Energy: 1.0320130193721724 Energy: 1.0836700277470817 Energy: 1.113385022726749 Energy: 1.0450106339885086 Energy: 1.0917535845006785 Energy: 1.1072941075041594 Energy: 1.0819789989831963 Energy: 1.04501063398545 Energy: 1.0917535845067405 Energy: 1.1072941075011005 Energy: 1.0732904346498324 Energy: 1.0685673689446957 Energy: 1.044492165718299 Energy: 1.0472451885279639 Energy: 1.073290434652891 Energy: 1.0685673689324606 Energy: 1.0444921657213577 Energy: 1.0541386859286417 Energy: 1.080402720675062 Energy: 1.0984065499638471 Energy: 1.0410209037565745 Energy: 1.0541386859194652 Energy: 1.0804027206658857 Energy: 1.09840654995773 Energy: 1.053035664803369 Energy: 1.0405273981876135 Energy: 1.1405522092735088 Energy: 1.0734320470859158 Energy: 1.05303566480031 Energy: 1.040527398190672 Energy: 1.1405522092613294 Energy: 1.0410367599517878 Energy: 1.0422775971546092 Energy: 1.0626863896108132 Energy: 1.0761553767843575 Energy: 1.0410367599548467 Energy: 1.0422775971546092 Energy: 1.0626863896199896 Energy: 1.0468912846442426 Energy: 1.0964905087965402 Energy: 1.083382664876661 Energy: 1.0572056128396237 Energy: 1.0468912846320075 Energy: 1.0964905087995989 Energy: 1.083382664876661 Energy: 1.0214053631660027 Energy: 1.050583831171933 Energy: 1.138298683225187 Energy: 1.0494237493044778 Energy: 1.021405363175179 Energy: 1.0505838311474631 Energy: 1.1382986832190691 Energy: 1.0396874671593475 Energy: 1.0608168004000536 Energy: 1.0874155973187807 Energy: 1.0709062300681191 Energy: 1.03968746715323 Energy: 1.060816800396995 Energy: 1.0874155973065456 Energy: 1.0830720914585978 Energy: 1.0865565374136843 Energy: 1.0615339146915272 Energy: 1.0743152307288402 Energy: 1.0830720914524803 Energy: 1.0865565374075667 Energy: 1.0615339146945857 Energy: 1.0992805052012982 Energy: 1.0803303018292247 Energy: 1.07246114628523 Energy: 1.0965605614254157 Energy: 1.0992805051951806 Energy: 1.0803303018384007 Energy: 1.0724611462821712 Energy: 1.102881270782833 Energy: 1.0531475172232843 Energy: 1.054462825210067 Energy: 1.0904816669363464 Energy: 1.102881270785892 Energy: 1.0531475172018727 Energy: 1.0544628252161843 Energy: 1.1034560587304305 Energy: 1.062306372459606 Energy: 1.0757082052697955 Energy: 1.0659220714125965 Energy: 1.1034560587121336 Energy: 1.0623063724443123 Energy: 1.0757082052697955 Energy: 1.1993023964041842 Energy: 1.0742625226342595 Energy: 1.07650244611468 Energy: 1.1120198464194788 Energy: 1.199302396398067 Energy: 1.0742625226434357 Energy: 1.0765024461116213 Energy: 1.0958472008336018 Energy: 1.078814920104974 Energy: 1.0701571007704638 Energy: 1.1058300700405708 Energy: 1.0958472008274844 Energy: 1.0788149200988566 Energy: 1.0701571007674051 Energy: 1.0212194676406274 Energy: 1.0478069509849042 Energy: 1.139070378430885 Energy: 1.0447716202178754 Energy: 1.0212194676345099 Energy: 1.047806950987963 Energy: 1.1390703784400613 Energy: 1.0467419313795256 Energy: 1.0976771629267228 Energy: 1.1448312014176993 Energy: 1.0810376013060015 Energy: 1.0467419313887023 Energy: 1.0976771629236641 Energy: 1.1448312014299344 Energy: 1.0212462922363204 Energy: 1.0803471527326798 Energy: 1.1021710243878944 Energy: 1.0465943702425948 Energy: 1.0212462922302032 Energy: 1.0803471527449147 Energy: 1.1021710243909533 minimum gb energy = 1.0212194676345099 eV minimum distance = 2.15695625819247 Angstroms sigma value = 401 ======================================== theta = 27.79577249602797 ======================================== Energy: 1.1231383409879467 Energy: 1.1568421745889887 Energy: 1.1153611527556269 Energy: 1.1490725823738752 Energy: 1.1231383409872526 Energy: 1.15684217458659 Energy: 1.1153611527493774 Energy: 1.0369231938897516 Energy: 1.0592850780014267 Energy: 1.1442349044195053 Energy: 1.0709600283639804 Energy: 1.0369231938824288 Energy: 1.059285078006982 Energy: 1.1442349044121825 Energy: 1.036860515404589 Energy: 1.0684684384447642 Energy: 1.0770403276656333 Energy: 1.0655995546567534 Energy: 1.036860515404589 Energy: 1.0684684384464687 Energy: 1.0770403276639287 Energy: 1.0671956143652233 Energy: 1.0856905370208367 Energy: 1.0793075430541925 Energy: 1.067931627293291 Energy: 1.0671956143603625 Energy: 1.0856905370243086 Energy: 1.0793075430608208 Energy: 1.0681033460980867 Energy: 1.071428626035204 Energy: 1.0663144591400584 Energy: 1.0798666638046315 Energy: 1.068103346105662 Energy: 1.0714286260303432 Energy: 1.0663144591407527 Energy: 1.0354802342581713 Energy: 1.0634301320126804 Energy: 1.0705975156106369 Energy: 1.093792530092417 Energy: 1.0354802342564666 Energy: 1.0634301320196247 Energy: 1.070597515606786 Energy: 1.0554996517200996 Energy: 1.0766108820549787 Energy: 1.1094935244095214 Energy: 1.0731836473585457 Energy: 1.0554996517224984 Energy: 1.0766108820629958 Energy: 1.1094935244136876 Energy: 1.0557153120212863 Energy: 1.057906257439791 Energy: 1.1266179743514824 Energy: 1.076749558303653 Energy: 1.055715312022675 Energy: 1.0579062574384024 Energy: 1.1266179743532498 Energy: 1.0352796019594228 Energy: 1.0630366179425523 Energy: 1.0989073463093235 Energy: 1.0623872941961623 Energy: 1.0352796019493222 Energy: 1.0630366179397748 Energy: 1.0989073463127954 Energy: 1.0668880552320106 Energy: 1.1213591484447332 Energy: 1.10749639503409 Energy: 1.0625989879210405 Energy: 1.0668880552379447 Energy: 1.121359148441261 Energy: 1.107496395036173 Energy: 1.0673644256148125 Energy: 1.1032981435287985 Energy: 1.1092012387297137 Energy: 1.0624307371875634 Energy: 1.0673644256220725 Energy: 1.1032981435242533 Energy: 1.099044196323059 Energy: 1.0361154930459955 Energy: 1.0688620762983267 Energy: 1.1280062253387388 Energy: 1.0695174512355365 Energy: 1.0361154930466898 Energy: 1.068862076295865 Energy: 1.1280062253387388 Energy: 1.0490195969810838 Energy: 1.0590801614853127 Energy: 1.1287337575471985 Energy: 1.1151008819848733 Energy: 1.0490195969796952 Energy: 1.0590801614843024 Energy: 1.128733757551365 Energy: 1.0509704053134805 Energy: 1.1568421745882944 Energy: 1.1153611527552483 Energy: 1.1490725823700247 Energy: 1.050970405304832 Energy: 1.1568421745875999 Energy: 1.115361152753165 Energy: 1.0369231938935393 Energy: 1.059285078002121 Energy: 1.1442349044201996 Energy: 1.116781967973742 Energy: 1.0369231938859007 Energy: 1.0592850780087495 Energy: 1.1442349044142657 Energy: 1.0368605154056618 Energy: 1.0684684384433756 Energy: 1.077040327666012 Energy: 1.0655995546553647 Energy: 1.0368605154042732 Energy: 1.0684684384464687 Energy: 1.0770403276628557 Energy: 1.0671956143627614 Energy: 1.082210118019877 Energy: 1.0793075430545713 Energy: 1.067931627292218 Energy: 1.067195614357206 Energy: 1.0822101180052945 Energy: 1.0793075430604422 Energy: 1.0681033461025686 Energy: 1.0711356316219705 Energy: 1.0663144591396796 Energy: 1.0798666638046315 Energy: 1.0681033461088183 Energy: 1.0711356316130063 Energy: 1.0663144591400584 Energy: 1.0354843163089043 Energy: 1.0634301320157737 Energy: 1.0705975156099425 Energy: 1.0937925300941216 Energy: 1.0354843163137653 Energy: 1.0634301320227177 Energy: 1.0705975156060916 Energy: 1.0554564381935498 Energy: 1.0766108820553573 Energy: 1.1094935244105315 Energy: 1.0731836473553895 Energy: 1.0554564381896991 Energy: 1.0766108820616072 Energy: 1.1094935244095214 Energy: 1.0557278116256532 Energy: 1.0579062574377078 Energy: 1.1266179743507878 Energy: 1.0767345559066739 Energy: 1.0557278116246434 Energy: 1.0579062574370135 Energy: 1.1266179743507878 Energy: 1.0352796019587283 Energy: 1.0630366179387647 Energy: 1.1041110505763392 Energy: 1.062387294197867 Energy: 1.035279601949701 Energy: 1.0630366179415425 Energy: 1.098907346316962 Energy: 1.0668880552337783 Energy: 1.1213591484454275 Energy: 1.1110180552798545 Energy: 1.0625989879217348 Energy: 1.0668880552382605 Energy: 1.1213591484405665 Energy: 1.1110180552864197 Energy: 1.0673644256137396 Energy: 1.0801497480033113 Energy: 1.1071257085576 Energy: 1.062430737189331 Energy: 1.0673644256220725 Energy: 1.0801497479945996 Energy: 1.1077705970140612 Energy: 1.0360041154593813 Energy: 1.068862076295865 Energy: 1.1196903522483732 Energy: 1.0695174512348422 Energy: 1.036004115457298 Energy: 1.0688620762944763 Energy: 1.1192750203783781 Energy: 1.037053889889467 Energy: 1.0590801614829137 Energy: 1.1237015137079946 Energy: 1.1151008819838635 Energy: 1.037053889896411 Energy: 1.059080161484618 Energy: 1.1388216465871746 Energy: 1.1231383409886413 Energy: 1.1568421745862112 Energy: 1.1140642187969871 Energy: 1.1490725823724866 Energy: 1.1231383409897144 Energy: 1.156842174582739 Energy: 1.11406421880431 Energy: 1.036923193890446 Energy: 1.0592850780018055 Energy: 1.1442349044198208 Energy: 1.0709600283625917 Energy: 1.0369231938831232 Energy: 1.059285078004583 Energy: 1.1442349044128768 Energy: 1.0368605154025057 Energy: 1.0684684384443854 Energy: 1.077040327666012 Energy: 1.0655995546557435 Energy: 1.0368605154042732 Energy: 1.0684684384454588 Energy: 1.07704032766254 Energy: 1.0671956143652233 Energy: 1.085690537020458 Energy: 1.079307543054887 Energy: 1.0679316272925965 Energy: 1.0671956143624457 Energy: 1.0856905370246244 Energy: 1.0793075430632197 Energy: 1.0681033461015588 Energy: 1.071428626036277 Energy: 1.0663144591389855 Energy: 1.079866663805326 Energy: 1.0681033461088183 Energy: 1.0714286260310375 Energy: 1.0663144591379752 Energy: 1.0354802342585498 Energy: 1.063430132016847 Energy: 1.070597515609248 Energy: 1.0937925300938058 Energy: 1.0354802342564666 Energy: 1.0634301320237909 Energy: 1.0705975156043872 Energy: 1.055499651718332 Energy: 1.0766108820563676 Energy: 1.1094935244102158 Energy: 1.0731836473599343 Energy: 1.0554996517214883 Energy: 1.0766108820609124 Energy: 1.1094935244143822 Energy: 1.055715312019203 Energy: 1.0579062574408642 Energy: 1.126617974349778 Energy: 1.0767495583054207 Energy: 1.0557153120178144 Energy: 1.0579062574401699 Energy: 1.1266179743500935 Energy: 1.0352796019608115 Energy: 1.0630366179373758 Energy: 1.1041110505784224 Energy: 1.062387294197867 Energy: 1.0352796019527943 Energy: 1.0630366179369972 Energy: 1.103341429325863 Energy: 1.0668880552330837 Energy: 1.121359148441261 Energy: 1.113183191071879 Energy: 1.0625989879210405 Energy: 1.0668880552379447 Energy: 1.1213591484370946 Energy: 1.1131831910715633 Energy: 1.0673644256095731 Energy: 1.1032981435305032 Energy: 1.107125708560062 Energy: 1.062430737193813 Energy: 1.0673644256186003 Energy: 1.1032981435246323 Energy: 1.109201238738362 Energy: 1.0361154930515508 Energy: 1.0688620762976324 Energy: 1.1196903522469845 Energy: 1.0695174512320644 Energy: 1.0361154930498464 Energy: 1.0688620762962437 Energy: 1.1192750203766106 Energy: 1.049019596980705 Energy: 1.0590801614808305 Energy: 1.1237015137052169 Energy: 1.1151008819838635 Energy: 1.049019596978306 Energy: 1.0590801614818406 Energy: 1.123701513714181 Energy: 1.0509704053114606 Energy: 1.1568421745848223 Energy: 1.114064218797366 Energy: 1.1490725823721077 Energy: 1.0509704053034432 Energy: 1.156842174584128 Energy: 1.1153611527524707 Energy: 1.0369231938897516 Energy: 1.0592850780031944 Energy: 1.1442349044177376 Energy: 1.1167819679719746 Energy: 1.0369231938807242 Energy: 1.0592850780066663 Energy: 1.1442349044121825 minimum gb energy = 1.0352796019493222 eV minimum distance = 2.1289901499692 Angstroms sigma value = 311 ======================================== theta = 32.20422750397202 ======================================== Energy: 1.128610061120099 Energy: 1.0901351355681685 Energy: 1.1912810902373476 Energy: 1.1099822113147289 Energy: 1.128610061119698 Energy: 1.0901351355697722 Energy: 1.1912810902381497 Energy: 1.1502454860513336 Energy: 1.1144434138420043 Energy: 1.1844856556635261 Energy: 1.096187407189898 Energy: 1.1502454860573474 Energy: 1.114443413839198 Energy: 1.1844856556615218 Energy: 1.1117156081329707 Energy: 1.1134087265433803 Energy: 1.180404078371627 Energy: 1.1132465006773564 Energy: 1.111715608130966 Energy: 1.1134087265425785 Energy: 1.180404078371226 Energy: 1.1324199012074718 Energy: 1.082835527142536 Energy: 1.1557229948904344 Energy: 1.0904226935005903 Energy: 1.1324199012038636 Energy: 1.0828355271417343 Energy: 1.1557229948900334 Energy: 1.1594353928542664 Energy: 1.1080436434817804 Energy: 1.2173655770691671 Energy: 1.122190291873551 Energy: 1.1594353928542664 Energy: 1.1080436434853884 Energy: 1.2173655770627525 Energy: 1.1125955124487388 Energy: 1.0974344352653334 Energy: 1.1406874833607679 Energy: 1.1204667666313615 Energy: 1.112595512445167 Energy: 1.097434435266536 Energy: 1.1406874833627725 Energy: 1.1068326371910941 Energy: 1.1795123887575492 Energy: 1.1192728389683921 Energy: 1.1036471578938565 Energy: 1.1068326371946657 Energy: 1.1795123887563466 Energy: 1.1192728389679916 Energy: 1.142778595595062 Energy: 1.083915861473513 Energy: 1.2117760441029186 Energy: 1.126972150278804 Energy: 1.1427785955938594 Energy: 1.083915861470743 Energy: 1.2117760441021168 Energy: 1.126801526100561 Energy: 1.0878108797057942 Energy: 1.1840576781208447 Energy: 1.1059594261142711 Energy: 1.126801526100561 Energy: 1.0878108797057942 Energy: 1.1840576781188403 Energy: 1.0977303451596467 Energy: 1.1241130508658042 Energy: 1.1690675387085303 Energy: 1.1251582697238403 Energy: 1.0977303451604485 Energy: 1.124113050862196 Energy: 1.169067538710535 Energy: 1.1431249735122635 Energy: 1.113215169767625 Energy: 1.156061687459831 Energy: 1.073669303410025 Energy: 1.1431249735142681 Energy: 1.1132151697684267 Energy: 1.1560616874618355 Energy: 1.124036880156247 Energy: 1.1472539507936435 Energy: 1.1479730020018943 Energy: 1.159890639401855 Energy: 1.1240368801582514 Energy: 1.1472539507912742 Energy: 1.147973002003498 Energy: 1.1269200006203124 Energy: 1.117858551931732 Energy: 1.1620587558820634 Energy: 1.09600833018777 Energy: 1.126920000617907 Energy: 1.1178585519293263 Energy: 1.162058755880059 Energy: 1.1046054488010288 Energy: 1.1086361801010027 Energy: 1.1930331853163412 Energy: 1.1257555375336539 Energy: 1.1046054488018306 Energy: 1.1086361800973945 Energy: 1.193033185313134 Energy: 1.1293140225612825 Energy: 1.0812879986935748 Energy: 1.1605882507383578 Energy: 1.0909922238611967 Energy: 1.1293140225656926 Energy: 1.0812879986951784 Energy: 1.1605882507399616 Energy: 1.1474916463650857 Energy: 1.1065074027216868 Energy: 1.1296405774990599 Energy: 1.11818932793399 Energy: 1.1474916463662883 Energy: 1.1065074027232904 Energy: 1.12964057750347 Energy: 1.1289132650145488 Energy: 1.0991769673209235 Energy: 1.1109129572917296 Energy: 1.1132248244298841 Energy: 1.1289132650129454 Energy: 1.0991769673225273 Energy: 1.1109129572905267 Energy: 1.1111977686948333 Energy: 1.1596934913127532 Energy: 1.2114788121669817 Energy: 1.1219720020905737 Energy: 1.1111977686932297 Energy: 1.159693491313956 Energy: 1.2114788121673825 Energy: 1.1021277174489648 Energy: 1.1025431047445524 Energy: 1.1665512007029122 Energy: 1.1312842422634675 Energy: 1.1021277174501676 Energy: 1.1025431047429488 Energy: 1.1665512007049168 Energy: 1.1106022885119267 Energy: 1.086564187806095 Energy: 1.1756089045659972 Energy: 1.0960133404075632 Energy: 1.1106022885099218 Energy: 1.0865641878064958 Energy: 1.1756089045684026 Energy: 1.1036381538657147 Energy: 1.1086849127136806 Energy: 1.1690683800628623 Energy: 1.1281340575114935 Energy: 1.1036381538673186 Energy: 1.1086849127172889 Energy: 1.1690683800664705 Energy: 1.107657029808511 Energy: 1.1044750270077393 Energy: 1.125710875130082 Energy: 1.0728305304001482 Energy: 1.1076570298153263 Energy: 1.1044750270061356 Energy: 1.1257108751288791 Energy: 1.129963957231257 Energy: 1.1140284381943597 Energy: 1.136087898665105 Energy: 1.145200950792137 Energy: 1.1299639572300544 Energy: 1.1140284381955625 Energy: 1.1360878986618979 Energy: 1.1058987799916626 Energy: 1.1122137720864285 Energy: 1.1804657577651774 Energy: 1.09050893692048 Energy: 1.10589877999487 Energy: 1.112213772087631 Energy: 1.180465757763173 Energy: 1.1129351091472304 Energy: 1.0955689261204564 Energy: 1.147597262367356 Energy: 1.1101104247104416 Energy: 1.1129351091460276 Energy: 1.095568926122862 Energy: 1.1415197588465906 Energy: 1.1558106530527477 Energy: 1.0898072834330943 Energy: 1.1580934114422545 Energy: 1.110528255063607 Energy: 1.1558106530535495 Energy: 1.0898072834302877 Energy: 1.1580934114422545 Energy: 1.150967201122321 Energy: 1.095807220472437 Energy: 1.179557530859799 Energy: 1.0928038622173997 Energy: 1.1509672011247267 Energy: 1.0958072204660223 Energy: 1.1795575308614028 Energy: 1.1414975885640297 Energy: 1.102022083949526 Energy: 1.1645135776141835 Energy: 1.1467807364925162 Energy: 1.1414975885588545 Energy: 1.102022083949125 Energy: 1.164513577615386 Energy: 1.104426339856274 Energy: 1.11440563956012 Energy: 1.1810982982770497 Energy: 1.1017946760599708 Energy: 1.1044263398582785 Energy: 1.1144056395633275 Energy: 1.1810982982786535 Energy: 1.1165487893837334 Energy: 1.1066404794382034 Energy: 1.1591901786599308 Energy: 1.0922420682062386 Energy: 1.1165487893861388 Energy: 1.1066404794365998 Energy: 1.1591901786599308 Energy: 1.1486605317115164 Energy: 1.1080550930423687 Energy: 1.1644850492507524 Energy: 1.1175718494885398 Energy: 1.1486605317099128 Energy: 1.1080550930451751 Energy: 1.1644850492495495 Energy: 1.0991978003451923 Energy: 1.0728117254102323 Energy: 1.1423970852541954 Energy: 1.0915218047798438 Energy: 1.0991978003435887 Energy: 1.0728117254110339 Energy: 1.1423970852533936 Energy: 1.1081255004070425 Energy: 1.1712360051989794 Energy: 1.1133804940534504 Energy: 1.114368883832994 Energy: 1.1081255004062407 Energy: 1.1712360052001822 Energy: 1.113380494051045 Energy: 1.1104824371064204 Energy: 1.1131118272670317 Energy: 1.2371936938796562 Energy: 1.1165063547094087 Energy: 1.1104824371048165 Energy: 1.113111827265829 Energy: 1.2371936938796562 Energy: 1.105185715586328 Energy: 1.155370908753885 Energy: 1.1915470415315967 Energy: 1.1320154323749227 Energy: 1.105185715591139 Energy: 1.1553709087546868 Energy: 1.1915470415292275 Energy: 1.1065162058423192 Energy: 1.1199405103300204 Energy: 1.1603412275125453 Energy: 1.1252282816334613 Energy: 1.1065162058415172 Energy: 1.1199405103296198 Energy: 1.1603412275125453 minimum gb energy = 1.0728117254102323 eV minimum distance = 2.19750108149229 Angstroms sigma value = 39 ======================================== theta = 38.21321070173819 ======================================== Energy: 1.138009133727787 Energy: 1.1040529256665015 Energy: 1.1669149740307259 Energy: 1.1003208800876185 Energy: 1.138009133721636 Energy: 1.104052925664609 Energy: 1.1669149740293063 Energy: 1.080549635061595 Energy: 1.15329038229971 Energy: 1.0199028522070779 Energy: 1.1672818188486787 Energy: 1.0805496350639607 Energy: 1.1532903823039253 Energy: 1.019902852209917 Energy: 1.0910541359287798 Energy: 1.074253004976559 Energy: 1.109070081772769 Energy: 1.0921952806165824 Energy: 1.0910541359292532 Energy: 1.074253004980344 Energy: 1.109070081763306 Energy: 1.0806221343249418 Energy: 1.1682650678555033 Energy: 1.1178788376995046 Energy: 1.1633624045089235 Energy: 1.0806221343306197 Energy: 1.168265067854557 Energy: 1.1178788376985584 Energy: 1.1598721773464997 Energy: 1.0940858152262445 Energy: 1.169615993202423 Energy: 1.1325248221324193 Energy: 1.1598721773460265 Energy: 1.0940858152210398 Energy: 1.1696159932028962 Energy: 1.0974127291772338 Energy: 1.1698157563525857 Energy: 1.1550578144712362 Energy: 1.1646409535791622 Energy: 1.0974127291706097 Energy: 1.1698157563554248 Energy: 1.1550578144721826 Energy: 1.1962375444414866 Energy: 1.0939824161530785 Energy: 1.1074082776739231 Energy: 1.130314974018406 Energy: 1.1962375444419597 Energy: 1.0939824161492933 Energy: 1.10740827767345 Energy: 1.0872038756071598 Energy: 1.16413184218734 Energy: 1.1539659828770805 Energy: 1.0248352861286611 Energy: 1.0872038756071598 Energy: 1.1641318421868667 Energy: 1.1539659828784998 Energy: 1.1951409311730463 Energy: 1.0882581194810121 Energy: 1.1397602602845038 Energy: 1.1265919573086371 Energy: 1.1951409311730463 Energy: 1.0882581194786467 Energy: 1.1397602602826113 Energy: 1.0806363521541846 Energy: 1.164409411400456 Energy: 1.1589227072377497 Energy: 1.159901950871448 Energy: 1.0806363521546578 Energy: 1.1644094113985635 Energy: 1.1589227072344377 Energy: 1.124878679686029 Energy: 1.0912584662583378 Energy: 1.1308345528702148 Energy: 1.126419642638393 Energy: 1.1248786796879218 Energy: 1.091258466258811 Energy: 1.1308345528687953 Energy: 1.0804823235879653 Energy: 1.0913182758276883 Energy: 1.0880075262145452 Energy: 1.1532734484554603 Energy: 1.0804823235846532 Energy: 1.091318275830054 Energy: 1.0880075262164377 Energy: 1.1019333617930547 Energy: 1.1085218924285438 Energy: 1.1200227477703957 Energy: 1.0357695170445407 Energy: 1.1019333617916351 Energy: 1.1085218924309097 Energy: 1.1200227477699225 Energy: 1.0711397474505562 Energy: 1.1532227928525454 Energy: 1.0198548853940836 Energy: 1.1650712178920264 Energy: 1.0711397474524487 Energy: 1.1532227928530185 Energy: 1.0198548853874594 Energy: 1.1177736065210806 Energy: 1.1040529256660283 Energy: 1.1376920046763286 Energy: 1.100320880086199 Energy: 1.1177736065225001 Energy: 1.1040529256665015 Energy: 1.1376920046758554 Energy: 1.0805496350625414 Energy: 1.1532903823016025 Energy: 1.019902852204239 Energy: 1.1672825525479655 Energy: 1.080549635064434 Energy: 1.153290382305818 Energy: 1.0199028522089706 Energy: 1.0910541359306725 Energy: 1.0762503939468366 Energy: 1.1090700817722958 Energy: 1.092195280615636 Energy: 1.091054135929726 Energy: 1.0762503939463635 Energy: 1.109070081763779 Energy: 1.080622134325415 Energy: 1.1682650678555033 Energy: 1.1178788377023436 Energy: 1.1633624045084503 Energy: 1.0806221343315658 Energy: 1.1682650678531379 Energy: 1.1178788377028168 Energy: 1.132309787369541 Energy: 1.0940858152252981 Energy: 1.169615993201477 Energy: 1.132524822131473 Energy: 1.1323097873714336 Energy: 1.0940858152200934 Energy: 1.1696159932033692 Energy: 1.1195742620052742 Energy: 1.169815756353532 Energy: 1.1550578144726558 Energy: 1.1646409535796354 Energy: 1.1195742620024351 Energy: 1.1698157563549516 Energy: 1.1550578144726558 Energy: 1.1962375444419597 Energy: 1.0939824161530785 Energy: 1.1057922660946198 Energy: 1.1303819141731053 Energy: 1.1962375444438524 Energy: 1.0939824161502396 Energy: 1.1057922660941466 Energy: 1.087203875605267 Energy: 1.0910515799772438 Energy: 1.1539659828761342 Energy: 1.0248352861300807 Energy: 1.0872038756066866 Energy: 1.0910515799781901 Energy: 1.1539659828780267 Energy: 1.1951409311706804 Energy: 1.0882581194814853 Energy: 1.112577641020253 Energy: 1.1265919573105296 Energy: 1.1951409311711536 Energy: 1.0882581194814853 Energy: 1.1125776410207262 Energy: 1.0998898351494384 Energy: 1.1644094114023487 Energy: 1.1589227072363302 Energy: 1.1599019508728676 Energy: 1.0998898351456532 Energy: 1.1644094113999828 Energy: 1.1589227072334913 Energy: 1.1248786796865022 Energy: 1.0912584662578646 Energy: 1.0809211399846077 Energy: 1.1264820831056808 Energy: 1.1248786796865022 Energy: 1.0912584662573914 Energy: 1.0809211399860272 Energy: 1.0804823235879653 Energy: 1.091318275826269 Energy: 1.0792736458634922 Energy: 1.1532734484564067 Energy: 1.0804823235865457 Energy: 1.0913182758286344 Energy: 1.0792736458644383 Energy: 1.1019333617916351 Energy: 1.1085218924271245 Energy: 1.080003464257357 Energy: 1.0357695170445407 Energy: 1.1019333617897427 Energy: 1.1085218924309097 Energy: 1.0800034642554641 Energy: 1.071139747450083 Energy: 1.1532227928530185 Energy: 1.0198548853950298 Energy: 1.1650712178929727 Energy: 1.0711397474524487 Energy: 1.1532227928534917 Energy: 1.019854885389352 Energy: 1.101896139981377 Energy: 1.1040529256641358 Energy: 1.1376920046753822 Energy: 1.1003208800876185 Energy: 1.1018961399832696 Energy: 1.1040529256622433 Energy: 1.1376920046725434 Energy: 1.080549635061122 Energy: 1.1532903823016025 Energy: 1.0199028522061317 Energy: 1.1668371894907468 Energy: 1.0805496350625414 Energy: 1.1532903823048717 Energy: 1.0199028522094438 minimum gb energy = 1.0198548853874594 eV minimum distance = 2.28897099972144 Angstroms sigma value = 21 ======================================== theta = 46.82644889274107 ======================================== Energy: 1.1292758708694917 Energy: 1.1706342203016153 Energy: 1.129452198938781 Energy: 1.1705932869841296 Energy: 1.1292758708694917 Energy: 1.1706342203039128 Energy: 1.129452198940504 Energy: 1.1471806928258865 Energy: 1.0858607145905104 Energy: 1.1632987873903284 Energy: 1.085667756119435 Energy: 1.1471806928253123 Energy: 1.0858607145876387 Energy: 1.1632987873954719 Energy: 1.1303430542532698 Energy: 1.0802667569412225 Energy: 1.0405516570465554 Energy: 1.124421683722549 Energy: 1.130343054253844 Energy: 1.080266756941797 Energy: 1.0405516570477045 Energy: 1.16363532371182 Energy: 1.086080128202722 Energy: 1.0882795346020253 Energy: 1.0878661860271392 Energy: 1.1636353237112456 Energy: 1.086080128202722 Energy: 1.088279534603174 Energy: 1.097038818582156 Energy: 1.120678675121404 Energy: 1.0689147527591087 Energy: 1.1267212163948723 Energy: 1.0970388185833049 Energy: 1.1206786751225526 Energy: 1.0689147527573857 Energy: 1.1636672483591732 Energy: 1.1034729584498473 Energy: 1.1236408125321253 Energy: 1.087944264201186 Energy: 1.1636672483568755 Energy: 1.1034729584498473 Energy: 1.1236408125315511 Energy: 1.12124297528957 Energy: 1.1177115772383441 Energy: 1.0687936300965193 Energy: 1.11793354490288 Energy: 1.1212429752872728 Energy: 1.1177115772371955 Energy: 1.0687936300953707 Energy: 1.145133602224708 Energy: 1.1186416931682674 Energy: 1.0586505873790626 Energy: 1.0891787398918764 Energy: 1.1451336022252827 Energy: 1.1186416931682674 Energy: 1.0586505873761904 Energy: 1.1212344323615406 Energy: 1.0893682566373386 Energy: 1.1819779263240544 Energy: 1.1098287775450164 Energy: 1.1212344323626895 Energy: 1.08936825663619 Energy: 1.18197792632348 Energy: 1.128708749145027 Energy: 1.1019005810645421 Energy: 1.0728600183534207 Energy: 1.0885418014241908 Energy: 1.128708749145027 Energy: 1.101900581063968 Energy: 1.0728600183568668 Energy: 1.1209592439415546 Energy: 1.1043822685829707 Energy: 1.1383264764405283 Energy: 1.098034653855047 Energy: 1.1209592439444263 Energy: 1.1043822685823963 Energy: 1.1383264764411027 Energy: 1.0603866801652433 Energy: 1.1002857952899707 Energy: 1.1159317423938282 Energy: 1.0939773599728084 Energy: 1.0603866801640944 Energy: 1.1002857952922682 Energy: 1.1159317423938282 Energy: 1.1213347984479614 Energy: 1.1007086523726615 Energy: 1.1070384299397036 Energy: 1.084947838836448 Energy: 1.1213347984496844 Energy: 1.1007086523732361 Energy: 1.10703842994315 Energy: 1.0556061088840725 Energy: 1.1032216730282758 Energy: 1.0584912294644329 Energy: 1.1027887215828758 Energy: 1.0556061088857958 Energy: 1.103221673027127 Energy: 1.058491229463284 Energy: 1.1583362123417675 Energy: 1.0726505204554342 Energy: 1.083997122621116 Energy: 1.0847621989246794 Energy: 1.158336212337747 Energy: 1.0726505204554342 Energy: 1.083997122622839 Energy: 1.0599567671385537 Energy: 1.1508332671456776 Energy: 1.060588880253048 Energy: 1.1580532349911468 Energy: 1.0599567671414258 Energy: 1.1508332671479753 Energy: 1.060588880251899 Energy: 1.1490512305021334 Energy: 1.0755376054737178 Energy: 1.1294196079111425 Energy: 1.0937864287352852 Energy: 1.1490512305004104 Energy: 1.0755376054760153 Energy: 1.1470588994650792 Energy: 1.059680574046834 Energy: 1.1152359351643915 Energy: 1.0636883543731406 Energy: 1.140180065542458 Energy: 1.0596805740491315 Energy: 1.1152359351626686 Energy: 1.063688354373715 Energy: 1.1406136672510625 Energy: 1.0730444146103586 Energy: 1.1412249290191159 Energy: 1.0878518841164264 Energy: 1.1406136672481906 Energy: 1.0730444146132303 Energy: 1.1412249290191159 Energy: 1.065030106030696 Energy: 1.1221418556933178 Energy: 1.0167290309518073 Energy: 1.1221419085898725 Energy: 1.0650301060324192 Energy: 1.1221418556927436 Energy: 1.0167290309529562 Energy: 1.1406214731283504 Energy: 1.0878536142471593 Energy: 1.136884366350998 Energy: 1.0730596701644721 Energy: 1.1406214731294992 Energy: 1.0878536142494568 Energy: 1.1368843663521468 Energy: 1.059694316596819 Energy: 1.1401498176866396 Energy: 1.0636866534186602 Energy: 1.1150770269092733 Energy: 1.0596943165979675 Energy: 1.1401498176854907 Energy: 1.0636866534192349 Energy: 1.1490479560121578 Energy: 1.0938650444903266 Energy: 1.0896230852543214 Energy: 1.0754761059509363 Energy: 1.1490479560115834 Energy: 1.0938650444874547 Energy: 1.089623085252598 Energy: 1.0599290965001378 Energy: 1.158027450377688 Energy: 1.0599195143471227 Energy: 1.1508456931602888 Energy: 1.0599290965018608 Energy: 1.1580274503759647 Energy: 1.059919514348846 Energy: 1.1584111026911625 Energy: 1.0934848908397583 Energy: 1.1899932249879899 Energy: 1.072662879093284 Energy: 1.1584111026928854 Energy: 1.093484890838035 Energy: 1.1899932249885645 minimum gb energy = 1.0167290309518073 eV minimum distance = 2.13012528874861 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 1.1083843708615784 Energy: 1.1303673486718933 Energy: 1.1245609690697693 Energy: 1.1321225968260702 Energy: 1.1083843708519616 Energy: 1.1303673486847161 Energy: 1.1245609690665634 Energy: 1.136352766466484 Energy: 1.1042386525880779 Energy: 1.030339037322408 Energy: 1.1042267317458392 Energy: 1.136352766466484 Energy: 1.1042386525912837 Energy: 1.0303390373288193 Energy: 1.1105923264442454 Energy: 1.0972051977780901 Energy: 1.1398122061238285 Energy: 1.088911196408403 Energy: 1.1105923264410398 Energy: 1.0972051977780901 Energy: 1.1398122061270342 Energy: 1.0502943793068438 Energy: 1.093659183466565 Energy: 1.0206979691734466 Energy: 1.1045154782143758 Energy: 1.0502943793100492 Energy: 1.0936591834633596 Energy: 1.0206979691670353 Energy: 1.131398682764436 Energy: 1.032171030066535 Energy: 1.086346937489679 Energy: 1.042973519127037 Energy: 1.1313986827772586 Energy: 1.032171030066535 Energy: 1.0863469374864734 Energy: 1.0498621619577153 Energy: 1.053448302322677 Energy: 1.0942535488120393 Energy: 1.0566546426946137 Energy: 1.0498621619545097 Energy: 1.0534483023386472 Energy: 1.0942535488056278 Energy: 1.0815141426451245 Energy: 1.032401315379316 Energy: 1.1396989722497695 Energy: 1.0393403367000176 Energy: 1.0815141426451245 Energy: 1.0324013153985496 Energy: 1.1396989722497695 Energy: 1.0466689483945162 Energy: 1.0501077564128796 Energy: 1.1602568857419733 Energy: 1.0498631447568667 Energy: 1.0466689483816936 Energy: 1.0501077564192909 Energy: 1.1602568857419733 Energy: 1.0814681833712954 Energy: 1.03733835026285 Energy: 1.0887229078387821 Energy: 1.041174291666017 Energy: 1.0814681833777067 Energy: 1.0373383502660556 Energy: 1.0887229078451934 Energy: 1.0416384872777305 Energy: 1.0498651744365264 Energy: 1.065062191273879 Energy: 1.0716921404537694 Energy: 1.0416384872649076 Energy: 1.0498651744301153 Energy: 1.0650621912834959 Energy: 1.0841866472482313 Energy: 1.0620997822684721 Energy: 1.0627483285306496 Energy: 1.0412766481850715 Energy: 1.084186647245026 Energy: 1.0620997822684721 Energy: 1.062748328537061 Energy: 1.0417799230763738 Energy: 1.0465402841684261 Energy: 1.0864438451511167 Energy: 1.0479227066352126 Energy: 1.0417799230731681 Energy: 1.0465402841684261 Energy: 1.0864438451511167 Energy: 1.112310795572424 Energy: 1.0525735385501542 Energy: 1.055597484333685 Energy: 1.044498850134777 Energy: 1.1123107955532485 Energy: 1.0525735385437431 Energy: 1.0555974843208626 Energy: 1.1164988850218445 Energy: 1.0965575271536512 Energy: 1.0742476344283725 Energy: 1.061609551476074 Energy: 1.1164988850218445 Energy: 1.0965575271408285 Energy: 1.0742476344059328 Energy: 1.1123748790450163 Energy: 1.0467660960903562 Energy: 1.0999672800595433 Energy: 1.1110208595556221 Energy: 1.1123748790546335 Energy: 1.0467660960999732 Energy: 1.0999672800563376 Energy: 1.1182271211914034 Energy: 1.0465779545595781 Energy: 1.052718033834593 Energy: 1.0495889093651911 Energy: 1.1182271211817862 Energy: 1.0465779545691951 Energy: 1.0527180338442095 Energy: 1.1266676903873174 Energy: 1.052634051385755 Energy: 1.1656858207527898 Energy: 1.044726322983388 Energy: 1.1266676904033457 Energy: 1.0526340513985775 Energy: 1.1656858207495842 Energy: 1.0419397365669263 Energy: 1.0449983198979638 Energy: 1.0288085253008705 Energy: 1.0586870525926804 Energy: 1.0419397365637204 Energy: 1.0449983198915525 Energy: 1.0288085253008705 Energy: 1.1265182499951232 Energy: 1.0594624880739985 Energy: 1.0736463857858416 Energy: 1.055931840461189 Energy: 1.1265182499919175 Energy: 1.0594624880675874 Energy: 1.0736463857986058 Energy: 1.0426918064432198 Energy: 1.0317426336443944 Energy: 1.0350023264917634 Energy: 1.0463798040894816 Energy: 1.0426918064400144 Energy: 1.0317426336476 Energy: 1.0350023264981747 Energy: 1.0925147381922555 Energy: 1.039021572221446 Energy: 1.0991056931744014 Energy: 1.1163008782637607 Energy: 1.0925147381922555 Energy: 1.0390215722246516 Energy: 1.0991056931647845 Energy: 1.0427010594924344 Energy: 1.0296014774753668 Energy: 1.0641980112384832 Energy: 1.0450007790207254 Energy: 1.0427010594892288 Energy: 1.029601477472161 Energy: 1.0641980112352774 Energy: 1.0923155191543377 Energy: 1.0371617220035756 Energy: 1.0866118605293082 Energy: 1.0888569925599512 Energy: 1.0923155191639546 Energy: 1.037161722009987 Energy: 1.086611860542131 Energy: 1.056002453531446 Energy: 1.034505982229031 Energy: 1.0441870820624493 Energy: 1.0449968109691585 Energy: 1.056002453541063 Energy: 1.0345059822258253 Energy: 1.0441870820752719 Energy: 1.0943943373930798 Energy: 1.0913427333747951 Energy: 1.0980420204370793 Energy: 1.128910949820405 Energy: 1.0943943373994909 Energy: 1.0913427333683838 Energy: 1.098042020440285 Energy: 1.0701634679994638 Energy: 1.0885170406520324 Energy: 1.100939320589021 Energy: 1.0376067903144972 Energy: 1.0701634680058751 Energy: 1.0885170406520324 Energy: 1.1009393205954325 Energy: 1.1731180937653185 Energy: 1.0914169485869407 Energy: 1.0802857856529728 Energy: 1.130630678450414 Energy: 1.1731180937589072 Energy: 1.091416948583735 Energy: 1.08028578566259 Energy: 1.070628079537659 Energy: 1.1382261026384275 Energy: 1.091360648420407 Energy: 1.0877287870858385 Energy: 1.0706280795408645 Energy: 1.138226102644839 Energy: 1.0913606484268181 Energy: 1.1742548204687648 Energy: 1.0917344957229562 Energy: 1.085582080754165 Energy: 1.1296814530205554 Energy: 1.174254820446325 Energy: 1.0917344957325732 Energy: 1.0855820807477536 Energy: 1.0704862347347692 Energy: 1.0800655571627458 Energy: 1.1099745298795032 Energy: 1.0279510866565276 Energy: 1.0704862347379749 Energy: 1.0800655571755684 Energy: 1.1099745298827088 Energy: 1.0883484636571648 Energy: 1.0993343051888829 Energy: 1.155190685724448 Energy: 1.1301710825780984 Energy: 1.0883484636475478 Energy: 1.0993343051856772 Energy: 1.155190685724448 Energy: 1.0658319088518144 Energy: 1.0347153338492985 Energy: 1.0505599926962959 Energy: 1.0452686782372662 Energy: 1.0658319088486088 Energy: 1.034715333846093 Energy: 1.0505599926803257 Energy: 1.0881603792708794 Energy: 1.0601556088687847 Energy: 1.1643525469507627 Energy: 1.0876195195212177 Energy: 1.088160379264468 Energy: 1.0601556088591677 Energy: 1.1643525469507627 Energy: 1.0696260665761648 Energy: 1.0342815790002846 Energy: 1.0812207260381839 Energy: 1.0443734461463663 Energy: 1.069626066582576 Energy: 1.034281578993873 Energy: 1.0812207260413895 Energy: 1.0732219198329713 Energy: 1.0544556671529715 Energy: 1.1388838905844278 Energy: 1.0855218770238992 Energy: 1.0732219198393824 Energy: 1.0544556671369432 Energy: 1.1388838905748109 Energy: 1.0698234860720908 Energy: 1.0452320715127212 Energy: 1.0944418261648359 Energy: 1.045190901745556 Energy: 1.0698234860752962 Energy: 1.0452320715063097 Energy: 1.094441826155219 Energy: 1.071899181020066 Energy: 1.046940566722559 Energy: 1.099245481498579 Energy: 1.088012562639805 Energy: 1.0718991810232716 Energy: 1.046940566722559 Energy: 1.099245481508196 Energy: 1.0744964376782449 Energy: 1.0466428275499566 Energy: 1.0763453127616045 Energy: 1.0449780908931243 Energy: 1.0744964376654225 Energy: 1.046642827543545 Energy: 1.0763453127551932 Energy: 1.07104124940864 Energy: 1.0844991727883118 Energy: 1.0991508397610108 Energy: 1.0899788725367365 Energy: 1.0710412494054344 Energy: 1.0844991727883118 Energy: 1.0991508397610108 Energy: 1.0784218219662305 Energy: 1.0912095559118984 Energy: 1.0485087083059716 Energy: 1.090731393931038 Energy: 1.078421821963025 Energy: 1.0912095559086927 Energy: 1.0485087082963547 Energy: 1.1339879432582498 Energy: 1.085731695174087 Energy: 1.0984783046714752 Energy: 1.09014544549119 Energy: 1.133987943255044 Energy: 1.0857316951708813 Energy: 1.0984783046714752 Energy: 1.0783186265116942 Energy: 1.1068764901169044 Energy: 1.162658777982941 Energy: 1.1117976969858896 Energy: 1.0783186265084885 Energy: 1.1068764901136985 Energy: 1.162658777982941 Energy: 1.124055618594161 Energy: 1.0858484550404894 Energy: 1.1509399202947803 Energy: 1.0899480295808779 Energy: 1.124055618594161 Energy: 1.0858484550501064 Energy: 1.1509399202947803 Energy: 1.0708256279868729 Energy: 1.0825698890201947 Energy: 1.16284112884305 Energy: 1.0769090699349908 Energy: 1.070825627977256 Energy: 1.0825698890201947 Energy: 1.16284112884305 Energy: 1.0426954061425153 Energy: 1.0854021555234814 Energy: 1.1112595766416287 Energy: 1.101097821347007 Energy: 1.0426954061425153 Energy: 1.0854021555170699 Energy: 1.1112595766384232 minimum gb energy = 1.0206979691670353 eV minimum distance = 2.1699615711304 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 1.0090398833579013 Energy: 0.9129537498727693 Energy: 1.160867433332464 Energy: 0.9129537498706013 Energy: 1.0090398833521192 Energy: 0.912953749871324 Energy: 1.160867433332464 Energy: 1.0090398833571788 Energy: 0.9129537498698784 Energy: 1.2994489886641631 Energy: 0.9129537498698784 Energy: 1.0090398833579013 Energy: 0.9129537498684329 Energy: 1.2994489886612721 Energy: 1.0090398833564558 Energy: 0.9129537498698784 Energy: 1.1608674333396913 Energy: 0.9129537498691557 Energy: 1.0090398833571788 Energy: 0.912953749871324 Energy: 1.160867433344028 Energy: 1.0090398833586243 Energy: 0.912953749871324 Energy: 1.1463411843915268 Energy: 0.9129537498698784 Energy: 1.0090398833528422 Energy: 0.9129537498698784 Energy: 1.1463411843893583 Energy: 1.0090398833557332 Energy: 0.9129537498706013 Energy: 1.1608674333454736 Energy: 0.912953749871324 Energy: 1.0090398833564558 Energy: 0.9129537498691557 Energy: 1.1608674333483646 Energy: 1.0090398833586243 Energy: 0.9129537498677102 Energy: 1.146341184390081 Energy: 0.9129537498684329 Energy: 1.0090398833586243 Energy: 0.9129537498698784 Energy: 1.1463411843915268 Energy: 1.0090398833579013 Energy: 0.9129537498720467 Energy: 1.0771858919301396 Energy: 0.912953749871324 Energy: 1.0090398833521192 Energy: 0.9129537498706013 Energy: 1.0771858919294168 Energy: 1.0090398833579013 Energy: 0.9129537498698784 Energy: 1.146341184390081 Energy: 0.9129537498706013 Energy: 1.0090398833586243 Energy: 0.9129537498677102 Energy: 1.1463411843893583 Energy: 1.0090398833571788 Energy: 0.9129537498698784 Energy: 1.0771858919294168 Energy: 0.9129537498691557 Energy: 1.0090398833564558 Energy: 0.912953749871324 Energy: 1.0771858919301396 Energy: 1.0090398833579013 Energy: 0.9129537498720467 Energy: 0.9972717362642817 Energy: 0.9129537498698784 Energy: 1.0090398833528422 Energy: 0.9129537498698784 Energy: 0.9972717362686182 Energy: 1.0090398833564558 Energy: 0.9129537498698784 Energy: 1.0771858919294168 Energy: 0.9129537498720467 Energy: 1.0090398833564558 Energy: 0.9129537498684329 Energy: 1.0771858919308623 Energy: 1.0090398833579013 Energy: 0.9129537498691557 Energy: 0.9972717362686182 Energy: 0.9129537498691557 Energy: 1.009039883359347 Energy: 0.9129537498698784 Energy: 0.9972717362621134 Energy: 1.0090398833564558 Energy: 0.9129537498720467 Energy: 0.9972717362642817 Energy: 0.9129537498706013 Energy: 1.0090398833513965 Energy: 0.9129537498706013 Energy: 0.9972717362678954 Energy: 1.0090398833571788 Energy: 0.9129537498698784 Energy: 0.9972717362635589 Energy: 0.912953749871324 Energy: 1.0090398833579013 Energy: 0.9129537498684329 Energy: 0.9972717362642817 Energy: 1.0090398833571788 Energy: 0.9129537498706013 Energy: 0.9972717362678954 Energy: 0.9129537498691557 Energy: 1.0090398833571788 Energy: 0.912953749871324 Energy: 0.9972717362621134 Energy: 1.0090398833586243 Energy: 0.9129537498720467 Energy: 0.9972717362628362 Energy: 0.9129537498706013 Energy: 1.0090398833528422 Energy: 0.9129537498698784 Energy: 0.9972717362686182 Energy: 1.0090398833557332 Energy: 0.9129537498706013 Energy: 0.9972717362642817 Energy: 0.9129537498720467 Energy: 1.0090398833564558 Energy: 0.9129537498691557 Energy: 0.9972717362635589 Energy: 1.0090398833579013 Energy: 0.9129537498698784 Energy: 0.9972717362678954 Energy: 0.9129537498698784 Energy: 1.0090398833586243 Energy: 0.9129537498706013 Energy: 0.9972717362621134 Energy: 1.0090398833564558 Energy: 0.9129537498727693 Energy: 0.9972717362628362 Energy: 0.912953749871324 Energy: 1.0090398833513965 Energy: 0.9129537498698784 Energy: 0.9972717362678954 Energy: 1.0090398833571788 Energy: 0.9129537498698784 Energy: 0.9972717362642817 Energy: 0.912953749871324 Energy: 1.0090398833579013 Energy: 0.9129537498691557 Energy: 0.9972717362642817 minimum gb energy = 0.9129537498677102 eV minimum distance = 2.30614518430433 Angstroms sigma value = 23