Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Fe__MO_549900287421_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Fe Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.608429037034512 cohesive_energy=4.255447061354489 mass=55.845 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: 0.020218298721470088 Energy: 0.4654537897028075 Energy: 0.6262363976810603 Energy: 0.46539048558157536 Energy: 0.020218298723982914 Energy: 0.46545378970329293 Energy: 0.6262363976810603 Energy: 0.4368314940115547 Energy: 0.02070518291285038 Energy: 0.24702102032560763 Energy: 0.020776609566396414 Energy: 0.4368314940115547 Energy: 0.02070518291285038 Energy: 0.24702102032560763 Energy: 0.020218298721470088 Energy: 0.4654537897030359 Energy: 0.6262363976810603 Energy: 0.4653904855813184 Energy: 0.020218298723982914 Energy: 0.46545378970329293 Energy: 0.6262363976810603 Energy: 0.4368314940115547 Energy: 0.02070518291285038 Energy: 0.24702102032560763 Energy: 0.020776609566396414 Energy: 0.4368314940115547 Energy: 0.02070518291285038 Energy: 0.24702102032560763 Energy: 0.020218298721470088 Energy: 0.4654537897030359 Energy: 0.6262363976810603 Energy: 0.46539048558157536 Energy: 0.020218298723982914 Energy: 0.46545378970329293 Energy: 0.6262363976810603 Energy: 0.4368314940115547 Energy: 0.02070518291285038 Energy: 0.24702102032560763 Energy: 0.020776609566396414 Energy: 0.4368314940115547 Energy: 0.02070518291285038 Energy: 0.24702102032560763 minimum gb energy = 0.020218298721470088 eV minimum distance = 2.52805482673919 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 1.0880210908136358 Energy: 1.0075623875161288 Energy: 1.0051957646681595 Energy: 1.0266997079651419 Energy: 1.0880210908136358 Energy: 1.0075623875161288 Energy: 1.0051957646712295 Energy: 0.9577604221750003 Energy: 0.9624996352108087 Energy: 0.9986105870059107 Energy: 1.014324484289752 Energy: 0.9577604221719306 Energy: 0.9624996352108087 Energy: 0.9986105870089806 Energy: 1.0371223748459926 Energy: 1.059717557551669 Energy: 1.061730059229134 Energy: 0.9977973727603574 Energy: 1.0371223748398528 Energy: 1.059717557554739 Energy: 1.061730059232204 Energy: 1.1651267306232442 Energy: 1.0395232121105058 Energy: 1.0087760662880918 Energy: 1.0376174622609327 Energy: 1.1651267306232442 Energy: 1.0395232121105058 Energy: 1.0087760662850218 Energy: 1.1115263335813155 Energy: 1.0100720737423896 Energy: 1.0525632578326825 Energy: 0.9534615935050562 Energy: 1.1115263335843852 Energy: 1.0100720737423896 Energy: 1.0525632578296127 Energy: 1.0592566820281928 Energy: 0.990346472622798 Energy: 1.1071016382191758 Energy: 0.9870807157723448 Energy: 1.059256682022053 Energy: 0.9903464726258678 Energy: 1.1071016382222458 Energy: 1.0211694466766208 Energy: 0.9899684099079845 Energy: 1.0674284664072216 Energy: 1.0614587849180543 Energy: 1.0211694466766208 Energy: 0.9899684099049146 Energy: 1.0674284664041516 Energy: 1.0274228450904868 Energy: 1.0371704504302106 Energy: 1.0126488042403405 Energy: 1.0654522372643545 Energy: 1.0274228450935565 Energy: 1.0371704504271408 Energy: 1.0126488042372706 Energy: 1.062029603483543 Energy: 1.0946508797009327 Energy: 0.9931621740127071 Energy: 1.1334403466585965 Energy: 1.062029603483543 Energy: 1.094650879697863 Energy: 0.993162174015777 Energy: 1.1218366805086373 Energy: 0.9833974139946171 Energy: 1.044300203128099 Energy: 1.0248966979261307 Energy: 1.1218366805086373 Energy: 0.9833974139915471 Energy: 1.044300203128099 Energy: 1.0577118570392021 Energy: 1.0757430523975613 Energy: 1.0454874382560602 Energy: 1.0529135208856177 Energy: 1.0577118570361321 Energy: 1.0757430524006313 Energy: 1.0454874382622 Energy: 1.0869112861113486 Energy: 1.0514999270709215 Energy: 0.9869846167511969 Energy: 0.9570590423504648 Energy: 1.0869112861144183 Energy: 1.0514999270709215 Energy: 0.9869846167542667 Energy: 1.0828730970159768 Energy: 1.0852894290069133 Energy: 0.9926259041899907 Energy: 1.081683567533978 Energy: 1.0828730970221165 Energy: 1.0852894290007737 Energy: 0.9926259041930606 Energy: 1.0390579453630369 Energy: 1.0059447746330514 Energy: 1.1141274129133303 Energy: 1.0048386810916345 Energy: 1.0390579453661066 Energy: 1.0059447746361212 Energy: 1.1141274129071905 Energy: 1.0741895972521065 Energy: 1.0399898299263846 Energy: 1.1385679078948514 Energy: 1.015383326273504 Energy: 1.0741895972490365 Energy: 1.0399898299202446 Energy: 1.1385679078948514 Energy: 1.159402175192571 Energy: 1.0622319677822032 Energy: 1.05150892825521 Energy: 1.0517787069576425 Energy: 1.159402175192571 Energy: 1.0622319677791892 Energy: 1.05150892825828 Energy: 1.0007062499884414 Energy: 1.0815361957996792 Energy: 1.132717784809943 Energy: 1.0682859009803514 Energy: 1.0007062499884414 Energy: 1.0815361957996792 Energy: 1.132717784809943 Energy: 1.0348458709945139 Energy: 1.0659225799671468 Energy: 1.0535652784768959 Energy: 1.0134912503564255 Energy: 1.034845870991444 Energy: 1.0659225799671468 Energy: 1.0535652784768959 Energy: 1.114870902386947 Energy: 1.1098241325101885 Energy: 1.1244965716368334 Energy: 1.10235599537406 Energy: 1.1148709023900167 Energy: 1.1098241325071185 Energy: 1.1244965716337634 Energy: 1.0903228967091922 Energy: 1.0563691712962133 Energy: 0.9700241918738205 Energy: 0.9665981577095237 Energy: 1.0903228967122622 Energy: 1.0563691712931433 Energy: 0.9700241918707507 Energy: 1.0137261038869048 Energy: 0.970279225788211 Energy: 1.059302827873894 Energy: 1.0089933081675693 Energy: 1.0137261038869048 Energy: 0.9702792257851411 Energy: 1.0593028278646843 Energy: 1.0350231941880956 Energy: 1.0126333565954173 Energy: 1.0453956661833748 Energy: 1.0724138793335385 Energy: 1.0350231941880956 Energy: 1.012633356598487 Energy: 1.0453956661833748 Energy: 1.0269619577933147 Energy: 1.0343228397444513 Energy: 1.101276620522021 Energy: 0.9858737159094085 Energy: 1.0269619577933147 Energy: 1.0343228397413813 Energy: 1.101276620522021 Energy: 1.0401164635172322 Energy: 1.0150793047204618 Energy: 0.9676859529324481 Energy: 1.0109872863865312 Energy: 1.0401164635203022 Energy: 1.0150793047204618 Energy: 0.967685952935518 Energy: 1.1077295319731753 Energy: 1.007944066561806 Energy: 1.092172452977938 Energy: 1.0497399401591907 Energy: 1.1077295319731753 Energy: 1.007944066564876 Energy: 1.092172452977938 Energy: 1.0135550449450488 Energy: 1.034750965231068 Energy: 1.0063628307817944 Energy: 1.0465914295762324 Energy: 1.0135550449481188 Energy: 1.034750965231068 Energy: 1.0063628307817944 Energy: 1.0077110825874447 Energy: 1.0259967183920327 Energy: 1.0270680586154517 Energy: 0.9676478050182361 Energy: 1.0077110825843747 Energy: 1.025996718388963 Energy: 1.0270680586093117 Energy: 1.0893861220414534 Energy: 1.0089349851057536 Energy: 1.0963845567409036 Energy: 0.9547707317614624 Energy: 1.0893861220414534 Energy: 1.0089349851088234 Energy: 1.0963845567347639 Energy: 1.0842567901222628 Energy: 0.9900718159328294 Energy: 1.0951006511588464 Energy: 1.0712898510215487 Energy: 1.0842567901284024 Energy: 0.9900718159328294 Energy: 1.0951006511619161 Energy: 0.9843668592323481 Energy: 1.066188858809034 Energy: 1.1700732966997962 Energy: 1.0133294729115194 Energy: 0.9843668592323481 Energy: 1.0661888588059643 Energy: 1.1700732966936565 Energy: 1.1496809083870176 Energy: 1.0368772765394314 Energy: 1.0353623024698069 Energy: 0.9206154914547149 Energy: 1.1496809083900876 Energy: 1.0368772765363616 Energy: 1.0353623024728769 Energy: 1.0747932271767928 Energy: 0.9471332198791226 Energy: 0.9990056288115173 Energy: 0.9774822424265822 Energy: 1.0747932271798624 Energy: 0.9471332198760527 Energy: 0.9990056288084475 Energy: 1.1046232251796362 Energy: 1.0137074907438892 Energy: 1.0606188192284747 Energy: 1.035187490343443 Energy: 1.1046232251796362 Energy: 1.0137074907438892 Energy: 1.0606188192284747 Energy: 1.0208140079932095 Energy: 1.0707232911663043 Energy: 1.0017620417541897 Energy: 1.0291890415449596 Energy: 1.0208140079962795 Energy: 1.070723291172444 Energy: 1.0017620416529387 Energy: 1.0457854585020279 Energy: 1.0027591502384254 Energy: 0.9708166917273244 Energy: 0.9900423614240358 Energy: 1.0457854585020279 Energy: 1.0027591502354112 Energy: 0.9708166917303942 Energy: 1.1210713597054283 Energy: 0.9637686995429678 Energy: 1.0527630386367715 Energy: 1.0488988169918638 Energy: 1.121071359708498 Energy: 0.9637686995460376 Energy: 1.0527630386367715 Energy: 1.05640549818497 Energy: 1.0598259815500566 Energy: 1.1266140402780838 Energy: 1.0174793504308626 Energy: 1.05640549818497 Energy: 1.0598259815469868 Energy: 1.1266140402811538 Energy: 0.9737508313006032 Energy: 1.0131984413692352 Energy: 1.1083291483682407 Energy: 0.9585974118154591 Energy: 0.9737508313006032 Energy: 1.0131984413661654 Energy: 1.108329148365171 Energy: 1.045340078403462 Energy: 1.051649822309568 Energy: 1.0833071436755715 Energy: 1.0306996742559917 Energy: 1.045340078406532 Energy: 1.051649822309568 Energy: 1.0833071436725015 Energy: 1.025920559750812 Energy: 0.9825076938136701 Energy: 1.0593598099059982 Energy: 1.0918794389999127 Energy: 1.025920559747742 Energy: 0.98250769382288 Energy: 1.0593598098998585 Energy: 1.0014614244487494 Energy: 1.0821304800195346 Energy: 1.1120054335099294 Energy: 1.0813090906259166 Energy: 1.0014614244487494 Energy: 1.0821304800165206 Energy: 1.1120054335099294 Energy: 1.043932723393108 Energy: 1.079854352001843 Energy: 1.0649616261010426 Energy: 0.9949554811924616 Energy: 1.043932723393108 Energy: 1.0798543519957033 Energy: 1.0649616260979726 Energy: 1.1102521122984887 Energy: 1.075923705982825 Energy: 1.1545729304020902 Energy: 1.0543802223304592 Energy: 1.1102521123046285 Energy: 1.075923705979755 Energy: 1.1545729304051597 Energy: 1.0050393624325467 Energy: 1.012220520062456 Energy: 0.9801990713103259 Energy: 1.0299603376262518 Energy: 1.005039362426407 Energy: 1.012220520065526 Energy: 0.9801990713103259 Energy: 1.0123918719813327 Energy: 1.013886803897291 Energy: 1.11952519906944 Energy: 1.023641105253501 Energy: 1.0123918719874727 Energy: 1.0138868039003608 Energy: 1.11952519906944 Energy: 1.1284400075259677 Energy: 1.0010549124700303 Energy: 1.0683771086931475 Energy: 0.9456726399059965 Energy: 1.1284400075259677 Energy: 1.0010549124700303 Energy: 1.0683771086961615 Energy: 1.0070590484645663 Energy: 0.9757391603415952 Energy: 1.013344980464951 Energy: 1.0174361308594722 Energy: 1.0070590484645663 Energy: 0.9757391603415952 Energy: 1.013344980464951 minimum gb energy = 0.9206154914547149 eV minimum distance = 2.22422701291633 Angstroms sigma value = 401 ======================================== theta = 27.79577249602797 ======================================== Energy: 1.0837490586699985 Energy: 0.9823605728170881 Energy: 1.0935788021650321 Energy: 1.055763336998761 Energy: 1.0837490586699985 Energy: 0.9823605728205095 Energy: 1.0935788021615476 Energy: 0.978732934244493 Energy: 0.9036473448058957 Energy: 1.0742272101237018 Energy: 1.1163416496322054 Energy: 0.978732934244493 Energy: 0.9036473448058957 Energy: 1.0742272101271866 Energy: 1.0054208539986231 Energy: 1.0677273350154484 Energy: 0.883222182271124 Energy: 1.1094313509040843 Energy: 1.0054208539986231 Energy: 1.067727335018933 Energy: 0.8832221822676394 Energy: 1.126646526739719 Energy: 1.0997715830817152 Energy: 0.9109722176025726 Energy: 1.042972582746617 Energy: 1.126646526739719 Energy: 1.0997715830817152 Energy: 0.9109722176025726 Energy: 1.0552406309395268 Energy: 1.0542434660182436 Energy: 1.0825294494600508 Energy: 1.022810202709244 Energy: 1.0552406309395268 Energy: 1.0542434660182436 Energy: 1.0825294494635356 Energy: 1.0371915221856105 Energy: 1.0590160103029282 Energy: 0.9918862112037673 Energy: 1.1320991743828137 Energy: 1.0371915221856105 Energy: 1.0590160103029282 Energy: 0.9918862112002826 Energy: 1.054791683244003 Energy: 1.0787845209823828 Energy: 1.1181505525105047 Energy: 1.0257360370959627 Energy: 1.0547916832474875 Energy: 1.0787845209823828 Energy: 1.1181505525070201 Energy: 0.9427697910467326 Energy: 1.1049346571480074 Energy: 1.0864836557080106 Energy: 1.0458888088278384 Energy: 0.942769791043248 Energy: 1.1049346571480074 Energy: 1.0864836557045259 Energy: 0.9988127066274506 Energy: 1.0605637348335792 Energy: 1.081995072085282 Energy: 0.9799061750330754 Energy: 0.9988127066309354 Energy: 1.0605637348335792 Energy: 1.0819950720817972 Energy: 1.1093109681173112 Energy: 1.0547804951626911 Energy: 0.956967765329017 Energy: 0.970507733327875 Energy: 1.1093109681138267 Energy: 1.0547804951592068 Energy: 0.9569677653255325 Energy: 1.1260610630999015 Energy: 1.024012760280998 Energy: 0.9865413070603084 Energy: 0.9721612791618821 Energy: 1.1260610630999015 Energy: 1.0240127602775133 Energy: 0.9865413070637932 Energy: 0.9993557418090924 Energy: 0.9829953995931424 Energy: 1.0911894999644225 Energy: 0.9121350826879109 Energy: 0.9993557418090924 Energy: 0.9829953995896576 Energy: 1.0911894999679073 Energy: 1.0757266626237627 Energy: 1.0787562766341074 Energy: 1.064988501633882 Energy: 0.9372182137049552 Energy: 1.0757266626237627 Energy: 1.0787562766341074 Energy: 1.064988501633882 Energy: 1.1661158891646375 Energy: 0.9823605728205095 Energy: 1.10177189298111 Energy: 1.055763336998761 Energy: 1.1661158891646375 Energy: 0.9823605728205095 Energy: 1.1017718929845948 Energy: 0.978732934244493 Energy: 0.9036473448093804 Energy: 1.0899698744072965 Energy: 1.0766228595496052 Energy: 0.9787329342479777 Energy: 0.9036473448058957 Energy: 1.0899698744072965 Energy: 1.0054208539986231 Energy: 1.0677273350154484 Energy: 0.9117507943588308 Energy: 1.1094313509075688 Energy: 1.0054208539986231 Energy: 1.0677273350154484 Energy: 0.9117507943588308 Energy: 1.1266465267432035 Energy: 1.0918811228164396 Energy: 0.9109722176060573 Energy: 1.042972582746617 Energy: 1.1266465267432035 Energy: 1.0918811228164396 Energy: 0.9109722176025726 Energy: 1.0552406309395268 Energy: 1.0697921896374605 Energy: 1.0380768194448247 Energy: 1.0228102027057593 Energy: 1.0552406309430111 Energy: 1.0697921896374605 Energy: 1.0665191283123219 Energy: 1.0370481226582697 Energy: 1.0590160103029282 Energy: 0.9712232539431178 Energy: 1.1320991743828137 Energy: 1.0370481226582697 Energy: 1.0590160103029282 Energy: 0.9712232539431178 Energy: 1.0522337919973592 Energy: 1.0787845209823828 Energy: 1.085462782101841 Energy: 1.0257360370959627 Energy: 1.0522337919938745 Energy: 1.0787845209823828 Energy: 1.0854627821053258 Energy: 0.9429662974095995 Energy: 1.1049346571480074 Energy: 1.0864836557045259 Energy: 1.045723295679203 Energy: 0.942966297413084 Energy: 1.1049346571480074 Energy: 1.0864836557045259 Energy: 0.9988127066274506 Energy: 1.0605637348335792 Energy: 1.0380789316029637 Energy: 0.9799061750330754 Energy: 0.9988127066309354 Energy: 1.0605637348335792 Energy: 1.0380789316029637 Energy: 1.109310968120796 Energy: 1.0547804951592068 Energy: 1.0279162092671001 Energy: 0.970507733327875 Energy: 1.1093109681138267 Energy: 1.0547804951592068 Energy: 1.0279162092671001 Energy: 1.1260610630999015 Energy: 0.9966323757669423 Energy: 1.0388147490507316 Energy: 0.9721612791618821 Energy: 1.1260610630999015 Energy: 0.9966323757634575 Energy: 1.0388147490507316 Energy: 1.0371285734773907 Energy: 0.9829953995931424 Energy: 1.0958120927220796 Energy: 0.9121350826879109 Energy: 1.037128573473906 Energy: 0.9829953995896576 Energy: 1.0958120927220796 Energy: 1.0678981139153976 Energy: 1.0787562766341074 Energy: 1.054196279622382 Energy: 0.9372182137049552 Energy: 1.0678981139153976 Energy: 1.0787562766341074 Energy: 1.0541962796188973 Energy: 1.0837490586699985 Energy: 0.9823605728170881 Energy: 1.1104380011221415 Energy: 1.055763336998761 Energy: 1.083749058666514 Energy: 0.9823605728170881 Energy: 1.1104380011221415 Energy: 0.978732934244493 Energy: 0.9036473448093804 Energy: 1.098349293214914 Energy: 1.1163416496322054 Energy: 0.978732934244493 Energy: 0.9036473448058957 Energy: 1.098349293214914 Energy: 1.0054208539986231 Energy: 1.067727335018933 Energy: 0.8832221822676394 Energy: 1.1094313509075688 Energy: 1.0054208539986231 Energy: 1.0677273350154484 Energy: 0.8832221822676394 Energy: 1.1266465267432035 Energy: 1.0997715830817152 Energy: 0.8970343285544281 Energy: 1.042972582746617 Energy: 1.1266465267432035 Energy: 1.0997715830817152 Energy: 0.8970343285613973 Energy: 1.0552406309395268 Energy: 1.0542434660217281 Energy: 1.0749736678973987 Energy: 1.0228102027057593 Energy: 1.0552406309395268 Energy: 1.0542434660182436 Energy: 1.0749736679008834 Energy: 1.0371915221856105 Energy: 1.0590160103029282 Energy: 1.026419438014289 Energy: 1.1320991743828137 Energy: 1.037191522189095 Energy: 1.0590160103029282 Energy: 1.0264194380108043 Energy: 1.0547916832474875 Energy: 1.0787845209823828 Energy: 1.0869660251969353 Energy: 1.0257360370959627 Energy: 1.054791683244003 Energy: 1.0787845209823828 Energy: 1.1418601157612822 Energy: 0.9427697910467326 Energy: 1.1049346571480074 Energy: 1.0471724495799544 Energy: 1.045888808831323 Energy: 0.942769791043248 Energy: 1.1049346571480074 Energy: 1.0471724495764694 Energy: 0.9988127066274506 Energy: 1.0605637348335792 Energy: 1.0262280726426223 Energy: 0.9799061750330754 Energy: 0.9988127066309354 Energy: 1.0605637348335792 Energy: 1.0262280726426223 Energy: 1.1093109681173112 Energy: 1.0547804951626911 Energy: 1.0539037111796636 Energy: 0.970507733327875 Energy: 1.1093109681138267 Energy: 1.0547804951592068 Energy: 1.053903711176179 Energy: 1.1260610630999015 Energy: 1.024012760280998 Energy: 1.0388147490507316 Energy: 0.9721612791583975 Energy: 1.1260610630999015 Energy: 1.0240127602775133 Energy: 1.0388147490507316 Energy: 0.9993557418090924 Energy: 0.9829953995931424 Energy: 1.1232512980832399 Energy: 0.9121350826913955 Energy: 0.9993557418125136 Energy: 0.9829953995896576 Energy: 1.1232512980797549 Energy: 1.0757266626237627 Energy: 1.0787562766341074 Energy: 1.0541962796188973 Energy: 0.9372182137049552 Energy: 1.0757266626237627 Energy: 1.0787562766375918 Energy: 1.0541962796154127 Energy: 1.1661158891646375 Energy: 0.9823605728170881 Energy: 1.0640943322292753 Energy: 1.0557633370022454 Energy: 1.1661158891646375 Energy: 0.9823605728170881 Energy: 1.0640943322292753 Energy: 0.978732934244493 Energy: 0.9036473448093804 Energy: 1.098349293214914 Energy: 1.0766228595461207 Energy: 0.978732934244493 Energy: 0.9036473448058957 Energy: 1.098349293214914 minimum gb energy = 0.8832221822676394 eV minimum distance = 2.27041166268254 Angstroms sigma value = 311 ======================================== theta = 32.20422750397202 ======================================== Energy: 1.024597023442495 Energy: 1.1006312458418215 Energy: 1.046899810890091 Energy: 1.051593399659787 Energy: 1.0245970234416901 Energy: 1.1006312458414191 Energy: 1.046899810889689 Energy: 1.0809062513622067 Energy: 1.1593026493430396 Energy: 1.0238253896401759 Energy: 1.026087697394829 Energy: 1.0809062513618044 Energy: 1.1593026493438445 Energy: 1.023825389641383 Energy: 1.0438739238181218 Energy: 1.0409776035819926 Energy: 0.9851152671455746 Energy: 0.9549513103716989 Energy: 1.0438739238173171 Energy: 1.0409776035840046 Energy: 0.985115267145977 Energy: 0.9817534597843953 Energy: 1.0491673309334686 Energy: 0.9643549780414564 Energy: 0.9883286462846199 Energy: 0.9817534597843953 Energy: 1.0491673309322616 Energy: 0.9643549780434683 Energy: 1.032646842940336 Energy: 1.021299361027858 Energy: 0.983732238242274 Energy: 1.0019215313657475 Energy: 1.0326468429399336 Energy: 1.0212993610286627 Energy: 0.983732238242274 Energy: 0.9520957342542872 Energy: 1.0996893903727947 Energy: 1.10839764809362 Energy: 1.0452599696468885 Energy: 0.9520957342534825 Energy: 1.0996893903727947 Energy: 1.108397648092413 Energy: 0.9593480321183852 Energy: 0.9902367704947573 Energy: 1.0181226538298584 Energy: 0.9858308104715026 Energy: 0.9593480321187874 Energy: 0.9902367704963667 Energy: 1.0181226538298584 Energy: 0.9989752795990868 Energy: 1.0503518794577578 Energy: 1.2139956175210513 Energy: 1.0662686074763832 Energy: 0.9989752795966725 Energy: 1.0503518794573556 Energy: 1.213995617518235 Energy: 1.1309683414359468 Energy: 1.1281205050180965 Energy: 1.2457040211130292 Energy: 0.9392102021425931 Energy: 1.1309683414359468 Energy: 1.128120505017694 Energy: 1.2457040211142365 Energy: 1.0344761197227428 Energy: 0.9854533950490147 Energy: 0.9935924987254577 Energy: 1.003273977070099 Energy: 1.0344761197223404 Energy: 0.9854533950474053 Energy: 0.9935924987246529 Energy: 1.1960192393785354 Energy: 1.0357836441414534 Energy: 1.094720106931873 Energy: 1.0205084345951376 Energy: 1.1960192393801448 Energy: 1.0357836441414534 Energy: 1.0947201069310684 Energy: 1.0634941275498546 Energy: 1.071908399477372 Energy: 1.0384727422049076 Energy: 1.050152438880373 Energy: 1.0634941275498546 Energy: 1.0719083994769694 Energy: 1.03847274220531 Energy: 1.1220545895523728 Energy: 1.0407820411837312 Energy: 1.1680141378248072 Energy: 1.025578711100357 Energy: 1.1220545895507632 Energy: 1.0407820411829263 Energy: 1.1680141378252094 Energy: 0.9995614948609747 Energy: 1.0089596073090423 Energy: 1.0690654442704248 Energy: 0.9748445011355708 Energy: 0.9995614948625842 Energy: 1.008959607310652 Energy: 1.069065444268413 Energy: 1.1699792966254308 Energy: 1.054895598042772 Energy: 1.1289159141598093 Energy: 1.031028064713222 Energy: 1.1699792966254308 Energy: 1.0548955980419674 Energy: 1.1289159141590046 Energy: 1.034487803549025 Energy: 1.0201973140269927 Energy: 1.0294264405253313 Energy: 1.0274869784349598 Energy: 1.0344878035482203 Energy: 1.020197314027395 Energy: 1.0294264405257338 Energy: 1.1792665637406827 Energy: 1.1243849358894864 Energy: 1.0576490917220729 Energy: 0.9950329284612968 Energy: 1.1792665637406827 Energy: 1.124384935890291 Energy: 1.0576490917216703 Energy: 0.9879890398098783 Energy: 1.0312618078100377 Energy: 0.9686967381630625 Energy: 0.9790052212278474 Energy: 0.9879890398098783 Energy: 1.0312618078112448 Energy: 0.9686967381622578 Energy: 1.1233473659228697 Energy: 1.0141163340100259 Energy: 1.1159952951134984 Energy: 0.9768221160252004 Energy: 1.1233473659228697 Energy: 1.0141163340108306 Energy: 1.115995295114303 Energy: 0.95352735679196 Energy: 1.1280317474260095 Energy: 1.2459297021383733 Energy: 1.0848486288576882 Energy: 0.9535273567903504 Energy: 1.1280317474260095 Energy: 1.2459297021387759 Energy: 0.9417623257995771 Energy: 0.9948653229159057 Energy: 1.086793203676216 Energy: 1.0765749116936059 Energy: 0.9417623257995771 Energy: 0.994865322915101 Energy: 1.0867932036742043 Energy: 1.019761217820735 Energy: 1.1120433024273773 Energy: 1.091939558870649 Energy: 1.0531336968604161 Energy: 1.0197612178203324 Energy: 1.1120433024269751 Energy: 1.09193955886904 Energy: 1.0605562905321415 Energy: 0.9258927273874642 Energy: 0.9978363913307008 Energy: 0.9942218344632159 Energy: 1.0605562905329462 Energy: 0.9258927273874642 Energy: 0.997836391328689 Energy: 1.049999596137445 Energy: 1.0798568024946282 Energy: 1.1155222215964509 Energy: 1.0330036311920985 Energy: 1.0499995961366404 Energy: 1.0798568024946282 Energy: 1.115522221594439 Energy: 1.0274411649070478 Energy: 1.0329393005711744 Energy: 1.0640360657191825 Energy: 1.0301808675365745 Energy: 1.0274411649082549 Energy: 1.0329393005715768 Energy: 1.0640360657195849 Energy: 1.1820920933910082 Energy: 1.0255593180822165 Energy: 1.031439109961727 Energy: 0.9998035357988033 Energy: 1.1820920933926178 Energy: 1.0255593180818143 Energy: 1.0314391099621294 Energy: 1.0434491101993604 Energy: 1.1192867150484103 Energy: 1.0190398018887057 Energy: 1.100612591359124 Energy: 1.0434491101993604 Energy: 1.1192867150484103 Energy: 1.019039801889108 Energy: 1.1379661485613644 Energy: 1.0757553317510353 Energy: 0.9694123728465789 Energy: 1.0728970323972775 Energy: 1.1379661485601573 Energy: 1.0757553317518402 Energy: 0.9694123728469811 Energy: 1.1125661906131845 Energy: 1.01230475974927 Energy: 1.0038081748677914 Energy: 0.9848995443873736 Energy: 1.1125661906131845 Energy: 1.0123047597484653 Energy: 1.0038081748673888 Energy: 1.025167885499511 Energy: 1.1224618199502265 Energy: 0.9916115806695881 Energy: 1.0315792223981748 Energy: 1.0251678854979014 Energy: 1.1224618199510312 Energy: 0.9916115806699904 Energy: 0.9437169601019869 Energy: 1.09330856763108 Energy: 1.0116940338048341 Energy: 0.956807557579927 Energy: 0.9437169601031942 Energy: 1.09330856763108 Energy: 1.0116940338048341 Energy: 1.0180283355188853 Energy: 1.0523382780136619 Energy: 1.0884929485849495 Energy: 1.054100152219951 Energy: 1.0180283355180804 Energy: 1.0523382780152715 Energy: 1.0884929485865589 Energy: 0.9794122966764511 Energy: 1.0260593548645112 Energy: 1.045790779387085 Energy: 0.9532849069603629 Energy: 0.9794122966756464 Energy: 1.0260593548653159 Energy: 1.045790779385878 Energy: 0.952436930751708 Energy: 1.0613528666240568 Energy: 1.2452071984125803 Energy: 1.08469321017751 Energy: 0.9524369307525127 Energy: 1.0613528666244592 Energy: 1.245207198413385 Energy: 1.0735107291500345 Energy: 1.102654757235611 Energy: 1.1510549830560548 Energy: 0.9392291448943589 Energy: 1.0735107291492298 Energy: 1.1026547572340015 Energy: 1.1510549830544452 Energy: 1.0347577197151605 Energy: 1.013573641421505 Energy: 1.0306121867032998 Energy: 1.0125279874012867 Energy: 1.0347577197155629 Energy: 1.0135736414211025 Energy: 1.0306121867041045 minimum gb energy = 0.9258927273874642 eV minimum distance = 2.25148504924343 Angstroms sigma value = 39 ======================================== theta = 38.21321070173819 ======================================== Energy: 0.9521962653190945 Energy: 1.1259825964186823 Energy: 0.982677147377864 Energy: 1.1259827885483498 Energy: 0.9521962653100718 Energy: 1.1259825964201067 Energy: 0.9826771473792886 Energy: 1.0952755434448596 Energy: 1.0946546331340437 Energy: 0.7918119078627696 Energy: 1.0945124228921033 Energy: 1.095275543439636 Energy: 1.0946546331373677 Energy: 0.7918119078641941 Energy: 0.9523859533457385 Energy: 0.9528210009903263 Energy: 1.0197323641706928 Energy: 1.1287187154308556 Energy: 0.9523859533462135 Energy: 0.9528210009879519 Energy: 1.0197323641716423 Energy: 1.0973139688545925 Energy: 1.0944990670107695 Energy: 0.7919917725711189 Energy: 0.8678578071705131 Energy: 1.0973139688541178 Energy: 1.094499067005071 Energy: 0.7919917725696943 Energy: 1.1598240607268635 Energy: 1.0787920530284665 Energy: 0.910144943371256 Energy: 1.128674340519842 Energy: 1.1598240607263886 Energy: 1.0787920530275166 Energy: 0.910144943371731 Energy: 1.0965642144057663 Energy: 0.9445898356652184 Energy: 1.2741699286874106 Energy: 0.8558682092724155 Energy: 1.0965642144014924 Energy: 0.9445898356618944 Energy: 1.2741699286864612 Energy: 1.0924422833661955 Energy: 1.0788002537042336 Energy: 1.0055371502593964 Energy: 1.1291141740777755 Energy: 1.0924422833709444 Energy: 1.0788002537079895 Energy: 1.0055371502598711 Energy: 1.159634964205492 Energy: 0.9113640469765232 Energy: 1.2561040665572207 Energy: 0.9113743132055391 Energy: 1.1596349642107158 Energy: 0.9113640469788977 Energy: 1.2561040665543715 Energy: 1.0925326814116318 Energy: 1.1288847073529336 Energy: 1.0100156052893416 Energy: 1.078982040847156 Energy: 1.0925326814097323 Energy: 1.1288847073524586 Energy: 1.0100156052898166 Energy: 1.096529106261046 Energy: 0.8556643494393489 Energy: 1.2740923774220183 Energy: 0.9444069555218743 Energy: 1.0965291062629452 Energy: 0.8556643494412486 Energy: 1.2740923774205937 Energy: 1.1599192920121546 Energy: 1.1287854564373645 Energy: 0.8733829629543275 Energy: 1.0789785508485796 Energy: 1.1599192920150039 Energy: 1.1287854564354651 Energy: 0.8733829629514783 Energy: 1.097404947876581 Energy: 0.8673587308085955 Energy: 0.7919582766177402 Energy: 1.0944651600889905 Energy: 1.09740494788038 Energy: 0.8673587308085955 Energy: 0.7919582766182152 Energy: 0.9524453712112368 Energy: 1.1287280464919134 Energy: 0.9455081466918198 Energy: 0.9527564017408522 Energy: 0.9524453712126615 Energy: 1.1287280464862148 Energy: 0.9455081466875459 Energy: 1.0953399575636953 Energy: 1.094525259889203 Energy: 0.7919075253392909 Energy: 1.094643798266011 Energy: 1.0953399575608462 Energy: 1.094525259884929 Energy: 0.7919075253388161 Energy: 0.9521962653186196 Energy: 1.1259825964186823 Energy: 0.9232587552120203 Energy: 1.1259827885483498 Energy: 0.9521962653110215 Energy: 1.1259825964191572 Energy: 0.9232587552139196 Energy: 1.0952755434439099 Energy: 1.0946546331345186 Energy: 0.7918119078613449 Energy: 1.0945124228906788 Energy: 1.095275543439636 Energy: 1.0946546331378426 Energy: 0.791811907864669 Energy: 0.9523859533462135 Energy: 0.9528210009908011 Energy: 1.031969447418494 Energy: 1.1287187154308556 Energy: 0.9523859533466885 Energy: 0.9528210009870021 Energy: 1.0319694474161192 Energy: 1.0973139688550675 Energy: 1.0944990670098198 Energy: 0.7919917725711189 Energy: 0.8678578071695633 Energy: 1.0973139688522182 Energy: 1.094499067005071 Energy: 0.7919917725692194 Energy: 1.1598240607278134 Energy: 1.0787920530284665 Energy: 0.8997938009041517 Energy: 1.128674340519842 Energy: 1.1598240607263886 Energy: 1.0787920530279915 Energy: 0.9171182990778999 Energy: 1.0965642144057663 Energy: 0.9445898356647436 Energy: 1.2741699286864612 Energy: 0.8558682092733652 Energy: 1.0965642144014924 Energy: 0.9445898356623691 Energy: 1.2741699286864612 Energy: 1.0924422833685699 Energy: 1.0788002537042336 Energy: 0.9786915790355207 Energy: 1.129114174077301 Energy: 1.0924422833704694 Energy: 1.0788002537084644 Energy: 1.0787391464991156 Energy: 1.159634964205967 Energy: 0.9113640469765232 Energy: 1.256104066556271 Energy: 0.9113743132055391 Energy: 1.1596349642116657 Energy: 0.9113640469779479 Energy: 1.2561040665538965 Energy: 1.0925326814121068 Energy: 1.1288847073534083 Energy: 1.0370206431547504 Energy: 1.078982040846681 Energy: 1.0925326814087823 Energy: 1.1288847073534083 Energy: 1.0241092734857635 Energy: 1.096529106261046 Energy: 0.8556643494398237 Energy: 1.2740923774224935 Energy: 0.9444069555213994 Energy: 1.096529106264845 Energy: 0.8556643494412486 Energy: 1.2740923774205937 Energy: 1.1599192920131045 Energy: 1.1287854564364148 Energy: 0.8733829629519532 Energy: 1.0789785508490546 Energy: 1.1599192920154788 Energy: 1.12878545643594 Energy: 0.8733829629548023 Energy: 1.0974049478775307 Energy: 0.8673587308081208 Energy: 0.7919582766182152 Energy: 1.0944651600894653 Energy: 1.0974049478775307 Energy: 0.8673587308085955 Energy: 0.7919582766172654 Energy: 0.9524453712102872 Energy: 1.1287280464919134 Energy: 0.8329825166482201 Energy: 0.9527564017408522 Energy: 0.9524453712131362 Energy: 1.1287280464871645 Energy: 0.83298251664917 Energy: 1.0953399575646452 Energy: 1.094525259889203 Energy: 0.7919075253388161 Energy: 1.094643798266011 Energy: 1.0953399575603713 Energy: 1.0945252598844541 Energy: 0.7919075253397658 Energy: 0.9521962653181448 Energy: 1.1259825964191572 Energy: 0.9738201995684193 Energy: 1.1259827885492997 Energy: 0.9521962653105467 Energy: 1.1259825964196317 Energy: 0.9575348466651307 Energy: 1.0952755434448596 Energy: 1.0946546331340437 Energy: 0.7918119078627696 Energy: 1.0945124228911536 Energy: 1.095275543440111 Energy: 1.0946546331373677 Energy: 0.791811907864669 minimum gb energy = 0.7918119078613449 eV minimum distance = 2.24254671543449 Angstroms sigma value = 21 ======================================== theta = 46.82644889274107 ======================================== Energy: 1.1424168254484661 Energy: 1.084486916952693 Energy: 0.9982029379677158 Energy: 1.0845610366778735 Energy: 1.1424168254495928 Energy: 1.0844869169521165 Energy: 0.9982029379677158 Energy: 1.0340131678122573 Energy: 0.9516831273707144 Energy: 1.0034995662335264 Energy: 0.9524137484763716 Energy: 1.0340131678139606 Energy: 0.9516831273741733 Energy: 1.0034995662341029 Energy: 1.1424557507702489 Energy: 1.0017454881800258 Energy: 0.8992230920882555 Energy: 1.0141763533247934 Energy: 1.1424557507696722 Energy: 1.0017454881817556 Energy: 0.899223092088832 Energy: 1.034913578970378 Energy: 0.9517904393602185 Energy: 0.9337418933864727 Energy: 0.9579891511054784 Energy: 1.0349135789709547 Energy: 0.9517904393602185 Energy: 0.9337418933870493 Energy: 1.0269508446095006 Energy: 1.1322619573059955 Energy: 0.9684957398846138 Energy: 1.085306502764247 Energy: 1.0269508446095006 Energy: 1.132261957306572 Energy: 0.9684957398828844 Energy: 1.0353121638195828 Energy: 0.9709163136458702 Energy: 1.1805178917779326 Energy: 1.001497341758307 Energy: 1.0353121638184297 Energy: 0.9709163136452936 Energy: 1.1805178917785093 Energy: 1.142105008840472 Energy: 1.132131442309554 Energy: 0.942748425634294 Energy: 1.0285983449924343 Energy: 1.1421050088398954 Energy: 1.1321314423089777 Energy: 0.942748425634294 Energy: 1.0385124512672592 Energy: 0.9589107486217886 Energy: 1.1588590591091235 Energy: 1.00134962154542 Energy: 1.0385124512666828 Energy: 0.9589107486217886 Energy: 1.1588590591108527 Energy: 1.1421241654016796 Energy: 1.001890562685333 Energy: 1.0960877819235895 Energy: 1.1425377307928333 Energy: 1.1421241654022563 Energy: 1.0018905626859094 Energy: 1.096087781923013 Energy: 1.0460080942854872 Energy: 0.9694922304064943 Energy: 0.9977455657321709 Energy: 1.0014594835239023 Energy: 1.046008094286064 Energy: 0.9694922304070709 Energy: 0.9977455657315943 Energy: 1.1091373686802484 Energy: 1.0454392395599426 Energy: 1.0679685212290941 Energy: 0.9954467003854599 Energy: 1.1091373686819774 Energy: 1.045439239561672 Energy: 1.0679685212296703 Energy: 0.9276716522560038 Energy: 1.0365414660819146 Energy: 1.1348468625081118 Energy: 0.91328010587179 Energy: 0.9276716522554274 Energy: 1.0365414660807615 Energy: 1.1348468625081118 Energy: 1.1090679966062944 Energy: 0.9947058005007567 Energy: 0.9263286197578867 Energy: 1.0325001848509974 Energy: 1.1090679966062944 Energy: 0.9947058004996037 Energy: 0.9263286197578867 Energy: 0.9265635122469592 Energy: 1.036390053681057 Energy: 1.0551848278308018 Energy: 1.0320542483222532 Energy: 0.9265635122481123 Energy: 1.0363900536781747 Energy: 1.0551848278302254 Energy: 1.0304486174282956 Energy: 0.9953798072506543 Energy: 1.0151961829670346 Energy: 1.0315406156664026 Energy: 1.030448617428872 Energy: 0.9953798072523837 Energy: 1.0151961829676113 Energy: 0.9405647060077585 Energy: 1.121912451244568 Energy: 1.0117105327936415 Energy: 1.0435280630429271 Energy: 0.9405647060094879 Energy: 1.1219124512434149 Energy: 1.011710532794218 Energy: 1.0954335631682066 Energy: 0.995650941198005 Energy: 1.1243098542246244 Energy: 1.0317987580930934 Energy: 1.0954335631682066 Energy: 0.9956509411962755 Energy: 1.1243098542246244 Energy: 0.9408609609295489 Energy: 0.9834896906558689 Energy: 0.9997435376614914 Energy: 1.0904500275378426 Energy: 0.9408609609295489 Energy: 0.9834896906558689 Energy: 0.9997435376609148 Energy: 1.142202912002898 Energy: 0.9957497242367649 Energy: 1.1222491282267133 Energy: 0.9613267753911545 Energy: 1.1422029120011685 Energy: 0.9957497242373413 Energy: 1.1222491282272895 Energy: 0.9418899283020823 Energy: 1.0688708219884193 Energy: 1.0387483342437247 Energy: 1.0688085927810373 Energy: 0.9418899283020823 Energy: 1.0688708219889955 Energy: 1.0387483342431483 Energy: 1.142153229128306 Energy: 0.9613199206494802 Energy: 1.1264701414668816 Energy: 0.9957129534201719 Energy: 1.142153229128306 Energy: 0.9613199206506332 Energy: 1.1264701414657285 Energy: 0.9407589838348581 Energy: 1.0902818689470322 Energy: 0.9999130190767174 Energy: 0.9834202110720384 Energy: 0.9407589838337052 Energy: 1.0902818689481852 Energy: 0.999913019074988 Energy: 1.0947736168316247 Energy: 1.031903961484703 Energy: 1.1242651555793 Energy: 0.9954859448047902 Energy: 1.0947736168333542 Energy: 1.0319039614841266 Energy: 1.1242651555793 Energy: 0.9406985025052268 Energy: 1.075252972453178 Energy: 1.0116063447230703 Energy: 1.1220401428807896 Energy: 0.9406985025069562 Energy: 1.0752529724549076 Energy: 1.011606344723647 Energy: 1.0959104745795312 Energy: 1.032471602204191 Energy: 1.000449463721562 Energy: 0.995429177991884 Energy: 1.0959104745801076 Energy: 1.0324716022036144 Energy: 1.0004494637209853 minimum gb energy = 0.8992230920882555 eV minimum distance = 2.25078827646054 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 0.9767292779139599 Energy: 1.1269033864061426 Energy: 0.6560988799336909 Energy: 1.1264647406146424 Energy: 0.9767292779139599 Energy: 1.12690338640936 Energy: 0.6560988799401257 Energy: 1.0433572203463173 Energy: 1.03032688171789 Energy: 1.1099051863065506 Energy: 1.0298785593022368 Energy: 1.0433572203463173 Energy: 1.030326881714673 Energy: 1.1099051863065506 Energy: 0.9211547522741798 Energy: 0.9725431047492055 Energy: 0.963890018815122 Energy: 1.0310433832598278 Energy: 0.9211547522741798 Energy: 0.9725431047459883 Energy: 0.9638900188183394 Energy: 0.8821398511771354 Energy: 1.0308799017071861 Energy: 1.0055388929028137 Energy: 1.0084707164858604 Energy: 0.8821398511739181 Energy: 1.0308799017039687 Energy: 1.0055388929060312 Energy: 1.0198894285241138 Energy: 0.9442411068789859 Energy: 0.8705160013718107 Energy: 0.9276819997650564 Energy: 1.0198894285241138 Energy: 0.9442411068757686 Energy: 0.8705160013718107 Energy: 0.882276897199012 Energy: 0.9594372403897449 Energy: 1.0657904875896536 Energy: 0.9463627110374673 Energy: 0.8822768971957945 Energy: 0.9594372403865276 Energy: 1.0657904875864366 Energy: 0.9407387151235717 Energy: 0.951747927814296 Energy: 0.9042094507754578 Energy: 0.8579504875261109 Energy: 0.9407387152586415 Energy: 0.9517479278110788 Energy: 0.9042094507754578 Energy: 0.9234780098021286 Energy: 0.9459891252001676 Energy: 1.0957570816885513 Energy: 0.9097878917725868 Energy: 0.9234780098021286 Energy: 0.9459891252033851 Energy: 1.0957570816853341 Energy: 0.9187053800648541 Energy: 0.9542217569535976 Energy: 0.9387120739784316 Energy: 0.9458064934589803 Energy: 0.9187053800616368 Energy: 0.9542217569471628 Energy: 0.9387120739784316 Energy: 0.8671688686087051 Energy: 0.9444149165386113 Energy: 1.058696793794967 Energy: 0.885295206731639 Energy: 0.8671688686054878 Energy: 0.9444149165386113 Energy: 1.058696793794967 Energy: 0.9023266106748274 Energy: 1.0423467763000656 Energy: 0.8581100614072253 Energy: 0.945186860489778 Energy: 0.9023266106780449 Energy: 1.0423467763000656 Energy: 0.8581100614072253 Energy: 0.913788460315811 Energy: 0.9310867203710744 Energy: 1.296008644124236 Energy: 0.9452875225476324 Energy: 0.9137884603093761 Energy: 0.9310867203646983 Energy: 1.2960086441178014 Energy: 0.9381671292243745 Energy: 0.9533911899769543 Energy: 0.9434420816631465 Energy: 0.9170065256474066 Energy: 0.9381671292275918 Energy: 0.9533911899737368 Energy: 0.9434420816663638 Energy: 0.9215780660545959 Energy: 0.9051271098657282 Energy: 1.2199945329071338 Energy: 0.9786906875777855 Energy: 0.9215780660610307 Energy: 0.905127109872163 Energy: 1.2199945329039164 Energy: 0.9378433267939577 Energy: 0.9581905763014319 Energy: 1.138544957101306 Energy: 0.9374454846097323 Energy: 0.9378433267939577 Energy: 0.9581905763014319 Energy: 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0.8822914623564072 Energy: 1.0029176755629905 Energy: 0.9820554997516396 Energy: 1.015231002091864 Energy: 0.8822914623531898 Energy: 1.0029176755629905 Energy: 0.8987933969605952 Energy: 0.8839804141325646 Energy: 0.8877484559413907 Energy: 0.914395719010358 Energy: 0.8987933969573777 Energy: 0.8839804141325646 Energy: 0.8877484559735057 Energy: 1.0145204677462438 Energy: 0.8822914738696377 Energy: 0.94352767574908 Energy: 1.0353004338843237 Energy: 1.0145204677494613 Energy: 0.8822914738664205 Energy: 0.94352767574908 Energy: 0.9491434169042988 Energy: 0.9659949228364311 Energy: 0.9107832570891191 Energy: 0.9110623600189565 Energy: 0.9491434169010815 Energy: 0.9659949228428657 Energy: 0.9107832570891191 Energy: 1.0146266966191124 Energy: 1.0307512643421697 Energy: 0.9825104711558542 Energy: 1.0887980944470597 Energy: 1.0146266966191124 Energy: 1.0307512643389523 Energy: 0.9825104711590716 Energy: 0.955366554719032 Energy: 0.9920615761327314 Energy: 0.9633337743966869 Energy: 0.8999807503664402 Energy: 0.9553665547286839 Energy: 0.9920615761327314 Energy: 0.9633337744031215 Energy: 1.1492795894120271 Energy: 1.0342877141894729 Energy: 1.0398036017014538 Energy: 1.0886931276210476 Energy: 1.1492795894152443 Energy: 1.0342877141798208 Energy: 1.0398036017046712 Energy: 0.9699475039020414 Energy: 1.0914594954384171 Energy: 1.061191451518586 Energy: 0.9716742964413674 Energy: 0.969947503898824 Energy: 1.0914594954384171 Energy: 1.0611914515250207 Energy: 1.1494627906275656 Energy: 1.0342484969475854 Energy: 1.0888928393877602 Energy: 1.0886333320218966 Energy: 1.1494627906307828 Energy: 1.0342484969411505 Energy: 1.088892839394195 Energy: 0.913966000322257 Energy: 0.9927652698208259 Energy: 1.0450531537335863 Energy: 0.94099758841699 Energy: 0.9139660003190399 Energy: 0.9927652698208259 Energy: 1.0450531537303689 Energy: 0.9946276719003996 Energy: 1.0341930079075985 Energy: 0.9631152312604098 Energy: 1.089829903447106 Energy: 0.9946276718971823 Energy: 1.0341930079043813 Energy: 0.9631152312732206 Energy: 0.92931752068538 Energy: 0.9229873270420852 Energy: 0.9447289724241265 Energy: 0.9323901927306317 Energy: 0.9293175206918146 Energy: 0.9229873270356505 Energy: 0.9447289724273438 Energy: 0.9942675425019425 Energy: 0.948870315803189 Energy: 1.1047397253155933 Energy: 1.0539497180548787 Energy: 0.9942675425019425 Energy: 0.9488703158064064 Energy: 1.1047397253155933 Energy: 1.0274297385476292 Energy: 0.9223922867688605 Energy: 0.9048986603890363 Energy: 0.959559828086082 Energy: 1.0274297385476292 Energy: 0.9223922867656431 Energy: 0.904898660395471 Energy: 1.0616705657804284 Energy: 0.92404933316643 Energy: 1.0951096737028105 Energy: 1.0461497764195726 Energy: 1.0616705657804284 Energy: 0.9240493331632127 Energy: 1.0951096736995931 Energy: 1.0277571652841848 Energy: 0.933230179816693 Energy: 0.9420920060080649 Energy: 0.9327416727388504 Energy: 1.0277571652841848 Energy: 0.9332301798134754 Energy: 0.9420920060080649 Energy: 0.9835365423548124 Energy: 0.9447924448423534 Energy: 1.0034180683775393 Energy: 0.9688713731108088 Energy: 0.983536542351595 Energy: 0.9447924448391359 Energy: 1.003418068374322 Energy: 0.9338517591368624 Energy: 0.9492096314678208 Energy: 0.9870707711249674 Energy: 0.931252198047673 Energy: 0.9338517591336452 Energy: 0.9492096314678208 Energy: 0.9870707711281849 Energy: 0.9835308519621427 Energy: 0.9768475290192882 Energy: 1.2148192412893641 Energy: 1.0229381136615907 Energy: 0.9835308519685774 Energy: 0.9768475290257229 Energy: 1.2148192412893641 Energy: 0.9304968537465976 Energy: 0.908448745039675 Energy: 0.9099047799819971 Energy: 0.9587308164515724 Energy: 0.9304968537465976 Energy: 0.9084487450300228 Energy: 0.9099047799884319 Energy: 1.0462593649990726 Energy: 1.0317022160374256 Energy: 1.0471270551812581 Energy: 1.0230792003540228 Energy: 1.0462593649990726 Energy: 1.0317022160342082 Energy: 1.0471270551748237 Energy: 0.9294696437126558 Energy: 0.9617385898776644 Energy: 1.117463718517307 Energy: 0.9718431146971455 Energy: 0.9294696437126558 Energy: 0.9617385898712882 Energy: 1.117463718517307 Energy: 0.9458484396892209 Energy: 1.0317545266095305 Energy: 0.9218287800213301 Energy: 1.017234627412212 Energy: 0.9458484396827863 Energy: 1.0317545266095305 Energy: 0.9218287800277647 Energy: 1.0086680113700697 Energy: 0.9519749321741289 Energy: 1.1136859568688668 Energy: 0.9174471317892917 Energy: 1.0086680113668525 Energy: 0.9519749321709117 Energy: 1.1136859568720843 Energy: 0.8812098019682606 Energy: 1.03156083906694 Energy: 1.0133641194786092 Energy: 0.9764332078962674 Energy: 0.8812098019650433 Energy: 1.03156083906694 Energy: 1.0133641194786092 minimum gb energy = 0.6560988799336909 eV minimum distance = 2.17202899967489 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 0.9595329659720918 Energy: 0.6089118804362956 Energy: 1.3227165148590165 Energy: 0.6089118804362956 Energy: 0.9595329659713664 Energy: 0.6089118804348448 Energy: 1.3227165148698972 Energy: 0.959532965970641 Energy: 0.6089118804341194 Energy: 0.9029639689127807 Energy: 0.6089118804355702 Energy: 0.959532965970641 Energy: 0.6089118804355702 Energy: 0.9029639694152453 Energy: 0.9595329659699157 Energy: 0.6089118804355702 Energy: 0.8837716187309725 Energy: 0.6089118804341194 Energy: 0.9595329659713664 Energy: 0.6089118804355702 Energy: 0.8837716200578427 Energy: 0.9595329659713664 Energy: 0.608911880437021 Energy: 0.9496485657877577 Energy: 0.6089118804362956 Energy: 0.9595329659713664 Energy: 0.6089118804348448 Energy: 0.9496485441285017 Energy: 0.9595329659713664 Energy: 0.6089118804341194 Energy: 1.0561397056837516 Energy: 0.6089118804348448 Energy: 0.9595329659699157 Energy: 0.6089118804362956 Energy: 1.0561396507562295 Energy: 0.9595329659699157 Energy: 0.6089118804362956 Energy: 0.8451849912779833 Energy: 0.6089118804355702 Energy: 0.959532965970641 Energy: 0.6089118804362956 Energy: 0.8451850074796357 Energy: 0.9595329659713664 Energy: 0.6089118804362956 Energy: 1.2451559432026094 Energy: 0.6089118804362956 Energy: 0.9595329659728172 Energy: 0.6089118804348448 Energy: 1.2451559432069619 Energy: 0.959532965970641 Energy: 0.6089118804341194 Energy: 1.3015238287347919 Energy: 0.6089118804362956 Energy: 0.9595329659699157 Energy: 0.6089118804362956 Energy: 1.3015238287586968 Energy: 0.9595329659699157 Energy: 0.6089118804355702 Energy: 1.1928888465617344 Energy: 0.6089118804348448 Energy: 0.959532965970641 Energy: 0.6089118804362956 Energy: 1.1928888465602836 Energy: 0.959532965970641 Energy: 0.6089118804362956 Energy: 1.1376249465339168 Energy: 0.608911880437021 Energy: 0.9595329659735425 Energy: 0.6089118804355702 Energy: 1.1376249465331914 Energy: 0.9595329659713664 Energy: 0.6089118804341194 Energy: 1.122931558851182 Energy: 0.6089118804355702 Energy: 0.959532965970641 Energy: 0.6089118804362956 Energy: 1.1229315588504565 Energy: 0.9595329659699157 Energy: 0.6089118804362956 Energy: 0.914995155474703 Energy: 0.6089118804355702 Energy: 0.959532965970641 Energy: 0.6089118804362956 Energy: 0.9149934056986292 Energy: 0.9595329659713664 Energy: 0.6089118804355702 Energy: 0.9149453624943703 Energy: 0.6089118804362956 Energy: 0.9595329659735425 Energy: 0.6089118804341194 Energy: 0.9149625483666083 Energy: 0.959532965970641 Energy: 0.6089118804348448 Energy: 0.9149283949263499 Energy: 0.6089118804355702 Energy: 0.9595329659699157 Energy: 0.6089118804362956 Energy: 0.9149241852737443 Energy: 0.9595329659699157 Energy: 0.6089118804355702 Energy: 0.9149955549117458 Energy: 0.6089118804355702 Energy: 0.9595329659713664 Energy: 0.6089118804362956 Energy: 0.9149982075236508 Energy: 0.959532965970641 Energy: 0.608911880437021 Energy: 0.9149061574315702 Energy: 0.608911880437021 Energy: 0.9595329659728172 Energy: 0.6089118804348448 Energy: 0.9149146041377635 Energy: 0.9595329659713664 Energy: 0.6089118804348448 Energy: 0.9149356266927052 Energy: 0.6089118804348448 Energy: 0.9595329659699157 Energy: 0.6089118804348448 Energy: 0.9149110452228281 Energy: 0.9595329659699157 Energy: 0.6089118804362956 Energy: 0.9149502140670359 Energy: 0.6089118804355702 Energy: 0.959532965970641 Energy: 0.6089118804362956 Energy: 0.9149489615367611 Energy: 0.9595329659713664 Energy: 0.6089118804362956 Energy: 0.9149492278629526 Energy: 0.6089118804355702 Energy: 0.9595329659735425 Energy: 0.6089118804341194 Energy: 0.9149543900329902 Energy: 0.959532965970641 Energy: 0.6089118804348448 Energy: 0.9149073144500691 Energy: 0.6089118804362956 Energy: 0.959532965970641 Energy: 0.6089118804362956 Energy: 0.9149437733686792 minimum gb energy = 0.6089118804341194 eV minimum distance = 2.25727620995262 Angstroms sigma value = 23