Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000 a1: a1=[-1, 1, 0] a2: a2=[0, 0, 1] a3: a3=[1, 1, 0] Species: species=Cu Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.614960163831712 cohesive_energy=3.540273359443754 mass=63.546 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=180.0 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: 0.013696098913339606 Energy: 0.569047887675429 Energy: 0.013696098913339606 Energy: 0.569047887674523 Energy: 0.013696098913339606 Energy: 0.5690478876742094 Energy: 0.5690478876742094 Energy: 0.334671686961149 Energy: 0.569047887674523 Energy: 0.334671686961149 Energy: 0.569047887674523 Energy: 0.334671686961149 Energy: 0.01369609891302599 Energy: 0.569047887674523 Energy: 0.013696098913339606 Energy: 0.569047887674523 Energy: 0.013696098913339606 Energy: 0.5690478876748019 Energy: 0.5690478876742094 Energy: 0.334671686961149 Energy: 0.5690478876748019 Energy: 0.334671686961149 Energy: 0.5690478876748019 Energy: 0.334671686961149 Energy: 0.013696098913339606 Energy: 0.569047887674523 Energy: 0.013696098913339606 Energy: 0.5690478876748019 Energy: 0.013696098913653221 Energy: 0.569047887674523 Energy: 0.5690478876742094 Energy: 0.334671686961149 Energy: 0.569047887674523 Energy: 0.334671686961149 Energy: 0.5690478876742094 Energy: 0.334671686961149 minimum gb energy = 0.01369609891302599 eV minimum distance = 2.5286118307398 Angstroms sigma value = 1 ======================================== theta = 20.049975724151484 ======================================== Energy: 0.810409608912606 Energy: 0.7694470796816707 Energy: 0.8104096089118513 Energy: 0.7694470796816707 Energy: 0.8104096089118513 Energy: 0.7694470796824256 Energy: 0.8772958723587001 Energy: 0.7228114636273517 Energy: 0.877295872359455 Energy: 0.7228114636273517 Energy: 0.8772958723602101 Energy: 0.7228114636273517 Energy: 0.8073985694588721 Energy: 0.7977445888513104 Energy: 0.8073985694581173 Energy: 0.79774458885433 Energy: 0.8073985694581173 Energy: 0.7977445888505555 Energy: 0.7823307011328513 Energy: 0.7567317274135806 Energy: 0.7823307009789183 Energy: 0.7567317274135806 Energy: 0.7823307011856607 Energy: 0.7567317274135806 Energy: 0.7894225324081767 Energy: 0.8388322680149902 Energy: 0.7894225324059119 Energy: 0.8388322680149902 Energy: 0.7894225324081767 Energy: 0.838832268014235 Energy: 0.8188821653889228 Energy: 0.7443744403621877 Energy: 0.8188821653896776 Energy: 0.7443744403621877 Energy: 0.8188821653889228 Energy: 0.7443744403621877 Energy: 0.7770308857124084 Energy: 0.8009304907375694 Energy: 0.7770308857139183 Energy: 0.800930490733795 Energy: 0.7770308857093887 Energy: 0.8009304907383243 Energy: 0.7559209136948349 Energy: 0.8574238249823923 Energy: 0.7559209136940799 Energy: 0.8574238249839021 Energy: 0.7559209136955898 Energy: 0.857423824977863 Energy: 0.8246928044790451 Energy: 0.8104324686629714 Energy: 0.8246928044782901 Energy: 0.8104324686629714 Energy: 0.8246928044790451 Energy: 0.8104324686637262 Energy: 0.7132115336083579 Energy: 0.8499286028250808 Energy: 0.7132115336098678 Energy: 0.8499286028265907 Energy: 0.7132115336083579 Energy: 0.8499286028258357 Energy: 0.8296775045529886 Energy: 0.734815217726242 Energy: 0.8296775045529886 Energy: 0.734815217726242 Energy: 0.8296775045529886 Energy: 0.7348152177254871 Energy: 0.6980967619520184 Energy: 0.7992479595602245 Energy: 0.6980967619535282 Energy: 0.7992469854169683 Energy: 0.6980967619527735 Energy: 0.7992468694501326 Energy: 0.877279248711434 Energy: 0.6929975055343544 Energy: 0.8772792487121891 Energy: 0.6929975055351093 Energy: 0.877279248711434 Energy: 0.6929975055351093 Energy: 0.7418252698201417 Energy: 0.7534699419233069 Energy: 0.7418252698186321 Energy: 0.7534699419248166 Energy: 0.7418252698201417 Energy: 0.7534699419240618 Energy: 0.8935570345678588 Energy: 0.7218895458982627 Energy: 0.893557034567104 Energy: 0.7218895458990177 Energy: 0.8935570345678588 Energy: 0.7218895458982627 Energy: 0.8891453574028261 Energy: 0.8140687000442823 Energy: 0.8891453574028261 Energy: 0.8140687000427727 Energy: 0.8891453574028261 Energy: 0.8140687000427727 Energy: 0.7978713029195577 Energy: 0.7964574417364725 Energy: 0.7978713029195577 Energy: 0.7964574417364725 Energy: 0.7978713029172929 Energy: 0.7964574417364725 Energy: 0.7978410035990614 Energy: 0.7547727265830764 Energy: 0.797841003602081 Energy: 0.7547727265808116 Energy: 0.7978410035990614 Energy: 0.7547727265815665 Energy: 0.7144234861672847 Energy: 0.7571289700570586 Energy: 0.7144234861672847 Energy: 0.7571289700555487 Energy: 0.7144234861657749 Energy: 0.7571289700547938 Energy: 0.8086316873792567 Energy: 0.7443042076954736 Energy: 0.8086316873800117 Energy: 0.7443042076947187 Energy: 0.8086316873800117 Energy: 0.7443042076954736 Energy: 0.726071906674273 Energy: 0.8733389609876927 Energy: 0.7260719066765376 Energy: 0.8733389609861828 Energy: 0.726071906674273 Energy: 0.873338960985428 Energy: 0.8179932389348114 Energy: 0.8025530874490108 Energy: 0.8179932389355663 Energy: 0.8025530874490108 Energy: 0.8179932389355663 Energy: 0.8025530874490108 Energy: 0.6938499245677073 Energy: 0.8641648418613859 Energy: 0.6938499245699721 Energy: 0.8641648418576456 Energy: 0.6938499245699721 Energy: 0.8641648418591555 minimum gb energy = 0.6929975055343544 eV minimum distance = 2.30118636028868 Angstroms sigma value = 33 ======================================== theta = 22.84350731792459 ======================================== Energy: 0.8532530527857926 Energy: 0.850934379548119 Energy: 0.8122610397229842 Energy: 0.8509343795515542 Energy: 0.8532530527883689 Energy: 0.8509343795519835 Energy: 0.8468828452336296 Energy: 0.7571666834181129 Energy: 0.8468828452332002 Energy: 0.7571666834198304 Energy: 0.8468828452293357 Energy: 0.7571666834202597 Energy: 0.7223401289631002 Energy: 0.7602860016416092 Energy: 0.7223401289553711 Energy: 0.7602860016351684 Energy: 0.7223401289566593 Energy: 0.7602860016373152 Energy: 0.8362516179254443 Energy: 0.8132684181287496 Energy: 0.8362516179215799 Energy: 0.813268418134761 Energy: 0.8362516179228681 Energy: 0.8132684181326141 Energy: 0.7978778148535747 Energy: 0.7871113361444734 Energy: 0.7978778148591569 Energy: 0.7871113361431851 Energy: 0.7978778148595862 Energy: 0.7871113361453321 Energy: 0.7695069372433476 Energy: 0.6961714424702024 Energy: 0.7695069372399126 Energy: 0.6961714424736374 Energy: 0.7695069372377655 Energy: 0.6961714424723494 Energy: 0.8564220639985597 Energy: 0.8295918933193598 Energy: 0.8564220640007066 Energy: 0.8295918933197892 Energy: 0.8564220639994187 Energy: 0.8295918933197892 Energy: 0.6867055258005251 Energy: 0.8570336184626263 Energy: 0.6867055257988076 Energy: 0.8570336184621969 Energy: 0.6867055257975194 Energy: 0.857033618453609 Energy: 0.7206578382366894 Energy: 0.720878594526084 Energy: 0.7206578382332544 Energy: 0.7208785945389657 Energy: 0.7206578382341131 Energy: 0.7208785945389657 Energy: 0.7253652061451291 Energy: 0.8504979751472129 Energy: 0.725363924593643 Energy: 0.8504979751472129 Energy: 0.725365206145988 Energy: 0.8504979751459248 Energy: 0.8553242286378101 Energy: 0.7221843270742478 Energy: 0.8553242286390981 Energy: 0.7221843270703834 Energy: 0.8553242286390981 Energy: 0.7221843270703834 Energy: 0.7212854436206447 Energy: 0.7603384233728893 Energy: 0.721285352312747 Energy: 0.7603384233741775 Energy: 0.7212854436142038 Energy: 0.7603384233746069 Energy: 0.8141892757695027 Energy: 0.7210897189889985 Energy: 0.8141892757707908 Energy: 0.7210897189898572 Energy: 0.8141892757609149 Energy: 0.7210897189898572 Energy: 0.8236474450336224 Energy: 0.8553849343816929 Energy: 0.8236474450353399 Energy: 0.8553849343773989 Energy: 0.8236474450340519 Energy: 0.8553849343782577 Energy: 0.7922772989480796 Energy: 0.7619895027368858 Energy: 0.792277298943786 Energy: 0.7619895027407504 Energy: 0.7922772989480796 Energy: 0.7619895027411797 Energy: 0.719427463318111 Energy: 0.7607119917710415 Energy: 0.7194274633129584 Energy: 0.760711991768465 Energy: 0.7194274633151053 Energy: 0.7607119917693239 Energy: 0.8608540237492804 Energy: 0.8139557315116764 Energy: 0.8608540237484218 Energy: 0.8139557315086707 Energy: 0.8608540237527157 Energy: 0.8139557315086707 Energy: 0.7995468960380063 Energy: 0.6967257343652717 Energy: 0.7995468960401534 Energy: 0.696725734367848 Energy: 0.799546896041012 Energy: 0.6967257343657011 Energy: 0.7712268729823358 Energy: 0.7745525751040856 Energy: 0.77122687297933 Energy: 0.7745525751053738 Energy: 0.7712268729810476 Energy: 0.7745525751032267 Energy: 0.8520231694810834 Energy: 0.8150561818740656 Energy: 0.8520231694793658 Energy: 0.8150561818835123 Energy: 0.8520231694819421 Energy: 0.8150561818835123 Energy: 0.6854903530713418 Energy: 0.8232352366511002 Energy: 0.685490353070483 Energy: 0.8232351971660237 Energy: 0.6854903530786414 Energy: 0.8232351810508952 Energy: 0.7604024500538916 Energy: 0.7234598159092279 Energy: 0.7604024500568973 Energy: 0.7234598159075103 Energy: 0.7604024500526034 Energy: 0.7234598159075103 Energy: 0.7227734420478629 Energy: 0.6704215614562485 Energy: 0.7227756504049908 Energy: 0.6703501893073037 Energy: 0.7227734420521568 Energy: 0.6706185703913812 Energy: 0.8548268160417803 Energy: 0.7930189352560856 Energy: 0.8548268160361984 Energy: 0.7930189352539386 Energy: 0.854826816037057 Energy: 0.7930189352539386 Energy: 0.722220959738512 Energy: 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0.7990875294361516 Energy: 0.6959526081307787 Energy: 0.7990875294382985 Energy: 0.6959526081307787 Energy: 0.7206854768830331 Energy: 0.8257947131676534 Energy: 0.7206854768860388 Energy: 0.8257947131753823 Energy: 0.7206854768894739 Energy: 0.8257947131740943 Energy: 0.8524605691119236 Energy: 0.8150739445042925 Energy: 0.8524605691080591 Energy: 0.8150739445128803 Energy: 0.8524605691114943 Energy: 0.8150739445128803 Energy: 0.7634002278973241 Energy: 0.792544866729628 Energy: 0.7634002278968947 Energy: 0.7925448667279104 Energy: 0.763400227896036 Energy: 0.7925448667279104 Energy: 0.7606604422047287 Energy: 0.7196110152316407 Energy: 0.7606604422042993 Energy: 0.7196110152346465 Energy: 0.7606604422051582 Energy: 0.7196110152346465 Energy: 0.8180761611756112 Energy: 0.8380933237554884 Energy: 0.8180761611786168 Energy: 0.838093323753771 Energy: 0.8180761611859165 Energy: 0.838093323757206 Energy: 0.7193305816619612 Energy: 0.7970964954498155 Energy: 0.7193332176700292 Energy: 0.7970964954515332 Energy: 0.7193305816671139 Energy: 0.7970964954523918 Energy: 0.7744456949621819 Energy: 0.7710165771516856 Energy: 0.7744456949604642 Energy: 0.7710165771551207 Energy: 0.7744456949630407 Energy: 0.7710165771551207 Energy: 0.8236506232223756 Energy: 0.8553538796737955 Energy: 0.823650623220658 Energy: 0.8553538796836715 Energy: 0.8236506232202286 Energy: 0.8553538796836715 Energy: 0.8239489478965493 Energy: 0.6860391012039024 Energy: 0.8239489638361744 Energy: 0.6860391011979301 Energy: 0.82394895269717 Energy: 0.6860391011979301 Energy: 0.7212874829924983 Energy: 0.7176841596088767 Energy: 0.7212874829899221 Energy: 0.717684159611453 Energy: 0.7212874829903515 Energy: 0.7176841596110237 minimum gb energy = 0.6530102703799343 eV minimum distance = 2.41386470821093 Angstroms sigma value = 51 ======================================== theta = 26.525352016609688 ======================================== Energy: 0.7811421591088527 Energy: 0.8037468289990074 Energy: 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0.7638915676590542 Energy: 0.7564086216593202 Energy: 0.7638915676570643 Energy: 0.7321092540772737 Energy: 0.7646749943453749 Energy: 0.7321092540802584 Energy: 0.7646749943453749 Energy: 0.7321092540782685 Energy: 0.7646749943463697 Energy: 0.8815894476705355 Energy: 0.7007338173314782 Energy: 0.8815894485794585 Energy: 0.7007338173314782 Energy: 0.8815894484024585 Energy: 0.7007338173324731 Energy: 0.71168668008823 Energy: 0.6328628137094057 Energy: 0.71168668008823 Energy: 0.6317806931361343 Energy: 0.71168668008823 Energy: 0.6332405816009888 Energy: 0.8295942067457142 Energy: 0.7036897247372187 Energy: 0.8295942067457142 Energy: 0.7036897247372187 Energy: 0.8295942067457142 Energy: 0.7036897247372187 Energy: 0.7828093832840546 Energy: 0.8050577804968378 Energy: 0.7828093832840546 Energy: 0.8050577804968378 Energy: 0.7828093832830598 Energy: 0.8050577804958431 Energy: 0.8465951588928716 Energy: 0.7592353432090153 Energy: 0.8465951666585357 Energy: 0.7592353432090153 Energy: 0.8465951556907708 Energy: 0.7592353432090153 Energy: 0.7630588186815355 Energy: 0.7357765538056475 Energy: 0.7630588186815355 Energy: 0.7357765538066424 Energy: 0.7630588186825303 Energy: 0.7357765538066424 Energy: 0.7814588230885393 Energy: 0.7843548603471538 Energy: 0.7814588230885393 Energy: 0.7843548603471538 Energy: 0.7814588230875446 Energy: 0.7843548603471538 Energy: 0.7997603994976709 Energy: 0.7639539736019503 Energy: 0.7997603994986657 Energy: 0.763953973604935 Energy: 0.7997603994976709 Energy: 0.7639539736039401 Energy: 0.8007362351961331 Energy: 0.83009037213364 Energy: 0.800736235197128 Energy: 0.83009037213364 Energy: 0.8007362351951383 Energy: 0.8300903721326451 Energy: 0.7869901536477968 Energy: 0.7679532887109713 Energy: 0.7869901536468018 Energy: 0.7679532887109713 Energy: 0.7869901536468018 Energy: 0.7679532887109713 minimum gb energy = 0.6317806931361343 eV minimum distance = 2.28900439224945 Angstroms sigma value = 19 ======================================== theta = 31.586338096527925 ======================================== Energy: 0.6336760119286066 Energy: 0.6737543452311399 Energy: 0.6336760119286066 Energy: 0.6737543452317301 Energy: 0.6336760119286066 Energy: 0.6737543452317301 Energy: 0.7297679876228786 Energy: 0.7788832772260611 Energy: 0.7297679876228786 Energy: 0.7788832772266513 Energy: 0.729767987624649 Energy: 0.7788832772266513 Energy: 0.6291888605573526 Energy: 0.7787666207472483 Energy: 0.6291888605561722 Energy: 0.7787666207466581 Energy: 0.6291888605567624 Energy: 0.7787666207472483 Energy: 0.6700357711989204 Energy: 0.6291505976883962 Energy: 0.6700357711977402 Energy: 0.6291505976883962 Energy: 0.6700357711995105 Energy: 0.6291505976889863 Energy: 0.6361364023478249 Energy: 0.6325188370792972 Energy: 0.6361364023501854 Energy: 0.6325188370787072 Energy: 0.6361364023472348 Energy: 0.6325188370775268 Energy: 0.6360846014680972 Energy: 0.6322996509011313 Energy: 0.6360846014657366 Energy: 0.6322996509011313 Energy: 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0.7787666207478384 Energy: 0.6700357711989204 Energy: 0.6291505976889863 Energy: 0.6700357711983302 Energy: 0.6291505976889863 Energy: 0.67003577119715 Energy: 0.6291505976889863 Energy: 0.636136402349005 Energy: 0.6325188370787072 Energy: 0.6361364023507755 Energy: 0.6325188370775268 Energy: 0.6361364023478249 Energy: 0.632518837078117 Energy: 0.6360846014686874 Energy: 0.6322996508999511 Energy: 0.6360846014663268 Energy: 0.6322996509017215 Energy: 0.6360846014663268 Energy: 0.6322996508999511 Energy: 0.6699952408750547 Energy: 0.6291283534170194 Energy: 0.6699952408803659 Energy: 0.6291283534170194 Energy: 0.6699952408756448 Energy: 0.6291283534176096 Energy: 0.6291835593696646 Energy: 0.7787479254183374 Energy: 0.6291835593696646 Energy: 0.7787479254206712 Energy: 0.6291835593696646 Energy: 0.7787479254177472 Energy: 0.7297246952258323 Energy: 0.7788876303023928 Energy: 0.7297246952252422 Energy: 0.7788876303018027 Energy: 0.7297246952252422 Energy: 0.7788876303023928 Energy: 0.6336760119280165 Energy: 0.6737543452317301 Energy: 0.6336760119280165 Energy: 0.6737543452317301 Energy: 0.6336760119280165 Energy: 0.6737543452317301 Energy: 0.7297679876216983 Energy: 0.778883277225471 Energy: 0.7297679876222884 Energy: 0.778883277225471 Energy: 0.7297679876234687 Energy: 0.778883277225471 Energy: 0.6291888605567624 Energy: 0.7787666207478384 Energy: 0.6291888605567624 Energy: 0.7787666207466581 Energy: 0.6291888605573526 Energy: 0.7787666207466581 Energy: 0.6700357711995105 Energy: 0.6291505976883962 Energy: 0.6700357711977402 Energy: 0.6291505976883962 Energy: 0.6700357711983302 Energy: 0.6291505976889863 Energy: 0.6361364023513657 Energy: 0.6325188370769367 Energy: 0.6361364023513657 Energy: 0.6325188370792972 Energy: 0.6361364023513657 Energy: 0.6325188370798874 Energy: 0.6360846014680972 Energy: 0.6322996509005412 Energy: 0.6360846014675071 Energy: 0.6322996509023117 Energy: 0.6360846014657366 Energy: 0.6322996508999511 Energy: 0.669995240876235 Energy: 0.6291283534170194 Energy: 0.6699952408780053 Energy: 0.6291283534164294 Energy: 0.6699952408774152 Energy: 0.6291283534176096 Energy: 0.6291835593696646 Energy: 0.7787479254206712 Energy: 0.6291835593684845 Energy: 0.7787479254200811 Energy: 0.6291835593696646 Energy: 0.7787479254206712 Energy: 0.7297246952270124 Energy: 0.7788876303023928 Energy: 0.729724695224652 Energy: 0.7788876303023928 Energy: 0.7297246952264224 Energy: 0.7788876303023928 Energy: 0.6336760119280165 Energy: 0.6737543452317301 Energy: 0.6336760119280165 Energy: 0.6737543452317301 Energy: 0.6336760119280165 Energy: 0.6737543452317301 Energy: 0.7297679876228786 Energy: 0.7788832772260611 Energy: 0.7297679876240588 Energy: 0.7788832772260611 Energy: 0.7297679876234687 Energy: 0.778883277225471 Energy: 0.6291888605555821 Energy: 0.7787666207472483 Energy: 0.6291888605567624 Energy: 0.7787666207466581 Energy: 0.6291888605561722 Energy: 0.7787666207484285 minimum gb energy = 0.6291283534164294 eV minimum distance = 2.32200826759407 Angstroms sigma value = 27 ======================================== theta = 38.94244126898138 ======================================== Energy: 0.6223809014230849 Energy: 0.6168205979941495 Energy: 0.6223809014230849 Energy: 0.6168205979941495 Energy: 0.6223809014230849 Energy: 0.6168205979941495 Energy: 0.7271646677368473 Energy: 0.6355984440206371 Energy: 0.7271646677354017 Energy: 0.6355984440206371 Energy: 0.7271646677354017 Energy: 0.6355984440206371 Energy: 0.6459006076610094 Energy: 0.6861056227313842 Energy: 0.6459006076610094 Energy: 0.6861056227313842 Energy: 0.6459006076595638 Energy: 0.6861056227299387 Energy: 0.701806127642672 Energy: 0.6022512759777131 Energy: 0.7018061276412264 Energy: 0.6022512759777131 Energy: 0.701806127642672 Energy: 0.6022512759777131 Energy: 0.7588530014220979 Energy: 0.5973381115462375 Energy: 0.7588530014235435 Energy: 0.5973381115462375 Energy: 0.7588530014220979 Energy: 0.5973381115462375 Energy: 0.7250425575403284 Energy: 0.7402622095092137 Energy: 0.7250425575403284 Energy: 0.7402622095106594 Energy: 0.7250425575388829 Energy: 0.7402622095092137 Energy: 0.6854702759702253 Energy: 0.6369369700112426 Energy: 0.6854702759687797 Energy: 0.6369369700112426 Energy: 0.6854702759716709 Energy: 0.6369369700112426 Energy: 0.618611460518061 Energy: 0.6201702484793175 Energy: 0.618611460518061 Energy: 0.6201702484793175 Energy: 0.618611460518061 Energy: 0.6201702484778718 Energy: 0.6834171052927325 Energy: 0.644353616764856 Energy: 0.6834171052927325 Energy: 0.6443536167388692 Energy: 0.683417105294178 Energy: 0.6443536167706382 Energy: 0.6894448938155122 Energy: 0.7196800622794592 Energy: 0.6894448938140666 Energy: 0.7196800622794592 Energy: 0.6894448938140666 Energy: 0.7196800622809049 Energy: 0.6427317760217114 Energy: 0.5973686369594204 Energy: 0.6427317760202658 Energy: 0.5973686369594204 Energy: 0.6427317760217114 Energy: 0.5973686369579748 Energy: 0.7579591443452381 Energy: 0.6832583410093168 Energy: 0.7579591443452381 Energy: 0.6832583410093168 Energy: 0.7579591443452381 Energy: 0.6832583410107622 minimum gb energy = 0.5973381115462375 eV minimum distance = 2.28219113194727 Angstroms sigma value = 9 ======================================== theta = 44.00342734889962 ======================================== Energy: 0.6201056000570534 Energy: 0.5784013437256064 Energy: 0.6201056000554288 Energy: 0.5784013437260126 Energy: 0.6201056000554288 Energy: 0.5784013437256064 Energy: 0.5809156075818793 Energy: 0.5478625778106168 Energy: 0.5809156075713192 Energy: 0.5478625778110229 Energy: 0.5809156075648205 Energy: 0.5478625778106168 Energy: 0.5556476447831863 Energy: 0.5987682541185189 Energy: 0.5556476447827802 Energy: 0.5987682541168943 Energy: 0.5556476447835924 Energy: 0.5987682541160819 Energy: 0.5649146803384142 Energy: 0.5443060976778096 Energy: 0.5649146803412574 Energy: 0.5443060976774033 Energy: 0.564914680340445 Energy: 0.5443060976782158 Energy: 0.6103950432941111 Energy: 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Energy: 0.6403420852168618 Energy: 0.4847423306479908 Energy: 0.6403420852150126 Energy: 0.4847423306479908 Energy: 0.6403420852177863 Energy: 0.3098974085961688 Energy: 0.5100618751950868 Energy: 0.3098974085952443 Energy: 0.5100618751941622 Energy: 0.3098974085961688 Energy: 0.5100618751941622 Energy: 0.7561208002263761 Energy: 0.533993299447591 Energy: 0.7561208002254515 Energy: 0.533993299447591 Energy: 0.7561208002263761 Energy: 0.533993299447591 Energy: 0.32693341547924365 Energy: 0.5107648829166161 Energy: 0.32693341548016824 Energy: 0.5107648829175406 Energy: 0.32693341547924365 Energy: 0.5107648829166161 Energy: 0.5355993361611344 Energy: 0.5157601716766578 Energy: 0.5355993361611344 Energy: 0.5157601716766578 Energy: 0.5355993361602099 Energy: 0.5157601716766578 Energy: 0.4828583111883081 Energy: 0.5055994881565452 Energy: 0.4828583111873835 Energy: 0.5055994881565452 Energy: 0.4828583111883081 Energy: 0.5055994881565452 Energy: 0.30973091102134304 Energy: 0.32769180724244185 Energy: 0.30973091102134304 Energy: 0.32769180724244185 Energy: 0.3097309110204185 Energy: 0.32769180724244185 Energy: 0.25956122698019973 Energy: 0.53316335343209 Energy: 0.25956122697927514 Energy: 0.53316335343209 Energy: 0.25956122697927514 Energy: 0.53316335343209 Energy: 0.25953351473731273 Energy: 0.5101340192206059 Energy: 0.25953351473731273 Energy: 0.5101340192206059 Energy: 0.25953351473731273 Energy: 0.5101340192196813 Energy: 0.32975401942473664 Energy: 0.31452533022546625 Energy: 0.32975401942473664 Energy: 0.31452533022546625 Energy: 0.32975401942473664 Energy: 0.31452533022546625 minimum gb energy = 0.25953351473546354 eV minimum distance = 2.46411253448573 Angstroms sigma value = 11 ======================================== theta = 55.8767054592047 ======================================== Energy: 0.4942863997188342 Energy: 0.6146693852383188 Energy: 0.4942863997201887 Energy: 0.6146693852376417 Energy: 0.49428639971951144 Energy: 0.6146693852383188 Energy: 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0.8521607411295055 Energy: 0.5995423830440376 Energy: 0.8521607411322144 Energy: 0.5995423830440376 minimum gb energy = 0.4167950343605821 eV minimum distance = 2.37003066315087 Angstroms sigma value = 41 ======================================== theta = 58.99241699313286 ======================================== Energy: 0.5495571271417974 Energy: 0.46956322156973274 Energy: 0.5495571271412636 Energy: 0.46956322156973274 Energy: 0.5495571271412636 Energy: 0.46956322156973274 Energy: 0.5282482285696203 Energy: 0.633476234955248 Energy: 0.5282482285690865 Energy: 0.6334762349547142 Energy: 0.5282482285696203 Energy: 0.633476234955248 Energy: 0.5841531637349141 Energy: 0.5739972246995235 Energy: 0.5841531637359818 Energy: 0.573997224700591 Energy: 0.5841531637359818 Energy: 0.5739972246995235 Energy: 0.5060468501810059 Energy: 0.4625707350325478 Energy: 0.5060468501810059 Energy: 0.4625707350325478 Energy: 0.5060468501799383 Energy: 0.4625707350325478 Energy: 0.4627605953357324 Energy: 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Energy: 0.46007983066095204 Energy: 0.5086063348652141 Energy: 0.46007983066095204 Energy: 0.45434325507250695 Energy: 0.6486692480538706 Energy: 0.45434325507250695 Energy: 0.648669248055472 Energy: 0.4543432550719731 Energy: 0.648669248055472 Energy: 0.4489315004115162 Energy: 0.6953931832203475 Energy: 0.44893150041365143 Energy: 0.6953931832198137 Energy: 0.44893150041205004 Energy: 0.69539318321928 Energy: 0.4705846189717203 Energy: 0.5298494250571784 Energy: 0.4705846189717203 Energy: 0.5298494250566446 Energy: 0.4705846189711865 Energy: 0.5298494250566446 Energy: 0.4621515230499612 Energy: 0.4601068636253107 Energy: 0.4621515230547655 Energy: 0.4601068636247769 Energy: 0.4621515230488936 Energy: 0.4601068636253107 Energy: 0.46858419119910727 Energy: 0.7512879567321926 Energy: 0.46858419120070866 Energy: 0.7512879567327265 Energy: 0.46858419119857336 Energy: 0.7512879567327265 Energy: 0.5020682897715092 Energy: 0.49787925869400096 Energy: 0.5020682897725768 Energy: 0.49787925869186567 Energy: 0.5020682897709754 Energy: 0.49787925869239946 Energy: 0.5494343826266271 Energy: 0.459217727447574 Energy: 0.5494343826276946 Energy: 0.45921772744704026 Energy: 0.5494343826271609 Energy: 0.45921772744704026 Energy: 0.456846148362037 Energy: 0.47630700028906175 Energy: 0.456846148362037 Energy: 0.4763070002922646 Energy: 0.456846148362037 Energy: 0.4763070002922646 Energy: 0.4719105458262108 Energy: 0.4767797191477676 Energy: 0.47191054582567693 Energy: 0.4767797191483014 Energy: 0.47191054582567693 Energy: 0.4767797191477676 Energy: 0.44840593320047184 Energy: 0.48909589641818646 Energy: 0.44840593320047184 Energy: 0.48909589641658496 Energy: 0.44840593320047184 Energy: 0.48909589641818646 minimum gb energy = 0.4458643350505812 eV minimum distance = 2.39955230808362 Angstroms sigma value = 33 ======================================== theta = 62.439396894736774 ======================================== Energy: 0.5411538960952668 Energy: 0.504602079081323 Energy: 0.5411538960945176 Energy: 0.5046020790816976 Energy: 0.5411538960952668 Energy: 0.5046020790820723 Energy: 0.559024617645538 Energy: 0.502881299371157 Energy: 0.5590246176447887 Energy: 0.502881299371157 Energy: 0.5590246176421664 Energy: 0.5028812993707823 Energy: 0.5218866160727182 Energy: 0.5816679547382207 Energy: 0.521886616073093 Energy: 0.5816679547382207 Energy: 0.5218866160719691 Energy: 0.5816679547434656 Energy: 0.5263198870920315 Energy: 0.4937852503732176 Energy: 0.5263198870920315 Energy: 0.493785250372843 Energy: 0.5263198870909075 Energy: 0.493785250372843 Energy: 0.5067137802589422 Energy: 0.5679659287059768 Energy: 0.50671378026119 Energy: 0.5679659287074754 Energy: 0.5067137802600661 Energy: 0.5679659287089739 Energy: 0.5276897439934768 Energy: 0.5066418850385266 Energy: 0.5276897440069294 Energy: 0.5066418850385266 Energy: 0.5276897439938514 Energy: 0.5066418850400252 Energy: 0.5230539570210392 Energy: 0.5629052905659546 Energy: 0.5230539570206646 Energy: 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0.5033654751568485 Energy: 0.5671053730818022 Energy: 0.5033654751568485 Energy: 0.49729052935576135 Energy: 0.560051332931783 Energy: 0.4972905293565105 Energy: 0.5600513329325323 Energy: 0.4972905293576345 Energy: 0.5600513329329069 Energy: 0.555747792782527 Energy: 0.4989415635642472 Energy: 0.5557477927806538 Energy: 0.4989415635638725 Energy: 0.5557477927810284 Energy: 0.49894156356499647 Energy: 0.5000884577492276 Energy: 0.5603655227871367 Energy: 0.5000884577507261 Energy: 0.5603655227871367 Energy: 0.5000884577469799 Energy: 0.5603655227863875 minimum gb energy = 0.4908243051534093 eV minimum distance = 2.40057531103411 Angstroms sigma value = 67 ======================================== theta = 70.52877936550931 ======================================== Energy: 0.5634891901453016 Energy: 0.5471146819683528 Energy: 0.5634891901453016 Energy: 0.5471146819681251 Energy: 0.5634891901453016 Energy: 0.5471146819686088 Energy: 0.5571616312854314 Energy: 0.5348881390317934 Energy: 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value = 3 ======================================== theta = 77.88488253796277 ======================================== Energy: 0.7408997399090255 Energy: 0.691505044346577 Energy: 0.7408997399087157 Energy: 0.6915050443458955 Energy: 0.7408997399069811 Energy: 0.691505044346577 Energy: 0.6913323593242677 Energy: 0.6471075526526201 Energy: 0.6913323593181349 Energy: 0.6471075526526201 Energy: 0.6913323593232146 Energy: 0.6471075526529919 Energy: 0.6493827655913502 Energy: 0.688375829327551 Energy: 0.6493827655906687 Energy: 0.6883758293282326 Energy: 0.6493827655917218 Energy: 0.6883758293285422 Energy: 0.6664523697460545 Energy: 0.6587386951077994 Energy: 0.6664523697436384 Energy: 0.658738695107118 Energy: 0.666452369745373 Energy: 0.6587386951074278 Energy: 0.7155739344545651 Energy: 0.6873805060289293 Energy: 0.7155739344548749 Energy: 0.6873805060234778 Energy: 0.715573934455928 Energy: 0.6873805060296108 Energy: 0.6557211635412551 Energy: 0.6728087724876145 Energy: 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0.6391335523711548 Energy: 0.6423722473694611 Energy: 0.6929255114396836 Energy: 0.6704743544975659 Energy: 0.6929255114396836 Energy: 0.6704743544975659 Energy: 0.6929255114391091 Energy: 0.6704743544975659 Energy: 0.6694656106081622 Energy: 0.619646096335421 Energy: 0.6694656106087365 Energy: 0.6196460963342723 Energy: 0.6694656106098854 Energy: 0.6196460963348466 Energy: 0.6845972473073388 Energy: 0.6951973024527759 Energy: 0.6845972473067644 Energy: 0.6951973024527759 Energy: 0.6845972473079133 Energy: 0.6951973024527759 Energy: 0.6391214720314449 Energy: 0.6706900669244046 Energy: 0.6391214720314449 Energy: 0.6706900669238302 Energy: 0.6391214720320192 Energy: 0.6706900669244046 Energy: 0.6737658504168652 Energy: 0.6594437823486552 Energy: 0.6737658504162908 Energy: 0.6594437823463577 Energy: 0.6737658504151419 Energy: 0.6594437823486552 Energy: 0.6431604693452657 Energy: 0.6615174017995534 Energy: 0.6431604693458401 Energy: 0.6615174017989789 Energy: 0.6431604693452657 Energy: 0.6615174017995534 minimum gb energy = 0.6128818693665607 eV minimum distance = 2.36384974202131 Angstroms sigma value = 57 ======================================== theta = 86.6277133165661 ======================================== Energy: 0.7383185779760661 Energy: 0.6347452602165397 Energy: 0.7383185779768098 Energy: 0.6347452602172835 Energy: 0.7383185779768098 Energy: 0.6347452602165397 Energy: 0.6534049308240274 Energy: 0.6148537020968075 Energy: 0.6534049308247711 Energy: 0.6148537020975512 Energy: 0.6534049308225737 Energy: 0.6148537020968075 Energy: 0.6835699963539561 Energy: 0.7135429992040982 Energy: 0.6835699963554435 Energy: 0.7135429992033545 Energy: 0.6835699963546998 Energy: 0.7135429992026107 Energy: 0.6353701499581305 Energy: 0.635792425741396 Energy: 0.6353701499588741 Energy: 0.6357924257421398 Energy: 0.6353701499573867 Energy: 0.6357924257428835 Energy: 0.6480847268543196 Energy: 0.676482422272437 Energy: 0.6480847268535759 Energy: 0.6764824222739244 Energy: 0.6480847268550634 Energy: 0.6764824222731808 Energy: 0.6965013580651863 Energy: 0.6448761978045057 Energy: 0.6965013580659299 Energy: 0.6448761978037618 Energy: 0.6965013580659299 Energy: 0.6448761978045057 Energy: 0.666862043591089 Energy: 0.748589341697546 Energy: 0.6668620435918329 Energy: 0.748589341697546 Energy: 0.666862043591089 Energy: 0.7485893416968022 Energy: 0.635561711674011 Energy: 0.6223291632503389 Energy: 0.6355617116710361 Energy: 0.6223291632525702 Energy: 0.6355617116732672 Energy: 0.6223291632503389 Energy: 0.6804065227342985 Energy: 0.6148792013308735 Energy: 0.6804065227350421 Energy: 0.614879201329386 Energy: 0.6804065227342985 Energy: 0.6148792013316171 Energy: 0.6163123114008395 Energy: 0.6289130640279728 Energy: 0.6163123114015832 Energy: 0.6289130640272291 Energy: 0.6163123114015832 Energy: 0.6289130640279728 Energy: 0.6746409267525622 Energy: 0.6372703067335482 Energy: 0.6746409267518185 Energy: 0.6372703067335482 Energy: 0.6746409267540496 Energy: 0.6372703067328045 Energy: 0.6487275999161509 Energy: 0.7368458280074979 Energy: 0.6487275999176383 Energy: 0.7368458280074979 Energy: 0.6487275999161509 Energy: 0.7368458280074979 Energy: 0.7107355112182511 Energy: 0.6149682981936553 Energy: 0.7107355112167635 Energy: 0.6149682981936553 Energy: 0.7107355112167635 Energy: 0.6149682981929115 Energy: 0.6657399331634537 Energy: 0.6217277646120526 Energy: 0.6657399331641973 Energy: 0.6217277646120526 Energy: 0.6657399331627437 Energy: 0.6217277646120526 Energy: 0.6735030331117597 Energy: 0.6177241977730794 Energy: 0.6735030331117597 Energy: 0.6177241977738231 Energy: 0.6735030331110161 Energy: 0.6177241977738231 Energy: 0.7027587728441788 Energy: 0.6734390637393501 Energy: 0.7027587728441788 Energy: 0.6734390637393501 Energy: 0.7027587728441788 Energy: 0.6734390637393501 Energy: 0.6179344825572715 Energy: 0.6423372936951012 Energy: 0.6179344825565276 Energy: 0.6423372936943574 Energy: 0.6179344825572715 Energy: 0.6423372936943574 Energy: 0.6728741962358029 Energy: 0.6541088823962787 Energy: 0.6728741962365467 Energy: 0.6541088823970225 Energy: 0.6728741962358029 Energy: 0.6541088823962787 Energy: 0.6172254685366809 Energy: 0.6498146714671135 Energy: 0.6172254685366809 Energy: 0.6498146714663697 Energy: 0.6172254685366809 Energy: 0.6498146714663697 Energy: 0.6444565403386932 Energy: 0.6729624476211423 Energy: 0.6444565403372057 Energy: 0.6729624476203986 Energy: 0.6444565403394368 Energy: 0.6729624476203986 Energy: 0.6522769590337776 Energy: 0.6263102449219933 Energy: 0.6522769590315465 Energy: 0.6263102449219933 Energy: 0.652276959035265 Energy: 0.6263102449212495 Energy: 0.7335402727391948 Energy: 0.6632648810812103 Energy: 0.733540272738451 Energy: 0.6632648810826978 Energy: 0.733540272738451 Energy: 0.6632648810804667 Energy: 0.6405564450307379 Energy: 0.6163306260760161 Energy: 0.6405564450307379 Energy: 0.6163306260752722 Energy: 0.6405564450299942 Energy: 0.6163306260767598 Energy: 0.650321322303041 Energy: 0.6823765078943648 Energy: 0.6503213223022972 Energy: 0.6823765078943648 Energy: 0.6503213223022972 Energy: 0.682376507893621 minimum gb energy = 0.6148537020968075 eV minimum distance = 2.38910525010381 Angstroms sigma value = 17 ======================================== theta = 93.3722866834339 ======================================== Energy: 0.6177631480027295 Energy: 0.5851064346063731 Energy: 0.6177631480027295 Energy: 0.5851064346063731 Energy: 0.6177631480048332 Energy: 0.5851064346063731 Energy: 0.5785827329994618 Energy: 0.5658885861797943 Energy: 0.5785827330005135 Energy: 0.5658885861797943 Energy: 0.5785827330005135 Energy: 0.5658885861797943 Energy: 0.6627192778760128 Energy: 0.6582416045734565 Energy: 0.6627192778749611 Energy: 0.6582416045734565 Energy: 0.6627192778760128 Energy: 0.6582416045734565 Energy: 0.5640426876516469 Energy: 0.6542158068328366 Energy: 0.564042687650595 Energy: 0.6542158068317849 Energy: 0.5640426876516469 Energy: 0.6542158068317849 Energy: 0.5544766191388646 Energy: 0.6289207144102992 Energy: 0.5544458784234013 Energy: 0.6289207146006008 Energy: 0.5543957880724074 Energy: 0.6289207143829766 Energy: 0.6127477304581772 Energy: 0.564361765580752 Energy: 0.6127477304581772 Energy: 0.5643617655818038 Energy: 0.6127477304581772 Energy: 0.564361765580752 Energy: 0.5521963872488023 Energy: 0.5855522742822835 Energy: 0.5521963872488023 Energy: 0.5855522742812317 Energy: 0.5521963872488023 Energy: 0.5855522742812317 Energy: 0.5637875121120618 Energy: 0.6388271368014673 Energy: 0.5637875121120618 Energy: 0.6388271368025191 Energy: 0.5637875121120618 Energy: 0.6388271368025191 Energy: 0.6419105356527178 Energy: 0.5651920681300893 Energy: 0.6419105356537697 Energy: 0.5651920681290374 Energy: 0.6419105356527178 Energy: 0.5651920681300893 Energy: 0.6089209479350138 Energy: 0.5757682417534571 Energy: 0.6089209479350138 Energy: 0.5757682417534571 Energy: 0.6089209479350138 Energy: 0.5757682417534571 Energy: 0.598682955653276 Energy: 0.5936274594157107 Energy: 0.598682955653276 Energy: 0.5936274594157107 Energy: 0.5986829556522242 Energy: 0.5936274594157107 Energy: 0.6213117049060571 Energy: 0.5848035274083994 Energy: 0.6213117049081607 Energy: 0.5848035274083994 Energy: 0.6213117049071089 Energy: 0.5848035274083994 Energy: 0.5456267883064805 Energy: 0.6442962540079501 Energy: 0.5456267883075323 Energy: 0.6442962540079501 Energy: 0.5456267883064805 Energy: 0.6442962540079501 Energy: 0.6085251727880884 Energy: 0.6631212733990466 Energy: 0.6085251727880884 Energy: 0.6631212734000985 Energy: 0.6085251727870366 Energy: 0.6631212733990466 Energy: 0.6125269217798449 Energy: 0.5713799770737216 Energy: 0.6125269217798449 Energy: 0.57137997707267 Energy: 0.6125269217787931 Energy: 0.57137997707267 Energy: 0.612781635128804 Energy: 0.5647936615582487 Energy: 0.612781635128804 Energy: 0.5647936615582487 Energy: 0.612781635128804 Energy: 0.5647936615582487 Energy: 0.6077921197950737 Energy: 0.6632413123766501 Energy: 0.6077921197950737 Energy: 0.6632413123766501 Energy: 0.6077921197950737 Energy: 0.6632413123766501 minimum gb energy = 0.5456267883064805 eV minimum distance = 2.36722857138895 Angstroms sigma value = 17 ======================================== theta = 97.054131382119 ======================================== Energy: 0.5622584136456983 Energy: 0.5463782035024529 Energy: 0.5622584136461045 Energy: 0.5463782035024529 Energy: 0.5622584136481351 Energy: 0.5463782035020468 Energy: 0.5635677810113763 Energy: 0.5289265189863128 Energy: 0.5635677810101578 Energy: 0.5289265189859066 Energy: 0.5635677810113763 Energy: 0.528926518984688 Energy: 0.6090790921035774 Energy: 0.5807441118587096 Energy: 0.6090790921031712 Energy: 0.5807441118583034 Energy: 0.6090790921056082 Energy: 0.5807441118583034 Energy: 0.5362778780324349 Energy: 0.5858077135961891 Energy: 0.5362778780360903 Energy: 0.5858077135965952 Energy: 0.5362778780332472 Energy: 0.5858077135965952 Energy: 0.6273860612894491 Energy: 0.5291138391206431 Energy: 0.6273860612922924 Energy: 0.5291138391210494 Energy: 0.6273860612886368 Energy: 0.5291138391206431 Energy: 0.5953789999748635 Energy: 0.5358121287713901 Energy: 0.5953789999744574 Energy: 0.535812128770984 Energy: 0.595378999976082 Energy: 0.535812128770984 Energy: 0.5600188046451562 Energy: 0.561470980132798 Energy: 0.5600188046455624 Energy: 0.5614709801319856 Energy: 0.5600188046447501 Energy: 0.5614709801323917 Energy: 0.6026597264126213 Energy: 0.5684242786761368 Energy: 0.6026597264101844 Energy: 0.5684242786708936 Energy: 0.6026597264085598 Energy: 0.5684242786773552 Energy: 0.5757543153051773 Energy: 0.5407418349794992 Energy: 0.5757543153072081 Energy: 0.5407418349786869 Energy: 0.5757543153072081 Energy: 0.5407418349803115 Energy: 0.5566951045691203 Energy: 0.5116931140961261 Energy: 0.556695104571151 Energy: 0.5116931140961261 Energy: 0.5566951045687141 Energy: 0.5116931140957199 Energy: 0.5122596982501145 Energy: 0.5770024007229043 Energy: 0.5122596982493021 Energy: 0.577002400724529 Energy: 0.5122596982472714 Energy: 0.5770024007237166 Energy: 0.609871600763662 Energy: 0.5345674127279249 Energy: 0.6098716007644742 Energy: 0.5345674127279249 Energy: 0.6098716007624435 Energy: 0.5345674127275187 Energy: 0.6010122019771558 Energy: 0.5399151243236346 Energy: 0.6010122019751248 Energy: 0.5399151243236346 Energy: 0.6010122019767495 Energy: 0.5399151243232285 Energy: 0.549690482153481 Energy: 0.6038517903115256 Energy: 0.5496904821526688 Energy: 0.6038517903115256 Energy: 0.549690482155918 Energy: 0.6038517903115256 Energy: 0.5817163635091277 Energy: 0.5603267781009482 Energy: 0.5817163635087217 Energy: 0.5603267781021668 Energy: 0.5817163635091277 Energy: 0.5603267781013545 Energy: 0.5191877940143302 Energy: 0.6204496237431935 Energy: 0.5191877940122993 Energy: 0.6204496237431935 Energy: 0.5191877940151425 Energy: 0.6204496237411629 Energy: 0.5576834114203703 Energy: 0.5784718126961992 Energy: 0.5576834114187457 Energy: 0.5784718126966054 Energy: 0.5576834114199641 Energy: 0.5784718126961992 Energy: 0.5857377214389458 Energy: 0.573501122821283 Energy: 0.5857377214413828 Energy: 0.5735011228216892 Energy: 0.5857377214389458 Energy: 0.5735011228216892 Energy: 0.5684765128527841 Energy: 0.5756318708738578 Energy: 0.5684765128507901 Energy: 0.5756318708734517 Energy: 0.5684765128531903 Energy: 0.5756318708738578 Energy: 0.5574372263402133 Energy: 0.551992175730122 Energy: 0.5574372263442748 Energy: 0.551992175730122 Energy: 0.5574372263414317 Energy: 0.5519921757305282 Energy: 0.5684913537685796 Energy: 0.5756056836267586 Energy: 0.5684913537697981 Energy: 0.5756056836259463 Energy: 0.5684913537681734 Energy: 0.575605683625134 Energy: 0.5854757449305628 Energy: 0.5729684086074804 Energy: 0.5854757449329997 Energy: 0.5729684086066681 Energy: 0.5854757449309689 Energy: 0.5729684086074804 Energy: 0.5576566405330446 Energy: 0.5783586461632194 Energy: 0.5576566405322322 Energy: 0.5783586461632194 Energy: 0.5576566405334508 Energy: 0.5783586461632194 Energy: 0.519227304413627 Energy: 0.6204102055257761 Energy: 0.519227304413627 Energy: 0.6204102055237452 Energy: 0.5192273044144393 Energy: 0.6204102055257761 Energy: 0.5817005447672559 Energy: 0.56048805033707 Energy: 0.581700544770099 Energy: 0.56048805033707 Energy: 0.5817005447684744 Energy: 0.56048805033707 Energy: 0.5497021924351306 Energy: 0.6039016842337566 Energy: 0.5497021924367552 Energy: 0.6039016842337566 Energy: 0.5497021924355368 Energy: 0.6039016842337566 Energy: 0.6009600107594927 Energy: 0.5402022078554387 Energy: 0.6009600107623359 Energy: 0.5402022078554387 Energy: 0.6009600107611174 Energy: 0.5402022078554387 Energy: 0.609899083346907 Energy: 0.5346124630234032 Energy: 0.6098990833460947 Energy: 0.5346124630250277 Energy: 0.6098990833489378 Energy: 0.534612463022997 Energy: 0.512215549164195 Energy: 0.576991180390561 Energy: 0.5122155491629765 Energy: 0.5769911803909671 Energy: 0.5122155491637889 Energy: 0.5769911803913733 Energy: 0.5566976825154947 Energy: 0.5662421929167055 Energy: 0.5566976825179316 Energy: 0.5662421929199548 Energy: 0.5566976825183378 Energy: 0.5662421929195487 Energy: 0.5760358806194225 Energy: 0.5405924772457695 Energy: 0.5760358806190162 Energy: 0.5405924772441449 Energy: 0.5760358806194225 Energy: 0.5405924772433326 Energy: 0.6026472759875121 Energy: 0.5680555296092447 Energy: 0.6026472759883245 Energy: 0.5680555296088385 Energy: 0.6026472759879182 Energy: 0.5680555296080263 Energy: 0.5600182717896297 Energy: 0.5616167955332521 Energy: 0.5600182717859743 Energy: 0.5616167955332521 Energy: 0.5600182717884112 Energy: 0.5616167955332521 Energy: 0.5950065220275931 Energy: 0.5357647757374608 Energy: 0.5950065220243438 Energy: 0.5357647757378671 Energy: 0.5950065220259684 Energy: 0.5357647757378671 Energy: 0.627104384214451 Energy: 0.5292197466418257 Energy: 0.6271043842136388 Energy: 0.5292197466418257 Energy: 0.627104384214451 Energy: 0.5292197466418257 Energy: 0.5363533714265841 Energy: 0.5857812591458889 Energy: 0.5363533714241471 Energy: 0.5857812591450765 Energy: 0.5363533714249594 Energy: 0.5857812591454826 Energy: 0.6090637185985871 Energy: 0.5804916563542153 Energy: 0.6090637185977748 Energy: 0.5804916563542153 Energy: 0.6090637185985871 Energy: 0.5804916563546214 Energy: 0.5635629699005079 Energy: 0.5290063346064651 Energy: 0.5635629699005079 Energy: 0.5290063346064651 Energy: 0.5635629699005079 Energy: 0.5290063346064651 Energy: 0.5622584136513844 Energy: 0.5463782035012344 Energy: 0.5622584136485413 Energy: 0.5463782035008282 Energy: 0.5622584136485413 Energy: 0.5463782035008282 Energy: 0.5635677810145887 Energy: 0.5289265189822512 Energy: 0.5635677810134072 Energy: 0.5289265189810327 Energy: 0.5635677810134072 Energy: 0.5289265189810327 Energy: 0.6090790921031712 Energy: 0.5807441118562726 Energy: 0.609079092102765 Energy: 0.5807441118558665 Energy: 0.6090790921039835 Energy: 0.580744111857085 Energy: 0.5362778780299979 Energy: 0.5858077135974076 Energy: 0.5362778780316225 Energy: 0.5858077135957829 Energy: 0.5362778780308102 Energy: 0.5858077135970013 Energy: 0.6273860612870121 Energy: 0.5291138391247047 Energy: 0.6273860612861999 Energy: 0.5291138391242985 Energy: 0.6273860612861999 Energy: 0.5291138391251108 minimum gb energy = 0.5116931140957199 eV minimum distance = 2.39042862192625 Angstroms sigma value = 57 ======================================== theta = 99.36891557845483 ======================================== Energy: 0.5230341044151632 Energy: 0.5066972269510049 Energy: 0.5230341044145018 Energy: 0.5066972269510049 Energy: 0.5230341044171471 Energy: 0.5066972269510049 Energy: 0.5137570538196948 Energy: 0.5006144924122934 Energy: 0.5137570538203561 Energy: 0.5006144924116321 Energy: 0.5137570538150654 Energy: 0.5006144924122934 Energy: 0.5743295338278168 Energy: 0.5403787073564836 Energy: 0.5743295338298009 Energy: 0.5403787073564836 Energy: 0.5743295338291395 Energy: 0.5403787073571449 Energy: 0.48277707393803665 Energy: 0.5532436429627661 Energy: 0.482777073938698 Energy: 0.5532436429621047 Energy: 0.4827770739413433 Energy: 0.5532436429614433 Energy: 0.5869787191585353 Energy: 0.47214116935115236 Energy: 0.5869787191572127 Energy: 0.47214116935115236 Energy: 0.5869787191572127 Energy: 0.4721411693518137 Energy: 0.5539907022178486 Energy: 0.5018988614598564 Energy: 0.5539907022178486 Energy: 0.5018988614598564 Energy: 0.5539907022191712 Energy: 0.5018988614598564 Energy: 0.4813968448071817 Energy: 0.5349103360101412 Energy: 0.4813968448065203 Energy: 0.5349103360088184 Energy: 0.4813968448045364 Energy: 0.5349103360088184 Energy: 0.5172299395295329 Energy: 0.5192512856129943 Energy: 0.517229939523641 Energy: 0.5192835212447032 Energy: 0.5172299395289316 Energy: 0.5192781357659779 Energy: 0.5116631655810262 Energy: 0.5028793075953022 Energy: 0.5116631655816876 Energy: 0.502879307594641 Energy: 0.511663165580365 Energy: 0.5028793075953022 Energy: 0.516263965572583 Energy: 0.515038662917186 Energy: 0.5162639655712604 Energy: 0.515038662917186 Energy: 0.5162639655752284 Energy: 0.515038662917186 Energy: 0.48157522198903957 Energy: 0.5323647464708371 Energy: 0.48157522199168484 Energy: 0.5323647464714985 Energy: 0.48157522198903957 Energy: 0.5323647464714985 Energy: 0.5327744291509066 Energy: 0.4823389984909214 Energy: 0.5327744291489225 Energy: 0.4823389984915827 Energy: 0.532774429149584 Energy: 0.4823389984909214 Energy: 0.5128688776283926 Energy: 0.5798720590879557 Energy: 0.5128688776297152 Energy: 0.5798720590879557 Energy: 0.512868877629054 Energy: 0.5798720590879557 Energy: 0.4829407246589941 Energy: 0.536884733949936 Energy: 0.4829407246556874 Energy: 0.536884733945968 Energy: 0.4829407246596553 Energy: 0.5368847339486132 Energy: 0.5606098529501262 Energy: 0.503135463291325 Energy: 0.5606098529474808 Energy: 0.5031354632919863 Energy: 0.5606098529494649 Energy: 0.5031354632919863 Energy: 0.5115413127655133 Energy: 0.514504600593556 Energy: 0.51154131276882 Energy: 0.5145046005922332 Energy: 0.5115413127655133 Energy: 0.5145046005922332 Energy: 0.5193167813734817 Energy: 0.5800757506801287 Energy: 0.5193167813748043 Energy: 0.5800757506801287 Energy: 0.5193167813748043 Energy: 0.5800757506807901 Energy: 0.5451465126210462 Energy: 0.5026686512258516 Energy: 0.5451465126190623 Energy: 0.5026686512258516 Energy: 0.5451465126203849 Energy: 0.5026686512258516 Energy: 0.49216359121522707 Energy: 0.5497626521674562 Energy: 0.49216359121390446 Energy: 0.5497626521667949 Energy: 0.4921635912145657 Energy: 0.5497626521674562 Energy: 0.4948241951855842 Energy: 0.5524742177020655 Energy: 0.4948241951855842 Energy: 0.5524742177020655 Energy: 0.4948241951862456 Energy: 0.5524742177020655 Energy: 0.5516914831360474 Energy: 0.6592655912736869 Energy: 0.5516914831360474 Energy: 0.6592655912736869 Energy: 0.5516914831360474 Energy: 0.6592655912736869 Energy: 0.4942856757190177 Energy: 0.6047987924955739 Energy: 0.4942856757190177 Energy: 0.6047987924962351 Energy: 0.4942856757190177 Energy: 0.6047987924955739 Energy: 0.5200951807055068 Energy: 0.5369211161471623 Energy: 0.520095180704184 Energy: 0.536921116146501 Energy: 0.5200951807035227 Energy: 0.5369211161471623 Energy: 0.5309684418852897 Energy: 0.5446307633151634 Energy: 0.5309684418866124 Energy: 0.5446307633145021 Energy: 0.5309684418872738 Energy: 0.544630763312518 Energy: 0.5212255629844208 Energy: 0.6473134045745533 Energy: 0.5212255669883501 Energy: 0.6473134045745533 Energy: 0.5212255719857769 Energy: 0.6473134045752146 Energy: 0.5104812661287138 Energy: 0.5367620064414768 Energy: 0.5104812661280526 Energy: 0.5367620064421381 Energy: 0.5104812661273912 Energy: 0.5367620064414768 Energy: 0.4910844140143608 Energy: 0.6032706573778392 Energy: 0.4910844140150221 Energy: 0.6032706573771779 Energy: 0.4910844140130381 Energy: 0.6032706573778392 minimum gb energy = 0.47214116935115236 eV minimum distance = 2.32993014787443 Angstroms sigma value = 43 ======================================== theta = 102.11511746203723 ======================================== Energy: 0.5387443905811671 Energy: 0.4501955356290002 Energy: 0.5387443905802034 Energy: 0.4501955356294821 Energy: 0.5387443905826125 Energy: 0.4501955356294821 Energy: 0.5115665065956989 Energy: 0.44918070630342627 Energy: 0.5115665065976263 Energy: 0.44918070630342627 Energy: 0.5115665065956989 Energy: 0.44918070630342627 Energy: 0.49556232650706517 Energy: 0.4836955121029575 Energy: 0.49556232650802884 Energy: 0.48369551210343936 Energy: 0.49556232650754695 Energy: 0.4836955121029575 Energy: 0.4494557038116891 Energy: 0.47183043629350185 Energy: 0.4494557038107254 Energy: 0.47183043629350185 Energy: 0.4494557038107254 Energy: 0.4718304362939837 Energy: 0.49080665313965527 Energy: 0.41571634013220266 Energy: 0.49080665313917354 Energy: 0.41571634013220266 Energy: 0.49080665313965527 Energy: 0.41571634013220266 Energy: 0.47339589142539057 Energy: 0.43879704456311464 Energy: 0.47339589142587235 Energy: 0.4387970445626328 Energy: 0.4733958914268361 Energy: 0.4387970445626328 Energy: 0.4505121262226182 Energy: 0.46003675032202884 Energy: 0.45051212622310005 Energy: 0.4600367503210652 Energy: 0.45051212622310005 Energy: 0.4600367503225108 Energy: 0.5141597752710065 Energy: 0.4073010734929505 Energy: 0.514159775270043 Energy: 0.4073010734929505 Energy: 0.5141597752714884 Energy: 0.4073010734929505 Energy: 0.4570174614076553 Energy: 0.4366190959729033 Energy: 0.4570174614071735 Energy: 0.4366190959733853 Energy: 0.45701746140813715 Energy: 0.43661909597386706 Energy: 0.49206134535164003 Energy: 0.44752068120141797 Energy: 0.4920613453526037 Energy: 0.44752068120189975 Energy: 0.4920613453506763 Energy: 0.44752068120141797 Energy: 0.5300341617208447 Energy: 0.452730108753187 Energy: 0.5300341617222902 Energy: 0.45273010875077774 Energy: 0.5300341617213266 Energy: 0.4527301087512595 Energy: 0.4314111524157907 Energy: 0.4370456415346224 Energy: 0.4314111524153088 Energy: 0.4370456415346224 Energy: 0.4314111524157907 Energy: 0.4370456415351042 Energy: 0.4912959804944392 Energy: 0.4294474287091959 Energy: 0.4912959804954029 Energy: 0.4294474287096778 Energy: 0.49129598049636647 Energy: 0.4294474287096778 Energy: 0.5349771963709363 Energy: 0.4786047691635549 Energy: 0.5349771963699727 Energy: 0.47860476916403666 Energy: 0.5349771963704545 Energy: 0.4786047691635549 Energy: 0.4455762560866346 Energy: 0.47990859124172536 Energy: 0.44557625608422535 Energy: 0.47990859124172536 Energy: 0.4455762560851891 Energy: 0.47990859124172536 Energy: 0.49503568425453887 Energy: 0.4755045569107867 Energy: 0.49503568425357514 Energy: 0.4755045569107867 Energy: 0.49503568425405703 Energy: 0.4755045569107867 Energy: 0.5322969704809031 Energy: 0.47608341897161593 Energy: 0.5322969704804212 Energy: 0.4760834189720977 Energy: 0.5322969704804212 Energy: 0.47608341897161593 Energy: 0.46034833895113486 Energy: 0.43185745386312036 Energy: 0.46034833895065297 Energy: 0.43185745386408403 Energy: 0.4603483389516167 Energy: 0.43185745386408403 Energy: 0.4219280100608339 Energy: 0.498705877269591 Energy: 0.4219280100603521 Energy: 0.49870587727007276 Energy: 0.4219280100627613 Energy: 0.498705877269591 Energy: 0.4376279979224072 Energy: 0.43417680136175535 Energy: 0.43762799792385276 Energy: 0.4341768013607916 Energy: 0.43762799792385276 Energy: 0.43417680136127346 Energy: 0.4862353682976021 Energy: 0.43945064537352013 Energy: 0.4862353682956747 Energy: 0.43945064537352013 Energy: 0.4862353682956747 Energy: 0.43945064537352013 Energy: 0.45216310825287204 Energy: 0.48975088153634505 Energy: 0.4521631082523902 Energy: 0.4897508815358632 Energy: 0.4521631082523902 Energy: 0.4897508815358632 Energy: 0.45337513884543096 Energy: 0.49175347894737925 Energy: 0.4533751388449491 Energy: 0.4917534789468973 Energy: 0.45337513884639463 Energy: 0.4917534789468973 Energy: 0.4701903811686603 Energy: 0.43819620366354933 Energy: 0.47019038116817846 Energy: 0.4381962036630675 Energy: 0.47019038116769657 Energy: 0.43819620366354933 Energy: 0.42073858449892365 Energy: 0.4363683622107921 Energy: 0.42073858449940554 Energy: 0.4363683622107921 Energy: 0.42073858449940554 Energy: 0.4363683622103102 Energy: 0.4302886981052716 Energy: 0.4791662859107085 Energy: 0.430288698107199 Energy: 0.4791662859111903 Energy: 0.43028869810671716 Energy: 0.47916628591167215 Energy: 0.4744483999923231 Energy: 0.4310739699794709 Energy: 0.47444839999280486 Energy: 0.4310739699794709 Energy: 0.47444839999328675 Energy: 0.43107396997657976 Energy: 0.4031647940220501 Energy: 0.48343862245489644 Energy: 0.4031647940201227 Energy: 0.48343862245489644 Energy: 0.4031647940220501 Energy: 0.48343862245393276 Energy: 0.4309164285642117 Energy: 0.45482027479588105 Energy: 0.4309164285627661 Energy: 0.45482027479588105 Energy: 0.43091642856324797 Energy: 0.45482027479588105 Energy: 0.4420118499673273 Energy: 0.4364044892095749 Energy: 0.4420118499639544 Energy: 0.4364044892100568 Energy: 0.44201184996588166 Energy: 0.4364044892100568 Energy: 0.40110881384772934 Energy: 0.4838785704645306 Energy: 0.4011088138482112 Energy: 0.4838785704640487 Energy: 0.40110881384869307 Energy: 0.4838785704645306 Energy: 0.4319971341137715 Energy: 0.4472072343940123 Energy: 0.4319971341142533 Energy: 0.4472072343940123 Energy: 0.4319971341137715 Energy: 0.4472072343940123 Energy: 0.4287070669501975 Energy: 0.43668000676794 Energy: 0.4287070669526067 Energy: 0.43668000676842184 Energy: 0.4287070669526067 Energy: 0.43668000676794 Energy: 0.5310913391004154 Energy: 0.4792802411614332 Energy: 0.5310913390999336 Energy: 0.47928024116384244 Energy: 0.5310913391008973 Energy: 0.47928024116287876 Energy: 0.43272150994228675 Energy: 0.4321428703730179 Energy: 0.4327215099432505 Energy: 0.43214287037349974 Energy: 0.4327215099432505 Energy: 0.43214287037349974 Energy: 0.4005376524156441 Energy: 0.4827750163166198 Energy: 0.4005376524175715 Energy: 0.4827750163166198 Energy: 0.4005376524166078 Energy: 0.4827750163166198 minimum gb energy = 0.4005376524156441 eV minimum distance = 2.33048944654194 Angstroms sigma value = 81 ======================================== theta = 109.47122063449069 ======================================== Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.31503822242752727 Energy: 0.03119037007822346 Energy: 0.31503822242752727 Energy: 0.031190370074682616 Energy: 0.31503822242929774 Energy: 0.031190370074682616 Energy: 0.31505964170695905 Energy: 0.03194472586792823 Energy: 0.31505964170341816 Energy: 0.03194472586438739 Energy: 0.31505964170695905 Energy: 0.03194472586792823 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.31503822242752727 Energy: 0.03119037007822346 Energy: 0.31503822242752727 Energy: 0.03119037007822346 Energy: 0.31503822242752727 Energy: 0.03119037007822346 Energy: 0.31505964170695905 Energy: 0.03194472586438739 Energy: 0.31505964170695905 Energy: 0.03194472586261697 Energy: 0.31505964170695905 Energy: 0.03194472586261697 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.31503822242752727 Energy: 0.031190370076453037 Energy: 0.31503822242752727 Energy: 0.031190370071141775 Energy: 0.31503822242929774 Energy: 0.031190370074682616 Energy: 0.31505964170695905 Energy: 0.03194472586615782 Energy: 0.31505964170695905 Energy: 0.03194472586792823 Energy: 0.31505964170695905 Energy: 0.03194472586438739 Energy: 0.02907216749148473 Energy: 0.05834122340470116 Energy: 0.02907216749148473 Energy: 0.05834122340647158 Energy: 0.02907216749148473 Energy: 0.05834122340647158 minimum gb energy = 0.02907216749148473 eV minimum distance = 2.53061496538941 Angstroms sigma value = 3 ======================================== theta = 117.56060310526324 ======================================== Energy: 0.42734283892181285 Energy: 0.39362221619961846 Energy: 0.42734283891969366 Energy: 0.39362221619961846 Energy: 0.4273428389202235 Energy: 0.39362221619961846 Energy: 0.4020458811070027 Energy: 0.4039547076476148 Energy: 0.40204588110806233 Energy: 0.403954707647085 Energy: 0.4020458811059431 Energy: 0.4039547076476148 Energy: 0.43387076398236896 Energy: 0.40294334098785267 Energy: 0.4338707639818391 Energy: 0.40294334098785267 Energy: 0.4338707639813093 Energy: 0.40294334098785267 Energy: 0.4166733142141955 Energy: 0.38491115530494246 Energy: 0.4166733142141955 Energy: 0.38491115530494246 Energy: 0.4166733142147253 Energy: 0.38491115530494246 Energy: 0.3507256632631981 Energy: 0.4045382503360378 Energy: 0.35072566326531734 Energy: 0.4045382503360378 Energy: 0.35072566326425775 Energy: 0.4045382503360378 Energy: 0.4203318694602436 Energy: 0.4202112562885761 Energy: 0.4203318694597138 Energy: 0.4202112562885761 Energy: 0.4203318694602436 Energy: 0.4202112562885761 Energy: 0.42609169391669677 Energy: 0.39488324652705725 Energy: 0.426091693916167 Energy: 0.39488324652705725 Energy: 0.42609169391669677 Energy: 0.3948832465275871 Energy: 0.3492896640937781 Energy: 0.40481676115699555 Energy: 0.3492896640937781 Energy: 0.40481676115699555 Energy: 0.3492896640943079 Energy: 0.40481676115699555 Energy: 0.42797024729079264 Energy: 0.429871803221247 Energy: 0.427970247292382 Energy: 0.429871803221247 Energy: 0.4279702472918522 Energy: 0.429871803221247 Energy: 0.3877391171812212 Energy: 0.385706614398539 Energy: 0.38773911718016163 Energy: 0.385706614398539 Energy: 0.3877391171812212 Energy: 0.385706614398539 Energy: 0.37230673622283894 Energy: 0.392194664325753 Energy: 0.37230673622283894 Energy: 0.392194664325753 Energy: 0.37230673622283894 Energy: 0.39219466432628286 Energy: 0.44028064240372755 Energy: 0.4473349628596263 Energy: 0.4402806424047871 Energy: 0.4473349628596263 Energy: 0.4402806424047871 Energy: 0.4473349628596263 Energy: 0.417301076335793 Energy: 0.3656719858894778 Energy: 0.417301076335793 Energy: 0.3656719858900076 Energy: 0.417301076335793 Energy: 0.3656719858900076 Energy: 0.3922486483505915 Energy: 0.4391750039070849 Energy: 0.3922486483505915 Energy: 0.4391750039070849 Energy: 0.3922486483505915 Energy: 0.43917500390655506 Energy: 0.42322477463603564 Energy: 0.43490184477898175 Energy: 0.423224774634976 Energy: 0.43490184477898175 Energy: 0.42322477463550584 Energy: 0.43490184477898175 Energy: 0.4165466316784651 Energy: 0.35401796610131914 Energy: 0.4165466316784651 Energy: 0.35401796610131914 Energy: 0.4165466316779353 Energy: 0.35401796610131914 Energy: 0.3211841124471326 Energy: 0.44325901700911335 Energy: 0.32118411244766243 Energy: 0.44325901700911335 Energy: 0.321184112448722 Energy: 0.44325901700911335 Energy: 0.403550426993232 Energy: 0.41279660721926126 Energy: 0.40355042699270227 Energy: 0.41279660721873146 Energy: 0.4035504269937618 Energy: 0.41279660721873146 Energy: 0.41685850719730805 Energy: 0.35028489288262127 Energy: 0.4168585071983676 Energy: 0.35028489288262127 Energy: 0.41685850719783785 Energy: 0.35028489288262127 Energy: 0.40852231949228285 Energy: 0.4240813943914252 Energy: 0.4085223194912233 Energy: 0.424081394391955 Energy: 0.40852231949228285 Energy: 0.4240813943914252 Energy: 0.40420347698796477 Energy: 0.39953146259820904 Energy: 0.40420347698849457 Energy: 0.39953146259767924 Energy: 0.40420347698849457 Energy: 0.39953146259820904 Energy: 0.4033327789781883 Energy: 0.40135355676261425 Energy: 0.40333277897924796 Energy: 0.40135355676261425 Energy: 0.4033327789765989 Energy: 0.40135355676208445 Energy: 0.40743576194128484 Energy: 0.41022341760511244 Energy: 0.40743576194181463 Energy: 0.41022341760511244 Energy: 0.4074357619423444 Energy: 0.4102234176056423 Energy: 0.4126880483828066 Energy: 0.3408196904473478 Energy: 0.4126880483828066 Energy: 0.3408196904478776 Energy: 0.41268804838174694 Energy: 0.3408196904468179 Energy: 0.41772655021384686 Energy: 0.42089968337909467 Energy: 0.4177265502143767 Energy: 0.42089968337909467 Energy: 0.41772655021543637 Energy: 0.42089968337909467 Energy: 0.40383190183531875 Energy: 0.4201382498561427 Energy: 0.40383190183584855 Energy: 0.4201382498556128 Energy: 0.40383190183584855 Energy: 0.4201382498556128 Energy: 0.4231370074782981 Energy: 0.340838958131471 Energy: 0.4231370074782981 Energy: 0.340838958131471 Energy: 0.4231370074793576 Energy: 0.340838958131471 Energy: 0.42418269046933615 Energy: 0.43671509813896037 Energy: 0.42418269047092555 Energy: 0.43671509813896037 Energy: 0.4241826904703957 Energy: 0.43671509813896037 Energy: 0.4007560516401009 Energy: 0.39957923493356345 Energy: 0.40075605164063066 Energy: 0.39957923493356345 Energy: 0.40075605164116046 Energy: 0.39957923493356345 Energy: 0.4254418899888921 Energy: 0.36706674320490645 Energy: 0.42544188998995175 Energy: 0.36706674320490645 Energy: 0.4254418899894219 Energy: 0.36706674320437666 Energy: 0.4427774080781333 Energy: 0.42749475336405396 Energy: 0.4427774080791929 Energy: 0.42749475336405396 Energy: 0.44277740807866317 Energy: 0.42749475336405396 Energy: 0.3814483541288269 Energy: 0.41978372945316117 Energy: 0.3814483541293567 Energy: 0.41978372945316117 Energy: 0.3814483541288269 Energy: 0.41978372945316117 Energy: 0.4455252186123487 Energy: 0.4079664398207337 Energy: 0.44552521861287847 Energy: 0.4079664398207337 Energy: 0.4455252186118188 Energy: 0.4079664398207337 minimum gb energy = 0.3211841124471326 eV minimum distance = 2.39367458525534 Angstroms sigma value = 67 ======================================== theta = 121.00758300686714 ======================================== Energy: 0.5424045767740246 Energy: 0.5404438754144842 Energy: 0.5424045767740246 Energy: 0.5404438754144842 Energy: 0.5424045767755344 Energy: 0.5404438754144842 Energy: 0.505153884014842 Energy: 0.515698227043298 Energy: 0.5051538840171066 Energy: 0.515698227043298 Energy: 0.5051538840125772 Energy: 0.515698227043298 Energy: 0.5549505648744099 Energy: 0.5320566662913684 Energy: 0.5549505648728998 Energy: 0.5320566662913684 Energy: 0.5549505648744099 Energy: 0.5320566662913684 Energy: 0.538381647272885 Energy: 0.5133705131436285 Energy: 0.5383816472706202 Energy: 0.5133705131436285 Energy: 0.538381647272885 Energy: 0.5133705131436285 Energy: 0.4587409578328408 Energy: 0.4943665280382785 Energy: 0.4587409578328408 Energy: 0.4943665280382785 Energy: 0.4587409578320859 Energy: 0.4943665280367687 Energy: 0.5378706003973232 Energy: 0.5372815398700125 Energy: 0.537870600398078 Energy: 0.5372815398692576 Energy: 0.5378706003973232 Energy: 0.5372815398700125 Energy: 0.5368511619240998 Energy: 0.49626532636982434 Energy: 0.5368511619240998 Energy: 0.49626532636982434 Energy: 0.5368511619248546 Energy: 0.49626532637057924 Energy: 0.48495193956247457 Energy: 0.49599757771725994 Energy: 0.48495193956171967 Energy: 0.49599757771801484 Energy: 0.4849519395602099 Energy: 0.49599757771725994 Energy: 0.5529085142935237 Energy: 0.5621925482193421 Energy: 0.5529085142927688 Energy: 0.5621925482216067 Energy: 0.5529085142927688 Energy: 0.5621925482200969 Energy: 0.5357616730305504 Energy: 0.4690704077884514 Energy: 0.5357616730297955 Energy: 0.46907040778920633 Energy: 0.5357616730297955 Energy: 0.4690704077899613 Energy: 0.5085790911906563 Energy: 0.5389713860343163 Energy: 0.5085790911921662 Energy: 0.5389713860343163 Energy: 0.5085790911899013 Energy: 0.5389713860343163 Energy: 0.5022123454977255 Energy: 0.5245175504465375 Energy: 0.5022123454984805 Energy: 0.5245175504465375 Energy: 0.5022123454977255 Energy: 0.5245175504465375 Energy: 0.5302474562789693 Energy: 0.5048621631405974 Energy: 0.5302474562782143 Energy: 0.5048621631413523 Energy: 0.5302474562789693 Energy: 0.5048621631413523 Energy: 0.4976022558331071 Energy: 0.5359513939385006 Energy: 0.4976022558323521 Energy: 0.5359513939385006 Energy: 0.49760225583386203 Energy: 0.5359513939385006 Energy: 0.4955842039206968 Energy: 0.49757142167395035 Energy: 0.4955842039222067 Energy: 0.49757142167395035 Energy: 0.4955842039206968 Energy: 0.49757142167395035 Energy: 0.49418700720869396 Energy: 0.5130557190620441 Energy: 0.4941870072094489 Energy: 0.513055719062799 Energy: 0.49418700721020375 Energy: 0.513055719062799 Energy: 0.5159270382744218 Energy: 0.5362834458348368 Energy: 0.5159270382744218 Energy: 0.5362834458348368 Energy: 0.5159270382736669 Energy: 0.5362834458348368 Energy: 0.5022201478404676 Energy: 0.49552974896418367 Energy: 0.5022201478412225 Energy: 0.4955297489634287 Energy: 0.5022201478412225 Energy: 0.49552974896418367 Energy: 0.5344659323663986 Energy: 0.5400831238276153 Energy: 0.5344659323686634 Energy: 0.5400831238283701 Energy: 0.5344659323671535 Energy: 0.5400831238283701 Energy: 0.4543006275581381 Energy: 0.5384148530548483 Energy: 0.4543006275573831 Energy: 0.5384148530548483 Energy: 0.4543006275573831 Energy: 0.5384148530548483 Energy: 0.5464130807813464 Energy: 0.4703557166759954 Energy: 0.5464130807821014 Energy: 0.4703557166759954 Energy: 0.5464130807821014 Energy: 0.4703557166767504 Energy: 0.5536386858243459 Energy: 0.5634480163211508 Energy: 0.5536386858220812 Energy: 0.5634480163211508 Energy: 0.5536386858205714 Energy: 0.5634480163211508 Energy: 0.47789277433592464 Energy: 0.5266810569741681 Energy: 0.4778927743351698 Energy: 0.5266810569741681 Energy: 0.47789277433592464 Energy: 0.526681056974923 minimum gb energy = 0.4543006275573831 eV minimum distance = 2.39779051880109 Angstroms sigma value = 33 ======================================== theta = 124.1232945407953 ======================================== Energy: 0.6128456316165842 Energy: 0.5473652875483056 Energy: 0.6128456316170631 Energy: 0.5473652875483056 Energy: 0.6128456316170631 Energy: 0.5473652875487846 Energy: 0.5677729788370618 Energy: 0.5995541187399896 Energy: 0.5677729788384986 Energy: 0.5995541187404686 Energy: 0.5677729788370618 Energy: 0.5995541187399896 Energy: 0.5967817133640617 Energy: 0.5990019900910631 Energy: 0.5967817133640617 Energy: 0.5990019900910631 Energy: 0.5967817133640617 Energy: 0.5990019900905842 Energy: 0.6104239053346967 Energy: 0.5919303479627309 Energy: 0.6104239053361333 Energy: 0.5919303479627309 Energy: 0.6104239053346967 Energy: 0.5919303479627309 Energy: 0.551009444193403 Energy: 0.5760759816835641 Energy: 0.5510094441929242 Energy: 0.5760759816826063 Energy: 0.5510094441929242 Energy: 0.5760759816830854 Energy: 0.6357854664313245 Energy: 0.6170921015266521 Energy: 0.635785466429409 Energy: 0.6170921015261731 Energy: 0.6357854664308458 Energy: 0.6170921015261731 Energy: 0.5636308308560418 Energy: 0.5568507454287037 Energy: 0.5636308308584362 Energy: 0.5568507454287037 Energy: 0.5636308308565208 Energy: 0.5568507454282249 Energy: 0.5745377207973816 Energy: 0.6170747074529862 Energy: 0.5745377207954662 Energy: 0.6170747074529862 Energy: 0.574537720795945 Energy: 0.6170747074529862 Energy: 0.6077380242224365 Energy: 0.6132147363011732 Energy: 0.6077380242233944 Energy: 0.6132147363011732 Energy: 0.6077380242229155 Energy: 0.6132147363011732 Energy: 0.5996504861200828 Energy: 0.594797894076377 Energy: 0.5996504861215195 Energy: 0.594797894076377 Energy: 0.599650486119125 Energy: 0.594797894076377 Energy: 0.6197014861483118 Energy: 0.6007222960276882 Energy: 0.6197014861502275 Energy: 0.6007222960281672 Energy: 0.6197014861492697 Energy: 0.6007222960281672 Energy: 0.5649264779033705 Energy: 0.5757629179418253 Energy: 0.5649264779024127 Energy: 0.5757629179418253 Energy: 0.5649264779033705 Energy: 0.5757629179413464 Energy: 0.6101527456977857 Energy: 0.5683773230422426 Energy: 0.6101527456997013 Energy: 0.5683773230417637 Energy: 0.6101527456997013 Energy: 0.5683773230417637 Energy: 0.5775461440024207 Energy: 0.5973652150392201 Energy: 0.5775461440043362 Energy: 0.5973652150392201 Energy: 0.5775461440038573 Energy: 0.5973652150392201 Energy: 0.5721227912778529 Energy: 0.5740832293747502 Energy: 0.5721227912783319 Energy: 0.5740832293747502 Energy: 0.5721227912778529 Energy: 0.5740832293747502 Energy: 0.6107389424752808 Energy: 0.6062719916166744 Energy: 0.6107389424738441 Energy: 0.6062719916161956 Energy: 0.6107389424738441 Energy: 0.6062719916161956 Energy: 0.5516922755910931 Energy: 0.598332712131514 Energy: 0.5516922755910931 Energy: 0.598332712131514 Energy: 0.5516922755925298 Energy: 0.598332712131035 Energy: 0.6079707125266262 Energy: 0.6056250494996459 Energy: 0.6079707125261473 Energy: 0.6056250494996459 Energy: 0.6079707125251895 Energy: 0.6056250495001249 Energy: 0.5635436193694946 Energy: 0.5639373660466034 Energy: 0.5635436193709314 Energy: 0.5639373660451666 Energy: 0.5635436193709314 Energy: 0.5639373660470822 Energy: 0.5745355695203377 Energy: 0.5993282207205519 Energy: 0.5745355695227323 Energy: 0.5993282207205519 Energy: 0.5745355695203377 Energy: 0.599328220720073 Energy: 0.6041117026832842 Energy: 0.6031327848297062 Energy: 0.6041117026828052 Energy: 0.6031327848297062 Energy: 0.604111702683763 Energy: 0.603132784830185 Energy: 0.5720714475528385 Energy: 0.5274503797312178 Energy: 0.5720714475523596 Energy: 0.5274503797312178 Energy: 0.5720714475514018 Energy: 0.5274503797307388 Energy: 0.6012435029452364 Energy: 0.6007706884332455 Energy: 0.6012435029437998 Energy: 0.6007706884332455 Energy: 0.6012435029442786 Energy: 0.6007706884327666 Energy: 0.5997362850664332 Energy: 0.5739174098078632 Energy: 0.5997362850678699 Energy: 0.5739174098078632 Energy: 0.5997362850664332 Energy: 0.5739174098078632 Energy: 0.5658113124366148 Energy: 0.5823022675186956 Energy: 0.5658113124366148 Energy: 0.5823022675191746 Energy: 0.565811312435657 Energy: 0.5823022675191746 Energy: 0.6015801931644168 Energy: 0.6041317848598088 Energy: 0.6015801931639814 Energy: 0.6041317848593298 Energy: 0.6015801931653746 Energy: 0.6041317848598088 Energy: 0.563755816744902 Energy: 0.5740379563382013 Energy: 0.5637558167453809 Energy: 0.5740379563382013 Energy: 0.5637558167453809 Energy: 0.5740379563377225 Energy: 0.6058405746589973 Energy: 0.6443566092470487 Energy: 0.6058405746570817 Energy: 0.64435660924657 Energy: 0.6058405746585185 Energy: 0.6443566092470487 Energy: 0.5735845358569712 Energy: 0.5763539603004173 Energy: 0.573584535857929 Energy: 0.5763539603008963 Energy: 0.573584535858408 Energy: 0.5763539603004173 Energy: 0.5590350024270985 Energy: 0.5564661441101592 Energy: 0.5590350024223094 Energy: 0.5564661441101592 Energy: 0.5590350024280563 Energy: 0.556466144110638 Energy: 0.6450227251594213 Energy: 0.6317321337405574 Energy: 0.6450227251575057 Energy: 0.6317321337405574 Energy: 0.6450227251613369 Energy: 0.6317321337405574 Energy: 0.5503161845056899 Energy: 0.5992523161566112 Energy: 0.5503161845032953 Energy: 0.5992523161566112 Energy: 0.5503161845052109 Energy: 0.5992523161566112 Energy: 0.6044617410101366 Energy: 0.5850499214066179 Energy: 0.604461741008221 Energy: 0.5850499214066179 Energy: 0.6044617410072631 Energy: 0.585049921406139 Energy: 0.5724552588148709 Energy: 0.599357372105555 Energy: 0.5724552588158287 Energy: 0.599357372105555 Energy: 0.572455258814392 Energy: 0.5993573721060338 Energy: 0.5735633004552466 Energy: 0.596964236991705 Energy: 0.5735633004528522 Energy: 0.5969642369907473 Energy: 0.5735633004552466 Energy: 0.596964236991705 Energy: 0.6064256982213152 Energy: 0.5715730751433605 Energy: 0.6064256982189207 Energy: 0.5715730751428817 Energy: 0.6064256982208364 Energy: 0.5715730751438395 Energy: 0.5624173189462025 Energy: 0.5667442171752224 Energy: 0.5624173189466813 Energy: 0.5667442171742647 Energy: 0.5624173189462025 Energy: 0.5667442171747435 minimum gb energy = 0.5274503797307388 eV minimum distance = 2.37815336003178 Angstroms sigma value = 41 ======================================== theta = 129.5211963586422 ======================================== Energy: 0.720813677966499 Energy: 0.715205016592742 Energy: 0.7208136779678065 Energy: 0.715205016592742 Energy: 0.720813677966499 Energy: 0.715205016592742 Energy: 0.6817720112984145 Energy: 0.7033133163033699 Energy: 0.6817720112984145 Energy: 0.7033133163020625 Energy: 0.6817720112984145 Energy: 0.7033133163007549 Energy: 0.7581077474333909 Energy: 0.7011707209504727 Energy: 0.7581077474346984 Energy: 0.7011707209504727 Energy: 0.7581077474333909 Energy: 0.7011707209504727 Energy: 0.7175572204766361 Energy: 0.7014164533153028 Energy: 0.7175572204766361 Energy: 0.7014164533153028 Energy: 0.7175572204779435 Energy: 0.7014164533166104 Energy: 0.6694389115355809 Energy: 0.715190658554634 Energy: 0.6694389115355809 Energy: 0.715190658554634 Energy: 0.6694389115355809 Energy: 0.715190658554634 Energy: 0.7376983664728824 Energy: 0.7360900079443075 Energy: 0.7376983664728824 Energy: 0.7360900079443075 Energy: 0.7376983664728824 Energy: 0.7360900079443075 Energy: 0.7058562146010879 Energy: 0.6817466771166437 Energy: 0.7058562146010879 Energy: 0.6817466771166437 Energy: 0.7058562146010879 Energy: 0.6817466771166437 Energy: 0.6989152127040105 Energy: 0.7043494306116119 Energy: 0.6989152127040105 Energy: 0.7043494306116119 Energy: 0.6989152127040105 Energy: 0.7043494306116119 Energy: 0.6816404208216007 Energy: 0.6825701082593493 Energy: 0.6816404208216007 Energy: 0.6825701082593493 Energy: 0.6816404208229082 Energy: 0.6825701082580417 Energy: 0.7072398742465666 Energy: 0.6957595517498286 Energy: 0.7072398742465666 Energy: 0.6957595517498286 Energy: 0.7072398742478742 Energy: 0.695759551748521 Energy: 0.6809201290170132 Energy: 0.7014334998067739 Energy: 0.680920129014398 Energy: 0.7014334998067739 Energy: 0.6809201290170132 Energy: 0.7014334998067739 Energy: 0.6951517973352291 Energy: 0.7036004799953435 Energy: 0.6951517973378443 Energy: 0.7036004799953435 Energy: 0.6951517973352291 Energy: 0.7036004799953435 Energy: 0.7125645092721801 Energy: 0.7227528436378042 Energy: 0.7125645092734876 Energy: 0.7227528436378042 Energy: 0.7125645092734876 Energy: 0.7227528436378042 Energy: 0.6676562945154929 Energy: 0.7045517498401647 Energy: 0.6676562945154929 Energy: 0.7045517498401647 Energy: 0.6676562945154929 Energy: 0.7045517498401647 minimum gb energy = 0.6676562945154929 eV minimum distance = 2.35735770993266 Angstroms sigma value = 11 ======================================== theta = 135.99657265110037 ======================================== Energy: 0.8253466165596808 Energy: 0.8039725969275114 Energy: 0.8253466165585319 Energy: 0.8039725969275114 Energy: 0.8253466165591063 Energy: 0.8039725969275114 Energy: 0.7641584214158582 Energy: 0.7868318324113762 Energy: 0.7641584214164326 Energy: 0.7868318324113762 Energy: 0.7641584214158582 Energy: 0.7868318324108018 Energy: 0.8311181074966835 Energy: 0.7808063741851424 Energy: 0.8311181074961091 Energy: 0.7808063741851424 Energy: 0.8311181074961091 Energy: 0.7808063741851424 Energy: 0.7844978171972508 Energy: 0.7796332776120256 Energy: 0.7844978171949532 Energy: 0.7796332776120256 Energy: 0.7844978171961018 Energy: 0.7796332776120256 Energy: 0.8080895406200593 Energy: 0.7857568158568913 Energy: 0.808089540621208 Energy: 0.7857568158563168 Energy: 0.8080895406206338 Energy: 0.7857568158563168 Energy: 0.7838960195547368 Energy: 0.7914931201122583 Energy: 0.7838960195558854 Energy: 0.7914931201122583 Energy: 0.7838960195547368 Energy: 0.7914931201122583 Energy: 0.7861128505451089 Energy: 0.7814555025320141 Energy: 0.7861128505439601 Energy: 0.7814555025320141 Energy: 0.7861128505451089 Energy: 0.7814555025320141 Energy: 0.7809172956262477 Energy: 0.7855980714896829 Energy: 0.7809172956262477 Energy: 0.7855980714902573 Energy: 0.7809172956262477 Energy: 0.7855980714902573 Energy: 0.7839387449999161 Energy: 0.7866494609137122 Energy: 0.7839387449999161 Energy: 0.7866494609137122 Energy: 0.7839387449993417 Energy: 0.7866494609137122 Energy: 0.777668108086911 Energy: 0.7961462530013347 Energy: 0.7776681080857623 Energy: 0.7961462530013347 Energy: 0.7776681080874854 Energy: 0.7961462530013347 Energy: 0.7792725332036036 Energy: 0.788692891474312 Energy: 0.7792725332030291 Energy: 0.788692891474312 Energy: 0.7792725332030291 Energy: 0.788692891474312 Energy: 0.8059709445774148 Energy: 0.7959761440316381 Energy: 0.8059709445762661 Energy: 0.7959761440322125 Energy: 0.8059709445768405 Energy: 0.7959761440322125 Energy: 0.7840597851758407 Energy: 0.7905998937473273 Energy: 0.7840597851769894 Energy: 0.7905998937473273 Energy: 0.7840597851746918 Energy: 0.7905998937473273 Energy: 0.8127914910263739 Energy: 0.7668357000030429 Energy: 0.8127914910257995 Energy: 0.7668357000030429 Energy: 0.8127914910269484 Energy: 0.7668357000030429 Energy: 0.7688310595654287 Energy: 0.7708559204586497 Energy: 0.76883105956428 Energy: 0.7708559204592241 Energy: 0.76883105956428 Energy: 0.7708559204586497 Energy: 0.7861165445285423 Energy: 0.787015335765415 Energy: 0.7861165445302655 Energy: 0.7870153357659895 Energy: 0.7861165445302655 Energy: 0.7870153357659895 Energy: 0.7724841375755184 Energy: 0.783292292633123 Energy: 0.7724841375755184 Energy: 0.7832922926336974 Energy: 0.7724841375743696 Energy: 0.7832922926336974 Energy: 0.788004490129033 Energy: 0.8077272500590212 Energy: 0.7880044901301818 Energy: 0.8077272500595954 Energy: 0.7880044901301818 Energy: 0.8077272500595954 Energy: 0.7827897355057147 Energy: 0.7793551326513323 Energy: 0.7827897355068635 Energy: 0.7793551326519067 Energy: 0.782789735506289 Energy: 0.7793551326519067 Energy: 0.7813619689976431 Energy: 0.7860610757406671 Energy: 0.7813619689982174 Energy: 0.7860610757406671 Energy: 0.7813619689976431 Energy: 0.7860610757412414 Energy: 0.7640597741535443 Energy: 0.7745200500650348 Energy: 0.7640597741541187 Energy: 0.7745200500650348 Energy: 0.7640597741535443 Energy: 0.7745200500650348 Energy: 0.7774575645752279 Energy: 0.8010439300578753 Energy: 0.7774575645752279 Energy: 0.8010439300578753 Energy: 0.7774575645746534 Energy: 0.8010439300578753 Energy: 0.793224516058211 Energy: 0.7817150904212238 Energy: 0.793224516058211 Energy: 0.7817150904217981 Energy: 0.7932245160593597 Energy: 0.7817150904212238 Energy: 0.7995775149538681 Energy: 0.7836097287046339 Energy: 0.7995775149532935 Energy: 0.7836097287046339 Energy: 0.799577514952719 Energy: 0.7836097287046339 Energy: 0.7794089671644623 Energy: 0.792053521463801 Energy: 0.7794089671644623 Energy: 0.7920535214632265 Energy: 0.779408967165611 Energy: 0.7920535214632265 Energy: 0.7714034580716905 Energy: 0.7853903144940148 Energy: 0.7714034580693929 Energy: 0.7853903144945892 Energy: 0.7714034580705417 Energy: 0.7853903144940148 Energy: 0.7837027768235123 Energy: 0.8175971436064622 Energy: 0.7837027768240867 Energy: 0.8175971436064622 Energy: 0.7837027768240867 Energy: 0.8175971436064622 Energy: 0.7841122761694791 Energy: 0.7735871542187595 Energy: 0.7841122761700535 Energy: 0.7735871542187595 Energy: 0.7841122761700535 Energy: 0.7735871542187595 Energy: 0.7889799358649356 Energy: 0.7676176502879022 Energy: 0.7889799358643612 Energy: 0.7676176502879022 Energy: 0.7889799358649356 Energy: 0.7676176502873278 Energy: 0.7656321563520653 Energy: 0.764582946747523 Energy: 0.7656321563520653 Energy: 0.764582946747523 Energy: 0.7656321563526397 Energy: 0.7645829467480975 Energy: 0.7785486003974089 Energy: 0.8238268963663212 Energy: 0.7785486003985577 Energy: 0.8238268963663212 Energy: 0.7785486003985577 Energy: 0.8238268963663212 minimum gb energy = 0.7640597741535443 eV minimum distance = 2.32865419259846 Angstroms sigma value = 57 ======================================== theta = 141.05755873101862 ======================================== Energy: 0.7637238868342694 Energy: 0.7882484850037267 Energy: 0.7637238868342694 Energy: 0.7882484850037267 Energy: 0.7637238868342694 Energy: 0.7882484850037267 Energy: 0.7666166282408935 Energy: 0.7899315721844763 Energy: 0.7666166282408935 Energy: 0.7899315721844763 Energy: 0.7666166282408935 Energy: 0.7899315721844763 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.820766389821849 Energy: 0.7906785415547277 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.7542416055123727 Energy: 0.917267277858891 Energy: 0.7542416055123727 Energy: 0.917267277858891 Energy: 0.7542416055123727 Energy: 0.917267277858891 Energy: 0.8208002570835381 Energy: 0.7907080708800636 Energy: 0.8208002570825159 Energy: 0.7907080708800636 Energy: 0.8208002570835381 Energy: 0.7907080708800636 Energy: 0.7665990180689866 Energy: 0.8128510145709592 Energy: 0.7665990180700087 Energy: 0.8128510145719815 Energy: 0.7665990180700087 Energy: 0.8128510145709592 Energy: 0.7637238868363138 Energy: 0.7882484850016823 Energy: 0.7637238868363138 Energy: 0.7882484850027044 Energy: 0.7637238868363138 Energy: 0.7882484850027044 Energy: 0.7666166282388492 Energy: 0.789931572183454 Energy: 0.7666166282398713 Energy: 0.7899315721814097 Energy: 0.7666166282388492 Energy: 0.789931572183454 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.7542416055103285 Energy: 0.8602993685067252 Energy: 0.7542416055103285 Energy: 0.8602993685067252 Energy: 0.7542416055103285 Energy: 0.8602993685067252 Energy: 0.8208002570814938 Energy: 0.7907080708821078 Energy: 0.8208002570804717 Energy: 0.7907080708821078 Energy: 0.8208002570814938 Energy: 0.7907080708821078 Energy: 0.7665990180679644 Energy: 0.8666837169353035 Energy: 0.7665990180669422 Energy: 0.8666837169332592 Energy: 0.7665990180669422 Energy: 0.7837983229857552 Energy: 0.7637238868352915 Energy: 0.7882484850037267 Energy: 0.7637238868342694 Energy: 0.7882484850037267 Energy: 0.7637238868342694 Energy: 0.7882484850027044 Energy: 0.7666166282419157 Energy: 0.789931572183454 Energy: 0.7666166282408935 Energy: 0.7899315721844763 Energy: 0.7666166282408935 Energy: 0.789931572183454 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.8207663898208268 Energy: 0.7906785415547277 Energy: 0.7542416055123727 Energy: 0.8602993685067252 Energy: 0.7542416055123727 Energy: 0.8602993685067252 Energy: 0.7542416055123727 Energy: 0.8602993685067252 Energy: 0.8208002570835381 Energy: 0.7907080708800636 Energy: 0.8208002570825159 Energy: 0.7907080708800636 Energy: 0.8208002570835381 Energy: 0.7907080708800636 minimum gb energy = 0.7542416055103285 eV minimum distance = 2.35181996463131 Angstroms sigma value = 9 ======================================== theta = 148.41366190347208 ======================================== Energy: 0.8049012669565984 Energy: 0.7923631915072531 Energy: 0.8049012669599367 Energy: 0.7923631915055839 Energy: 0.8049012669599367 Energy: 0.7923631915047493 Energy: 0.8168373687184238 Energy: 0.8000002119246568 Energy: 0.8168373687184238 Energy: 0.8000002119238222 Energy: 0.8168373687192585 Energy: 0.8000002119238222 Energy: 0.830398366044337 Energy: 0.800360977888153 Energy: 0.8303983660426679 Energy: 0.8003609778889875 Energy: 0.8303983660435025 Energy: 0.800360977888153 Energy: 0.7802623157877364 Energy: 0.873412331621286 Energy: 0.780262315788571 Energy: 0.873412331621286 Energy: 0.780262315788571 Energy: 0.8734123316204512 Energy: 0.8217524119296143 Energy: 0.8078996811422896 Energy: 0.8217524119287798 Energy: 0.8078996811431243 Energy: 0.8217524119296143 Energy: 0.8078996811422896 Energy: 0.8385566175643111 Energy: 0.7845808339285647 Energy: 0.8385566175643111 Energy: 0.7845808339285647 Energy: 0.8385566175651457 Energy: 0.7845808339285647 Energy: 0.7786372257612749 Energy: 0.8502588380366899 Energy: 0.7786372257612749 Energy: 0.8502588380366899 Energy: 0.7786372257604404 Energy: 0.8502588380366899 Energy: 0.803048093142119 Energy: 0.8364991282781019 Energy: 0.8030480931429537 Energy: 0.8364991282781019 Energy: 0.8030480931404499 Energy: 0.8364991282781019 Energy: 0.8636978797069746 Energy: 0.8075102586740014 Energy: 0.8636978797069746 Energy: 0.8075102586740014 Energy: 0.8636978797069746 Energy: 0.8075102586740014 Energy: 0.7801850374645649 Energy: 0.8186861353988034 Energy: 0.7801850374637683 Energy: 0.8186861353988034 Energy: 0.7801850374645649 Energy: 0.8186861353979689 Energy: 0.8204642804080498 Energy: 0.8167011374388737 Energy: 0.8204642804105535 Energy: 0.8167011374388737 Energy: 0.8204642804080498 Energy: 0.8167011374388737 Energy: 0.8436007676493424 Energy: 0.7839468625351951 Energy: 0.843600767650177 Energy: 0.7839468625351951 Energy: 0.843600767650177 Energy: 0.7839468625351951 Energy: 0.7842324721640698 Energy: 0.8674870455304782 Energy: 0.7842324721640698 Energy: 0.8674870455304782 Energy: 0.7842324721649042 Energy: 0.8674870455304782 Energy: 0.8066365790875377 Energy: 0.8238790796503378 Energy: 0.8066365790875377 Energy: 0.8238790796503378 Energy: 0.8066365790867033 Energy: 0.8238790796503378 Energy: 0.8663025551566399 Energy: 0.782708148358799 Energy: 0.8663025551558055 Energy: 0.7827081483579644 Energy: 0.8663025551549709 Energy: 0.782708148358799 Energy: 0.8072083862695885 Energy: 0.8342373983916767 Energy: 0.807208386268754 Energy: 0.8342373983916767 Energy: 0.8072083862695885 Energy: 0.8342373983916767 Energy: 0.8112307675399213 Energy: 0.8453487600992904 Energy: 0.8112307675382522 Energy: 0.8453487600992904 Energy: 0.8112307675399213 Energy: 0.845348760100125 Energy: 0.901608659961939 Energy: 0.7840953029524443 Energy: 0.901608659961939 Energy: 0.784095302953279 Energy: 0.901608659961939 Energy: 0.7840953029524443 Energy: 0.8119070507246836 Energy: 0.8237660453346234 Energy: 0.8119070507221798 Energy: 0.8237660453346234 Energy: 0.811907050723849 Energy: 0.8237660453346234 Energy: 0.7904491215626722 Energy: 0.7944540701006503 Energy: 0.7904491215618377 Energy: 0.7944540700998157 Energy: 0.7904491215626722 Energy: 0.7944540700998157 Energy: 0.8523397878545168 Energy: 0.7886769951502958 Energy: 0.852339787852013 Energy: 0.7886769951494613 Energy: 0.8523397878528476 Energy: 0.7886769951502958 minimum gb energy = 0.7786372257604404 eV minimum distance = 2.34671996084307 Angstroms sigma value = 27 ======================================== theta = 153.4746479833903 ======================================== Energy: 0.7948740885490156 Energy: 0.8213088350594454 Energy: 0.7948740885476088 Energy: 0.8213088350594454 Energy: 0.794874088548312 Energy: 0.8213088350601487 Energy: 0.7858985027509274 Energy: 0.7834074894685873 Energy: 0.7858985027516309 Energy: 0.7834074894685873 Energy: 0.7858985027509274 Energy: 0.7834074894685873 Energy: 0.8095507239817087 Energy: 0.8024615663575774 Energy: 0.8095507239817087 Energy: 0.8024615663575774 Energy: 0.8095507239817087 Energy: 0.8024615663575774 Energy: 0.7753982375515183 Energy: 0.7894550002036862 Energy: 0.7753982375515183 Energy: 0.7894550002029826 Energy: 0.7753982375515183 Energy: 0.7894550002036862 Energy: 0.775225221802184 Energy: 0.8052605888869454 Energy: 0.775225221802184 Energy: 0.8052605888869454 Energy: 0.7752252218014806 Energy: 0.8052605888869454 Energy: 0.8001434143777921 Energy: 0.7652561414730559 Energy: 0.800143414379199 Energy: 0.7652561414730559 Energy: 0.8001434143784956 Energy: 0.7652561414730559 Energy: 0.7655101072778798 Energy: 0.8058867828699999 Energy: 0.7655101072799904 Energy: 0.8058867828699999 Energy: 0.7655101072785834 Energy: 0.8058867828699999 Energy: 0.7876892384339391 Energy: 0.8106872593563733 Energy: 0.7876892384353461 Energy: 0.8106872593563733 Energy: 0.7876892384318287 Energy: 0.8106872593563733 Energy: 0.8069486814500897 Energy: 0.7652359420830612 Energy: 0.8069486814500897 Energy: 0.7652359420830612 Energy: 0.8069486814500897 Energy: 0.7652359420823577 Energy: 0.7627917273714079 Energy: 0.8124839926733449 Energy: 0.7627917273700009 Energy: 0.8124839926733449 Energy: 0.7627917273714079 Energy: 0.8124839926733449 Energy: 0.7630108786979525 Energy: 0.8055377449972763 Energy: 0.7630108786979525 Energy: 0.8055377449972763 Energy: 0.7630108786965454 Energy: 0.8055377449972763 Energy: 0.8064573424127863 Energy: 0.7654136568917781 Energy: 0.8064573424141933 Energy: 0.7654136568917781 Energy: 0.8064573424134898 Energy: 0.7654136568917781 Energy: 0.8064381742088635 Energy: 0.7929077177178895 Energy: 0.80643817420816 Energy: 0.7929077177192965 Energy: 0.8064381742088635 Energy: 0.7929077177185929 Energy: 0.7652226114241057 Energy: 0.8041149583682285 Energy: 0.7652226114241057 Energy: 0.8041149583682285 Energy: 0.7652226114248094 Energy: 0.8041149583682285 Energy: 0.803909210297981 Energy: 0.7651192032145775 Energy: 0.8039092102986847 Energy: 0.7651192032145775 Energy: 0.8039092102986847 Energy: 0.7651192032145775 Energy: 0.7920746911448198 Energy: 0.7935090895578244 Energy: 0.792074691145523 Energy: 0.7935090895571209 Energy: 0.792074691145523 Energy: 0.7935090895571209 Energy: 0.7754063486616896 Energy: 0.8088683831214633 Energy: 0.7754063486602825 Energy: 0.8088683831221667 Energy: 0.7754063486602825 Energy: 0.8088683831221667 Energy: 0.7881506813391356 Energy: 0.7974896024488601 Energy: 0.7881506813405424 Energy: 0.7974896024488601 Energy: 0.7881506813412459 Energy: 0.7974896024488601 Energy: 0.7870728885866745 Energy: 0.7733564554005762 Energy: 0.7870728885880494 Energy: 0.7733564554005762 Energy: 0.7870728885866745 Energy: 0.7733564554005762 Energy: 0.794874088552533 Energy: 0.8213088350601487 Energy: 0.7948740885518296 Energy: 0.8213088350594454 Energy: 0.7948740885532366 Energy: 0.8213088350601487 Energy: 0.7858985027537413 Energy: 0.7834074894735117 Energy: 0.7858985027537413 Energy: 0.7834074894735117 Energy: 0.7858985027537413 Energy: 0.7834074894735117 Energy: 0.8095507239810051 Energy: 0.802461566359688 Energy: 0.8095507239817087 Energy: 0.8024615663589846 Energy: 0.8095507239810051 Energy: 0.8024615663589846 Energy: 0.7753982375451868 Energy: 0.7894550002050933 Energy: 0.7753982375451868 Energy: 0.7894550002050933 Energy: 0.7753982375458903 Energy: 0.7894550002050933 Energy: 0.775225221800777 Energy: 0.805260588884835 Energy: 0.7752252218028874 Energy: 0.805260588884835 Energy: 0.7752252218028874 Energy: 0.8052605888855385 Energy: 0.800143414379199 Energy: 0.7652561414737593 Energy: 0.8001434143784956 Energy: 0.7652561414737593 Energy: 0.8001434143777921 Energy: 0.7652561414737593 minimum gb energy = 0.7627917273700009 eV minimum distance = 2.36182121713421 Angstroms sigma value = 19 ======================================== theta = 157.15649268207542 ======================================== Energy: 0.7768186667469504 Energy: 0.8055514588312421 Energy: 0.7768186667469504 Energy: 0.8055514588312421 Energy: 0.7768186667463433 Energy: 0.8055514588306347 Energy: 0.7713658902410709 Energy: 0.7698118077081296 Energy: 0.7713658902392492 Energy: 0.7698118077081296 Energy: 0.7713658902404636 Energy: 0.7698118077081296 Energy: 0.7998138507544562 Energy: 0.7398314373194288 Energy: 0.7998138507574926 Energy: 0.7398314373188215 Energy: 0.7998138507568852 Energy: 0.7398314373194288 Energy: 0.7497779030060048 Energy: 0.7896414832341176 Energy: 0.7497779030060048 Energy: 0.7896414832341176 Energy: 0.7497779030060048 Energy: 0.7896414832341176 Energy: 0.7693147780928609 Energy: 0.7737144407583195 Energy: 0.7693147780928609 Energy: 0.7737144407589268 Energy: 0.7693147780928609 Energy: 0.7737144407583195 Energy: 0.7810318365510901 Energy: 0.753831221502236 Energy: 0.7810318365498755 Energy: 0.753831221502236 Energy: 0.7810318365498755 Energy: 0.753831221502236 Energy: 0.7490419147559174 Energy: 0.7875556470332905 Energy: 0.7490419147559174 Energy: 0.7875556470345051 Energy: 0.7490419147547028 Energy: 0.7875556470345051 Energy: 0.7666378508023483 Energy: 0.7961343488687079 Energy: 0.7666378508029555 Energy: 0.7961343488687079 Energy: 0.7666378508035628 Energy: 0.7961343488687079 Energy: 0.8152053455050366 Energy: 0.7441193391989711 Energy: 0.8152053455050366 Energy: 0.7441193391989711 Energy: 0.8152053455044294 Energy: 0.7441193391989711 Energy: 0.767643189128253 Energy: 0.7656476678324305 Energy: 0.7676431891300748 Energy: 0.7656476678324305 Energy: 0.7676431891288603 Energy: 0.7656476678324305 Energy: 0.7470532415016876 Energy: 0.8113693794224988 Energy: 0.7470532415016876 Energy: 0.8113693794231058 Energy: 0.7470532415016876 Energy: 0.8113693794231058 Energy: 0.7779061148245549 Energy: 0.7441721099747963 Energy: 0.7779061148227332 Energy: 0.7441721099747963 Energy: 0.7779061148233404 Energy: 0.7441721099747963 Energy: 0.7530231112958554 Energy: 0.7532751197682914 Energy: 0.7530231112934265 Energy: 0.7532751197676841 Energy: 0.7530231113049365 Energy: 0.7532751197676841 Energy: 0.7473362651766211 Energy: 0.7905802948931349 Energy: 0.7473362651754066 Energy: 0.7905802948931349 Energy: 0.7473362651760139 Energy: 0.7905802948937423 Energy: 0.7830112914358996 Energy: 0.7482218730134715 Energy: 0.7830112914358996 Energy: 0.7482218730134715 Energy: 0.7830112914365068 Energy: 0.7482218730134715 Energy: 0.8125686393912682 Energy: 0.7395294964238651 Energy: 0.8125686393918756 Energy: 0.7395294964238651 Energy: 0.8125686393906612 Energy: 0.7395294964238651 Energy: 0.7497210137342649 Energy: 0.7874457331738016 Energy: 0.7497210137342649 Energy: 0.7874457331738016 Energy: 0.7497210137342649 Energy: 0.7874457331738016 Energy: 0.7771694621554727 Energy: 0.7867222839014246 Energy: 0.77716946215608 Energy: 0.7867222839020319 Energy: 0.77716946215608 Energy: 0.7867222839014246 Energy: 0.7975074537224243 Energy: 0.7542361028106197 Energy: 0.7975074537230316 Energy: 0.7542361028106197 Energy: 0.7975074537230316 Energy: 0.7542361028106197 Energy: 0.7504762305224527 Energy: 0.7839570239439113 Energy: 0.7504762305224527 Energy: 0.7839570239439113 Energy: 0.7504762305218455 Energy: 0.7839570239439113 Energy: 0.7429235281315353 Energy: 0.7999028396934292 Energy: 0.7429235281321426 Energy: 0.7999028396934292 Energy: 0.7429235281315353 Energy: 0.7999028396934292 Energy: 0.8243296380595461 Energy: 0.7401001659366028 Energy: 0.824329638058939 Energy: 0.7401001659366028 Energy: 0.824329638058939 Energy: 0.7401001659366028 Energy: 0.7789481238749282 Energy: 0.7597381253664428 Energy: 0.7789481238743209 Energy: 0.7597381253664428 Energy: 0.7789481238749282 Energy: 0.7597381253670501 Energy: 0.7781478912479308 Energy: 0.807853648881856 Energy: 0.7781478912485381 Energy: 0.807853648881856 Energy: 0.7781478912479308 Energy: 0.807853648881856 Energy: 0.8036279943092375 Energy: 0.7460062397519073 Energy: 0.8036279943092375 Energy: 0.7460062397525145 Energy: 0.8036279943098449 Energy: 0.7460062397519073 Energy: 0.7646491443140245 Energy: 0.7551013537829038 Energy: 0.7646491443146317 Energy: 0.7551013537829038 Energy: 0.7646491443140245 Energy: 0.7551013537829038 Energy: 0.742361566890326 Energy: 0.8090189294996447 Energy: 0.7423615668921476 Energy: 0.8090189294996447 Energy: 0.7423615668909331 Energy: 0.8090189295002519 Energy: 0.7806352922546023 Energy: 0.7590061476680416 Energy: 0.7806352922546023 Energy: 0.7590061476686488 Energy: 0.7806352922546023 Energy: 0.7590061476686488 Energy: 0.7994521585687615 Energy: 0.7535601146504616 Energy: 0.7994521585681543 Energy: 0.7535601146510689 Energy: 0.7994521585687615 Energy: 0.7535601146510689 minimum gb energy = 0.7395294964238651 eV minimum distance = 2.31977798543765 Angstroms sigma value = 101 ======================================== theta = 159.95002427584853 ======================================== Energy: 0.7545042403699285 Energy: 0.7673616876678252 Energy: 0.7545042403699285 Energy: 0.7673616876678252 Energy: 0.7545042403693947 Energy: 0.7673616876678252 Energy: 0.7599454974476268 Energy: 0.7448561719564215 Energy: 0.7599454974486944 Energy: 0.7448561719558877 Energy: 0.7599454974476268 Energy: 0.7448561719558877 Energy: 0.7533910947409558 Energy: 0.7099403065676652 Energy: 0.7533910947414896 Energy: 0.7099403065676652 Energy: 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0.7531002494703565 Energy: 0.7091530691926128 Energy: 0.7531002494719578 Energy: 0.709153069192079 Energy: 0.7531002494708902 Energy: 0.709153069192079 Energy: 0.7085790051436752 Energy: 0.7709996771260504 Energy: 0.7085790051447428 Energy: 0.7709996771265841 Energy: 0.7085790051442091 Energy: 0.7709996771265841 Energy: 0.7096433178507541 Energy: 0.7268803297416316 Energy: 0.7096433178523555 Energy: 0.7268803297416316 Energy: 0.7096433178507541 Energy: 0.7268803297421655 Energy: 0.757914195647109 Energy: 0.7057478180958302 Energy: 0.757914195647109 Energy: 0.7057478180958302 Energy: 0.757914195647109 Energy: 0.7057478180958302 Energy: 0.735105548820651 Energy: 0.7608119194494587 Energy: 0.7351055488211848 Energy: 0.7608119194489249 Energy: 0.7351055488211848 Energy: 0.7608119194494587 Energy: 0.7093803093259765 Energy: 0.8461307348917547 Energy: 0.7093803093265103 Energy: 0.8461307348912208 Energy: 0.7093803093259765 Energy: 0.8461307348917547 Energy: 0.764434913466889 Energy: 0.7080270911307174 Energy: 0.7644349134663553 Energy: 0.7080270911307174 Energy: 0.7644349134663553 Energy: 0.7080270911307174 Energy: 0.7768539017281673 Energy: 0.709099410320095 Energy: 0.776853901726032 Energy: 0.7090994103195613 Energy: 0.7768539017281673 Energy: 0.709099410320095 Energy: 0.7055277476852594 Energy: 0.783137471959768 Energy: 0.7055277476847256 Energy: 0.7831374719522948 Energy: 0.7055277476852594 Energy: 0.7831374719560315 Energy: 0.7665869037323629 Energy: 0.7215407404216451 Energy: 0.7665869037318293 Energy: 0.7215407404221788 Energy: 0.7665869037323629 Energy: 0.7215407404216451 Energy: 0.7493951795829652 Energy: 0.7091475901520697 Energy: 0.7493951795861437 Energy: 0.709147590151536 Energy: 0.7493951795872114 Energy: 0.7091475901520697 Energy: 0.7399340060713625 Energy: 0.7689351153591308 Energy: 0.7399340060692273 Energy: 0.7689351153591308 Energy: 0.7399340060718963 Energy: 0.768935115358597 Energy: 0.7399286165987622 Energy: 0.7257902194059946 Energy: 0.7399286165987622 Energy: 0.7257902194065284 Energy: 0.7399286165982284 Energy: 0.7257902194059946 Energy: 0.7848695217757248 Energy: 0.7060457975858109 Energy: 0.7848695217757248 Energy: 0.7060457975858109 Energy: 0.784869521775191 Energy: 0.7060457975858109 Energy: 0.7093308542849168 Energy: 0.7695156712834978 Energy: 0.7093308542849168 Energy: 0.769515671282964 Energy: 0.7093308542854506 Energy: 0.7695156712834978 Energy: 0.708900911674676 Energy: 0.7611570987112649 Energy: 0.708900911674676 Energy: 0.7611570987112649 Energy: 0.7089009116757437 Energy: 0.7611570987117987 Energy: 0.7733994440752873 Energy: 0.708624054692938 Energy: 0.7733994440758212 Energy: 0.7086240546934718 Energy: 0.7733994440758212 Energy: 0.708624054692938 Energy: 0.7638456601111515 Energy: 0.7087077537729437 Energy: 0.7638456601106176 Energy: 0.7087077537734775 Energy: 0.7638456601100838 Energy: 0.7087077537729437 minimum gb energy = 0.7055277476847256 eV minimum distance = 2.32529377910905 Angstroms sigma value = 33 ======================================== theta = 180.0 ======================================== Energy: 0.015489591857278853 Energy: 0.5816669537095098 Energy: 0.01548959185769773 Energy: 0.5816669537095098 Energy: 0.01548959185769773 Energy: 0.5816669537086474 Energy: 0.01654288017988069 Energy: 0.2152430623095023 Energy: 0.016542880180743083 Energy: 0.21524306230822102 Energy: 0.016542880180299566 Energy: 0.2152430623090834 Energy: 0.8553139173557157 Energy: 0.21532681356345576 Energy: 0.855313917356578 Energy: 0.21532681356604294 Energy: 0.8553139173184354 Energy: 0.21532681356084396 Energy: 0.01654288017943717 Energy: 0.21524306230777746 Energy: 0.01654288017943717 Energy: 0.21524306230777746 Energy: 0.01654288017943717 Energy: 0.215243062307334 minimum gb energy = 0.015489591857278853 eV minimum distance = 2.54575208400078 Angstroms sigma value = 1