Model name: model_name=MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 a1: a1=[-1, 1, 0] a2: a2=[0, 0, 1] a3: a3=[1, 1, 0] Species: species=Al Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=4.049999177455902 cohesive_energy=3.3532637165796375 mass=26.981538 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: 0.010339248580230167 Energy: 0.5765077381616452 Energy: 0.010339248580230167 Energy: 0.576507738161895 Energy: 0.010339248580230167 Energy: 0.576507738161895 Energy: 0.5765077381616452 Energy: 0.6593938343822413 Energy: 0.5765077381616452 Energy: 0.6593938343822413 Energy: 0.5765077381616452 Energy: 0.8067783393285537 Energy: 0.010339248580230167 Energy: 0.5765077381616452 Energy: 0.010339248580230167 Energy: 0.5765077381616452 Energy: 0.010339248580230167 Energy: 0.5765077381616452 Energy: 0.5765077381616452 Energy: 0.6593938343822413 Energy: 0.576507738161895 Energy: 0.6593938343824912 Energy: 0.576507738161895 Energy: 0.8067783393285537 Energy: 0.010339248580230167 Energy: 0.5765077381616452 Energy: 0.010339248580230167 Energy: 0.5765077381616452 Energy: 0.010339248580230167 Energy: 0.5765077381616452 Energy: 0.5765077381616452 Energy: 0.8067783393283038 Energy: 0.576507738161895 Energy: 0.8067783393285537 Energy: 0.5765077381616452 Energy: 0.8067783393285537 minimum gb energy = 0.010339248580230167 eV minimum distance = 2.52312312829235 Angstroms sigma value = 1 ======================================== theta = 20.049975724151484 ======================================== Energy: 0.6913874141700297 Energy: 0.6157562765866719 Energy: 0.6913874141700297 Energy: 0.6157562765872733 Energy: 0.6913874141700297 Energy: 0.6157562765866719 Energy: 0.7026691232257897 Energy: 0.5762842158717907 Energy: 0.7026691232257897 Energy: 0.5762842158717907 Energy: 0.7026691232251883 Energy: 0.5762842158717907 Energy: 0.6631321082231949 Energy: 0.6282621440196705 Energy: 0.6532323442267399 Energy: 0.6282621440202719 Energy: 0.6631321082225933 Energy: 0.6282621440202719 Energy: 0.6728780299742642 Energy: 0.6035893247182683 Energy: 0.6728780299748657 Energy: 0.6035893247176668 Energy: 0.6728780299742642 Energy: 0.6035893247176668 Energy: 0.6209550060127306 Energy: 0.6979957150173329 Energy: 0.6209550060121292 Energy: 0.6979957150173329 Energy: 0.6209550060121292 Energy: 0.6979957150173329 Energy: 0.7006145865418918 Energy: 0.6059726986089206 Energy: 0.7006145865418918 Energy: 0.6059726986095221 Energy: 0.7006145865418918 Energy: 0.6059726986089206 Energy: 0.6322098002603288 Energy: 0.6629817955943839 Energy: 0.6322098002603288 Energy: 0.6629817955949854 Energy: 0.6322098002603288 Energy: 0.6629817955949854 Energy: 0.6041596008280483 Energy: 0.6945657643559412 Energy: 0.6041596008286498 Energy: 0.6945657643559412 Energy: 0.6041596008286498 Energy: 0.6945657643559412 Energy: 0.6653183578273563 Energy: 0.6853069435049949 Energy: 0.6653183578273563 Energy: 0.6853069435049949 Energy: 0.6653183578279577 Energy: 0.6853069435049949 Energy: 0.5615373477376 Energy: 0.6855093710265009 Energy: 0.5615373477376 Energy: 0.6855093710258995 Energy: 0.5615373477376 Energy: 0.6855093710265009 Energy: 0.7486128518431638 Energy: 0.5984770160949199 Energy: 0.7486128518431638 Energy: 0.5984770160955213 Energy: 0.7486128518431638 Energy: 0.5984770160949199 Energy: 0.5326189529781071 Energy: 0.7333709956408712 Energy: 0.5326189529781071 Energy: 0.7333709956408712 Energy: 0.5326189529781071 Energy: 0.7333709956414726 Energy: 0.706836002973007 Energy: 0.5371229157708438 Energy: 0.7068360029724056 Energy: 0.5371229157702424 Energy: 0.706836002973007 Energy: 0.5371229157702424 Energy: 0.6047211450869381 Energy: 0.6286520101568853 Energy: 0.6047211450875396 Energy: 0.6286520101562838 Energy: 0.6047211450869381 Energy: 0.6286520101568853 Energy: 0.7134134537054639 Energy: 0.5675339833003016 Energy: 0.7134134537048625 Energy: 0.5675339833003016 Energy: 0.7134134537048625 Energy: 0.5675339833003016 Energy: 0.7310658526348012 Energy: 0.6484406480775524 Energy: 0.7310658526348012 Energy: 0.6484406480787553 Energy: 0.7310658526341995 Energy: 0.6484406480781537 Energy: 0.6545531915815733 Energy: 0.6352581727426079 Energy: 0.6545531915815733 Energy: 0.6352581727426079 Energy: 0.6545531915815733 Energy: 0.6352581727426079 Energy: 0.6575769341049927 Energy: 0.6004701441548093 Energy: 0.6575769341049927 Energy: 0.6004701441548093 Energy: 0.6575769341049927 Energy: 0.6004701441554107 Energy: 0.5668410862081066 Energy: 0.6428297671259122 Energy: 0.5801662834465668 Energy: 0.6428297671259122 Energy: 0.6056246848427793 Energy: 0.6428297671259122 Energy: 0.6709009845603301 Energy: 0.6060264039967667 Energy: 0.6709009845603301 Energy: 0.6060264039967667 Energy: 0.6709009845603301 Energy: 0.6060264039967667 Energy: 0.5727007584055611 Energy: 0.7893822434669553 Energy: 0.5727007584061625 Energy: 0.7893822434669553 Energy: 0.5727007584055611 Energy: 0.7893822434663538 Energy: 0.6661784566413897 Energy: 0.6814989384068004 Energy: 0.6661784566413897 Energy: 0.6814989384068004 Energy: 0.6661784566413897 Energy: 0.6814989384068004 Energy: 0.5337257537409195 Energy: 0.6776544330534104 Energy: 0.5337257537409195 Energy: 0.677654433052809 Energy: 0.5337257537409195 Energy: 0.6776544330522076 minimum gb energy = 0.5326189529781071 eV minimum distance = 2.51335431871786 Angstroms sigma value = 33 ======================================== theta = 22.84350731792459 ======================================== Energy: 0.789604188905132 Energy: 0.6648765284468272 Energy: 0.7361378045760629 Energy: 0.664876528446485 Energy: 0.789604188905132 Energy: 0.6648765284478534 Energy: 0.6703542292857212 Energy: 0.5908105395056066 Energy: 0.6703542292850371 Energy: 0.5908105395056066 Energy: 0.6703542292860634 Energy: 0.5908105395062907 Energy: 0.5830357291900765 Energy: 0.5994035673531375 Energy: 0.5830357291907607 Energy: 0.5994035673534795 Energy: 0.5830357291900765 Energy: 0.5994035673534795 Energy: 0.6897836087562257 Energy: 0.7152312800241918 Energy: 0.6897836087555415 Energy: 0.7152312800245338 Energy: 0.6897836087562257 Energy: 0.7152312800238497 Energy: 0.648947470845001 Energy: 0.6360660686396294 Energy: 0.6489474708453431 Energy: 0.6360660686396294 Energy: 0.6489474708453431 Energy: 0.6360660686386033 Energy: 0.5845991172629038 Energy: 0.568801954477952 Energy: 0.5845991172632459 Energy: 0.568801954477952 Energy: 0.5845991172632459 Energy: 0.5688019544793205 Energy: 0.6758786547885199 Energy: 0.6739726621203725 Energy: 0.6760379540050672 Energy: 0.6739726621200304 Energy: 0.6757916390968395 Energy: 0.6739726621193463 Energy: 0.5374720729449196 Energy: 0.7436336237203484 Energy: 0.53750832906183 Energy: 0.7436336237203484 Energy: 0.5374720729449196 Energy: 0.7436336237230851 Energy: 0.5387660453612925 Energy: 0.5813640540473995 Energy: 0.5387660453602662 Energy: 0.5813640540473995 Energy: 0.5387660453565031 Energy: 0.5813640540480838 Energy: 0.5736767779074757 Energy: 0.7050305600483571 Energy: 0.573617650577239 Energy: 0.7050305600480149 Energy: 0.5736767779074757 Energy: 0.7050305600476728 Energy: 0.727843150551889 Energy: 0.5723263508789552 Energy: 0.7278431505505205 Energy: 0.5723263508789552 Energy: 0.7278431505515468 Energy: 0.5723263508810077 Energy: 0.5807742126661568 Energy: 0.6195323259553153 Energy: 0.5807876522043357 Energy: 0.6195323259553153 Energy: 0.5807742126658147 Energy: 0.6195323259590784 Energy: 0.6767596981830312 Energy: 0.5552190530227052 Energy: 0.7096562086573514 Energy: 0.5552190530227052 Energy: 0.6767596981830312 Energy: 0.5552190530247578 Energy: 0.671438586433235 Energy: 0.6710103726686192 Energy: 0.700555170101368 Energy: 0.6710103726682771 Energy: 0.6714385864322088 Energy: 0.6710103726682771 Energy: 0.6704233126954545 Energy: 0.6066321643076509 Energy: 0.6704233126951125 Energy: 0.6066321643076509 Energy: 0.6704233126957966 Energy: 0.6066321643090193 Energy: 0.5834296673204327 Energy: 0.6025369261450793 Energy: 0.5834296673190643 Energy: 0.6025369261447371 Energy: 0.5834296673200905 Energy: 0.6025369261450793 Energy: 0.7366671724751258 Energy: 0.6539872930865182 Energy: 0.7366671724740993 Energy: 0.6539872930865182 Energy: 0.7366671724747835 Energy: 0.6539872930878865 Energy: 0.6474444422898518 Energy: 0.5795142700403547 Energy: 0.6474444422901939 Energy: 0.5795142700403547 Energy: 0.6474444422891676 Energy: 0.579514270041039 Energy: 0.5874668849226117 Energy: 0.5992097571624803 Energy: 0.5874668849226117 Energy: 0.599209757161454 Energy: 0.5874668849226117 Energy: 0.5992097571604277 Energy: 0.680287066883709 Energy: 0.7363269875953917 Energy: 0.679875281451836 Energy: 0.7363269875953917 Energy: 0.6802870667835368 Energy: 0.7363269875964179 Energy: 0.5349094734447658 Energy: 0.735335121636025 Energy: 0.5349211783386337 Energy: 0.735335121636025 Energy: 0.5349094734440816 Energy: 0.7353351216373933 Energy: 0.6339657525983134 Energy: 0.5828283857289125 Energy: 0.6339657525976292 Energy: 0.5828283857292546 Energy: 0.6339657525986556 Energy: 0.5828283857295966 Energy: 0.5726723732111869 Energy: 0.7076637018924644 Energy: 0.5726328590860432 Energy: 0.7076637018921224 Energy: 0.5726723732111869 Energy: 0.7076637018917802 Energy: 0.7236853086645135 Energy: 0.6405902339564118 Energy: 0.7236853086645135 Energy: 0.6405902339564118 Energy: 0.7236853086638294 Energy: 0.6405902339560697 Energy: 0.5829421004232063 Energy: 0.5847006078347835 Energy: 0.5829759324709115 Energy: 0.5847006078340993 Energy: 0.5829421004232063 Energy: 0.5847006078344414 Energy: 0.739494091647372 Energy: 0.6785770017655642 Energy: 0.7040177061776804 Energy: 0.6785770017655642 Energy: 0.739494091647372 Energy: 0.6785770017676167 Energy: 0.7392684077119595 Energy: 0.6880024316727704 Energy: 0.7031712895707221 Energy: 0.6880024316731126 Energy: 0.7392684077119595 Energy: 0.6880024316741388 Energy: 0.5828759379436506 Energy: 0.6000100975704752 Energy: 0.5828759379436506 Energy: 0.6000100975704752 Energy: 0.5828759379436506 Energy: 0.6000100975718436 Energy: 0.7054449052061811 Energy: 0.5911323445354834 Energy: 0.7054449052051549 Energy: 0.5911323445354834 Energy: 0.7054449052061811 Energy: 0.5911323445361676 Energy: 0.5825766546570174 Energy: 0.7302106859442874 Energy: 0.5825766546583857 Energy: 0.7302106859446295 Energy: 0.5825766546570174 Energy: 0.7302106859449716 Energy: 0.6571299567983176 Energy: 0.5812902252679505 Energy: 0.6571299567986597 Energy: 0.5812902252682927 Energy: 0.6571299567983176 Energy: 0.5812902252669242 Energy: 0.5535624271506336 Energy: 0.6668667045268307 Energy: 0.5535624271506336 Energy: 0.6668667045271729 Energy: 0.5535624271506336 Energy: 0.6668667045268307 Energy: 0.6818414950455992 Energy: 0.7361879906172862 Energy: 0.6821560960860059 Energy: 0.7361879906172862 Energy: 0.6818408382091102 Energy: 0.7361879906176284 Energy: 0.6092429711811396 Energy: 0.6697214228129594 Energy: 0.6092429711821657 Energy: 0.6697214228129594 Energy: 0.6092429711807975 Energy: 0.6697214228136437 Energy: 0.5995605349412358 Energy: 0.5804800224837399 Energy: 0.5995605349412358 Energy: 0.5804800224840821 Energy: 0.5995605349412358 Energy: 0.5804800224851083 Energy: 0.7193607854112224 Energy: 0.6827475428333672 Energy: 0.7193607854115645 Energy: 0.6827475428333672 Energy: 0.7193607854108802 Energy: 0.6827475428337093 Energy: 0.5796901007910299 Energy: 0.65144943906391 Energy: 0.5785091145732252 Energy: 0.65144943906391 Energy: 0.5796901007910299 Energy: 0.6514494390632256 Energy: 0.5877684206235565 Energy: 0.5885913856748238 Energy: 0.5997282391576256 Energy: 0.5885913856748238 Energy: 0.5877684206235565 Energy: 0.5885913856761923 Energy: 0.6712540849695704 Energy: 0.6779566616239077 Energy: 0.7158253143335918 Energy: 0.6779566616239077 Energy: 0.6712540849688863 Energy: 0.6779566616221973 Energy: 0.7453355031039554 Energy: 0.5279809134116377 Energy: 0.7453355031039554 Energy: 0.5279809134119797 Energy: 0.7453355031039554 Energy: 0.527980913412664 Energy: 0.5807814435564524 Energy: 0.5378010976189654 Energy: 0.5807814435557682 Energy: 0.5378010976189654 Energy: 0.5807814435564524 Energy: 0.5378010976213601 minimum gb energy = 0.5279809134116377 eV minimum distance = 2.610692283569 Angstroms sigma value = 51 ======================================== theta = 26.525352016609688 ======================================== Energy: 0.6510427958262295 Energy: 0.6528790280624895 Energy: 0.6510427958262295 Energy: 0.6528790280624895 Energy: 0.6510427958262295 Energy: 0.6528790280624895 Energy: 0.7344780987310243 Energy: 0.6007838639772648 Energy: 0.7344780987310243 Energy: 0.6007838639772648 Energy: 0.7344780987310243 Energy: 0.6007838639772648 Energy: 0.6410942775578281 Energy: 0.638166320765642 Energy: 0.6410942775578281 Energy: 0.638166320765642 Energy: 0.6410942775578281 Energy: 0.638166320765642 Energy: 0.6381324270235688 Energy: 0.5509122142776031 Energy: 0.6381324270235688 Energy: 0.5509122142776031 Energy: 0.6381324270235688 Energy: 0.5509122142776031 Energy: 0.6479616969473153 Energy: 0.6516069551562543 Energy: 0.6479616969473153 Energy: 0.6516069551570469 Energy: 0.6479616969473153 Energy: 0.6516069551570469 Energy: 0.6484832548878252 Energy: 0.6479352287414865 Energy: 0.6484832548878252 Energy: 0.6479352287414865 Energy: 0.6484832548878252 Energy: 0.6479352287414865 Energy: 0.7048456462199622 Energy: 0.647743037049311 Energy: 0.7048456462199622 Energy: 0.6477430370485184 Energy: 0.7048456462199622 Energy: 0.6477430370485184 Energy: 0.5843622993577924 Energy: 0.6481952176705889 Energy: 0.5843622993577924 Energy: 0.6481952176705889 Energy: 0.5843622993577924 Energy: 0.6481952176705889 Energy: 0.7103361624481304 Energy: 0.5480983210795608 Energy: 0.7103361624481304 Energy: 0.5480983210787862 Energy: 0.7103361624481304 Energy: 0.5480983210787862 Energy: 0.5579754097036064 Energy: 0.7269176507047629 Energy: 0.5579754097036064 Energy: 0.7269176507047629 Energy: 0.5579754097036064 Energy: 0.7269176507047629 Energy: 0.7302729361648458 Energy: 0.5400467056446637 Energy: 0.7302729361648458 Energy: 0.5400467056446637 Energy: 0.7302729361640532 Energy: 0.5400467056446637 Energy: 0.6527141764648615 Energy: 0.6549321360623751 Energy: 0.6527141764648615 Energy: 0.6549321360623751 Energy: 0.6527141764648615 Energy: 0.6549321360623751 Energy: 0.7350642697400761 Energy: 0.5932959248144121 Energy: 0.7350642697400761 Energy: 0.5932959248144121 Energy: 0.7350642697400761 Energy: 0.5932959248144121 Energy: 0.6420239714050211 Energy: 0.5947869625149275 Energy: 0.6420239714050211 Energy: 0.5947869625149275 Energy: 0.6420239714050211 Energy: 0.5947869625149275 Energy: 0.6327488718993911 Energy: 0.643567643133351 Energy: 0.6327488718970132 Energy: 0.643567643133351 Energy: 0.632748871884331 Energy: 0.643567643133351 Energy: 0.6481023727580841 Energy: 0.6481522785423655 Energy: 0.6481023727580841 Energy: 0.6481522785423655 Energy: 0.6481023727580841 Energy: 0.6481522785423655 Energy: 0.6480238541809609 Energy: 0.705830947975344 Energy: 0.6480238541809609 Energy: 0.705830947975344 Energy: 0.6480238541809609 Energy: 0.705830947975344 Energy: 0.6407120132141604 Energy: 0.6315588413399718 Energy: 0.6407120132141604 Energy: 0.6315588413399718 Energy: 0.6407120132141604 Energy: 0.6315588413399718 minimum gb energy = 0.5400467056446637 eV minimum distance = 2.47671021087519 Angstroms sigma value = 19 ======================================== theta = 31.586338096527925 ======================================== Energy: 0.5207227143841378 Energy: 0.5248240601211375 Energy: 0.5207227143841378 Energy: 0.5248240601211375 Energy: 0.5207227143841378 Energy: 0.5248240601211375 Energy: 0.6468385885648132 Energy: 0.6545693654132739 Energy: 0.6468385885652832 Energy: 0.6545693654123335 Energy: 0.646838588564343 Energy: 0.6545693654128036 Energy: 0.5029469363376768 Energy: 0.6539906815441566 Energy: 0.5029469363376768 Energy: 0.6539906815446268 Energy: 0.5029469363372067 Energy: 0.6539906815441566 Energy: 0.5515383287457379 Energy: 0.505437303475458 Energy: 0.5515383287457379 Energy: 0.5054373034749878 Energy: 0.5515383287462081 Energy: 0.5054373034749878 Energy: 0.5261951096389039 Energy: 0.5274455908190718 Energy: 0.5261951096389039 Energy: 0.5274455908186018 Energy: 0.5261951096393741 Energy: 0.5274455908181315 Energy: 0.5261464708855155 Energy: 0.5271996207723921 Energy: 0.5261464708855155 Energy: 0.5271996207738027 Energy: 0.5261464708855155 Energy: 0.5271996207709818 Energy: 0.551485945528463 Energy: 0.5054123703942163 Energy: 0.5514859455303224 Energy: 0.505412370393276 Energy: 0.551485945528463 Energy: 0.5054123703946864 Energy: 0.50296826113773 Energy: 0.653910993348805 Energy: 0.5029682611372598 Energy: 0.6539109933483348 Energy: 0.5029682611372598 Energy: 0.6539109933483348 Energy: 0.6468241698419664 Energy: 0.6545914853775764 Energy: 0.6468241698424367 Energy: 0.6545914853785167 Energy: 0.6468241698414964 Energy: 0.6545914853785167 Energy: 0.5207227143841378 Energy: 0.5248240601206675 Energy: 0.5207227143846079 Energy: 0.5248240601206675 Energy: 0.5207227143836676 Energy: 0.5248240601206675 Energy: 0.646838588564343 Energy: 0.6545693654128036 Energy: 0.6468385885634026 Energy: 0.6545693654128036 Energy: 0.6468385885634026 Energy: 0.6545693654132739 Energy: 0.5029469363362664 Energy: 0.6539906815441566 Energy: 0.5029469363376768 Energy: 0.6539906815432163 Energy: 0.5029469363386171 Energy: 0.6539906815441566 Energy: 0.5515383287457379 Energy: 0.505437303475458 Energy: 0.5515383287462081 Energy: 0.5054373034749878 Energy: 0.5515383287462081 Energy: 0.505437303475458 Energy: 0.5261951096384337 Energy: 0.5274455908176613 Energy: 0.5261951096393741 Energy: 0.5274455908190718 Energy: 0.5261951096379637 Energy: 0.5274455908190718 Energy: 0.5261464708855155 Energy: 0.5271996207761536 Energy: 0.5261464708850453 Energy: 0.5271996207719221 Energy: 0.5261464708845751 Energy: 0.5271996207742728 Energy: 0.551485945528912 Energy: 0.505412370393276 Energy: 0.551485945528912 Energy: 0.505412370393746 Energy: 0.551485945528463 Energy: 0.5054123703942163 Energy: 0.5029682611367895 Energy: 0.6539109933478646 Energy: 0.5029682611363194 Energy: 0.6539109933478646 Energy: 0.5029682611382001 Energy: 0.6539109933473946 Energy: 0.6468241698419664 Energy: 0.6545914853789868 Energy: 0.6468241698424367 Energy: 0.6545914853780465 Energy: 0.6468241698424367 Energy: 0.6545914853785167 Energy: 0.5207227143846079 Energy: 0.5248240601211375 Energy: 0.5207227143850782 Energy: 0.5248240601201972 Energy: 0.5207227143841378 Energy: 0.5248240601211375 Energy: 0.6468385885638728 Energy: 0.6545693654118633 Energy: 0.6468385885634026 Energy: 0.6545693654123335 Energy: 0.6468385885638728 Energy: 0.6545693654128036 Energy: 0.5029469363390874 Energy: 0.653990681545097 Energy: 0.5029469363372067 Energy: 0.6539906815432163 Energy: 0.5029469363386171 Energy: 0.6539906815436864 Energy: 0.5515383287462081 Energy: 0.5054373034759282 Energy: 0.5515383287462081 Energy: 0.505437303475458 Energy: 0.5515383287462081 Energy: 0.5054373034749878 Energy: 0.5261951096389039 Energy: 0.5274455908181315 Energy: 0.5261951096393741 Energy: 0.5274455908186018 Energy: 0.5261951096389039 Energy: 0.5274455908176613 Energy: 0.526146470884105 Energy: 0.5271996207705115 Energy: 0.5261464708859857 Energy: 0.5271996207705115 Energy: 0.526146470884105 Energy: 0.5271996207719221 Energy: 0.551485945528463 Energy: 0.5054123703923356 Energy: 0.551485945528912 Energy: 0.505412370393276 Energy: 0.551485945528463 Energy: 0.505412370393276 Energy: 0.5029682611382001 Energy: 0.6539109933497453 Energy: 0.50296826113773 Energy: 0.653910993348805 Energy: 0.5029682611367895 Energy: 0.6539109933483348 Energy: 0.6468241698414964 Energy: 0.6545914853780465 Energy: 0.6468241698433771 Energy: 0.6545914853780465 Energy: 0.6468241698424367 Energy: 0.6545914853785167 Energy: 0.5207227143841378 Energy: 0.5248240601216078 Energy: 0.5207227143850782 Energy: 0.5248240601206675 Energy: 0.5207227143836676 Energy: 0.5248240601206675 Energy: 0.6468385885638728 Energy: 0.6545693654128036 Energy: 0.6468385885629325 Energy: 0.6545693654137441 Energy: 0.646838588564343 Energy: 0.6545693654128036 Energy: 0.5029469363386171 Energy: 0.6539906815446268 Energy: 0.5029469363386171 Energy: 0.6539906815432163 Energy: 0.5029469363390874 Energy: 0.6539906815441566 minimum gb energy = 0.5029469363362664 eV minimum distance = 2.49778629506026 Angstroms sigma value = 27 ======================================== theta = 38.94244126898138 ======================================== Energy: 0.5553279460793088 Energy: 0.537791618342336 Energy: 0.5553279460793088 Energy: 0.537791618342336 Energy: 0.5553279460793088 Energy: 0.537791618342336 Energy: 0.7543549798904253 Energy: 0.5454655965726721 Energy: 0.7543549798904253 Energy: 0.5454655965726721 Energy: 0.7543549798904253 Energy: 0.5454655965726721 Energy: 0.5421164793395222 Energy: 0.5938137855650787 Energy: 0.5421164793395222 Energy: 0.5938137855650787 Energy: 0.5421164793395222 Energy: 0.5938137855650787 Energy: 0.6231061283988278 Energy: 0.5296720785043773 Energy: 0.6231061283999796 Energy: 0.5296720785032254 Energy: 0.6231061283999796 Energy: 0.5296720785032254 Energy: 0.6242234603450888 Energy: 0.5269080726387392 Energy: 0.624223460343937 Energy: 0.5269080726375875 Energy: 0.6242234603450888 Energy: 0.5269080726387392 Energy: 0.6395211354130721 Energy: 0.6719061319441887 Energy: 0.6395211354130721 Energy: 0.6719061319441887 Energy: 0.6395211354130721 Energy: 0.6719061319441887 Energy: 0.6255959042047595 Energy: 0.5471996099362038 Energy: 0.6255959042047595 Energy: 0.547199609935052 Energy: 0.6255959042047595 Energy: 0.5471996099362038 Energy: 0.5613101914763803 Energy: 0.5401921507038863 Energy: 0.5613101914763803 Energy: 0.5401921507027346 Energy: 0.5613101914763803 Energy: 0.5401921507038863 Energy: 0.6366795753226768 Energy: 0.541904119097946 Energy: 0.6366795753226768 Energy: 0.54190411916011 Energy: 0.6366795753226768 Energy: 0.541904119087581 Energy: 0.5514492996692708 Energy: 0.6382760235562441 Energy: 0.5514492996692708 Energy: 0.6382760235562441 Energy: 0.5514492996692708 Energy: 0.6382760235562441 Energy: 0.5551462264775417 Energy: 0.5264532181116621 Energy: 0.5551462264775417 Energy: 0.5264532181116621 Energy: 0.6609202682706937 Energy: 0.5264532181116621 Energy: 0.6231956876291548 Energy: 0.6338250006616833 Energy: 0.6231956876291548 Energy: 0.6338250006605316 Energy: 0.6231956876291548 Energy: 0.6338250006605316 minimum gb energy = 0.5264532181116621 eV minimum distance = 2.57851357956673 Angstroms sigma value = 9 ======================================== theta = 44.00342734889962 ======================================== Energy: 0.5967337513633595 Energy: 0.511865339492103 Energy: 0.596733751363036 Energy: 0.5118653394917794 Energy: 0.596733751363036 Energy: 0.5118653394911322 Energy: 0.6329785574272588 Energy: 0.535287627389553 Energy: 0.6329785574262881 Energy: 0.5536711335606479 Energy: 0.6329785574269352 Energy: 0.5259139600063475 Energy: 0.49565634965310906 Energy: 0.6186392410541818 Energy: 0.49565634965343264 Energy: 0.6186392410541818 Energy: 0.49565634965343264 Energy: 0.6186392410545054 Energy: 0.5072983612998816 Energy: 0.5083705264371535 Energy: 0.507298361299558 Energy: 0.5083705264371535 Energy: 0.5072983612998816 Energy: 0.5083705264368299 Energy: 0.524049475186304 Energy: 0.5039083848367468 Energy: 0.5240494751859803 Energy: 0.5039083848367468 Energy: 0.5240494751859803 Energy: 0.5039083848370705 Energy: 0.5659817576971077 Energy: 0.5750642503478512 Energy: 0.5659817576977549 Energy: 0.5986630749895137 Energy: 0.5659817576987255 Energy: 0.5956449592570346 Energy: 0.5451138114825992 Energy: 0.5412912974563596 Energy: 0.5451138114845407 Energy: 0.5412912974563596 Energy: 0.5451138114825992 Energy: 0.5412912974563596 Energy: 0.4927075203550896 Energy: 0.5489060820399434 Energy: 0.49270752035573684 Energy: 0.5489060820399434 Energy: 0.4927075203550896 Energy: 0.5489060820396199 Energy: 0.6109669381478916 Energy: 0.5036618352681732 Energy: 0.6109669381488624 Energy: 0.5036618352681732 Energy: 0.6109669381498332 Energy: 0.5036618352681732 Energy: 0.5236154267642823 Energy: 0.6429351798791197 Energy: 0.5236154267633115 Energy: 0.6429351798791197 Energy: 0.5236154267616936 Energy: 0.6429351798784725 Energy: 0.5102765094786764 Energy: 0.5048680232230939 Energy: 0.5102765094783528 Energy: 0.5048680232224466 Energy: 0.5102765094783528 Energy: 0.5048680232227702 Energy: 0.5019995623660642 Energy: 0.5841579565865377 Energy: 0.5019995623663878 Energy: 0.5841579565868613 Energy: 0.5019995623667114 Energy: 0.5841579565865377 Energy: 0.6107891575994205 Energy: 0.5797559247326606 Energy: 0.6107891575994205 Energy: 0.5797559247326606 Energy: 0.6107891575997442 Energy: 0.5797559247329841 Energy: 0.596927318184551 Energy: 0.5484183547154523 Energy: 0.5969273181842274 Energy: 0.5484183547151288 Energy: 0.5969273181851688 Energy: 0.5484183547157759 Energy: 0.5053740033311096 Energy: 0.525208637492166 Energy: 0.5053740033311096 Energy: 0.525208637492166 Energy: 0.5053740033311096 Energy: 0.5252086374924896 Energy: 0.6856508283448974 Energy: 0.6009567147582145 Energy: 0.6856508283448974 Energy: 0.600956714757891 Energy: 0.6856508283455446 Energy: 0.6009567147591853 Energy: 0.63358233174025 Energy: 0.5938985576943828 Energy: 0.6335823317405737 Energy: 0.5938985576943828 Energy: 0.6335823317405737 Energy: 0.5938985576947065 Energy: 0.5099678331278029 Energy: 0.5010048723729624 Energy: 0.5099678331274793 Energy: 0.501004872373286 Energy: 0.5099678331278029 Energy: 0.5010048723729624 Energy: 0.4969497329225631 Energy: 0.6262049514496437 Energy: 0.4969497329225631 Energy: 0.6262049514493201 Energy: 0.4969497329225631 Energy: 0.6262049514493201 Energy: 0.6101550172773221 Energy: 0.5656626096298907 Energy: 0.6101550172769985 Energy: 0.5656626096298907 Energy: 0.6101550172779693 Energy: 0.5656626096298907 Energy: 0.4970511350107076 Energy: 0.6262815755931272 Energy: 0.4970511350110312 Energy: 0.6262815755934509 Energy: 0.4970511350110312 Energy: 0.6262815755931272 Energy: 0.5099532066534141 Energy: 0.5010106052334088 Energy: 0.5099532066534141 Energy: 0.5010106052334088 Energy: 0.5099532066534141 Energy: 0.5010106052334088 Energy: 0.6338668056530233 Energy: 0.5939937170951172 Energy: 0.6338668056526997 Energy: 0.5939937170951172 Energy: 0.6338668056526997 Energy: 0.5939937170951172 Energy: 0.6856541463842242 Energy: 0.5783301597415416 Energy: 0.6856541463839007 Energy: 0.5867854176315807 Energy: 0.6856541463842242 Energy: 0.5783301597425122 Energy: 0.5053298771564938 Energy: 0.525257512681593 Energy: 0.5053298771568174 Energy: 0.525257512681593 Energy: 0.5053298771568174 Energy: 0.525257512681593 Energy: 0.5968898258900802 Energy: 0.5483981291013216 Energy: 0.5968898258904037 Energy: 0.5483981291016451 Energy: 0.5968898258897566 Energy: 0.5483981291013216 Energy: 0.6107520460015877 Energy: 0.5797021149849194 Energy: 0.6107520460028821 Energy: 0.5797021149849194 Energy: 0.6107520460022349 Energy: 0.5797021149849194 Energy: 0.5019936472124431 Energy: 0.5214324432192694 Energy: 0.5019936472117958 Energy: 0.5301512170600562 Energy: 0.5019936472121195 Energy: 0.521432443219593 Energy: 0.5104846861817287 Energy: 0.5049289619571858 Energy: 0.5104846861817287 Energy: 0.5049289619565387 Energy: 0.5104846861817287 Energy: 0.5049289619571858 Energy: 0.5236385246851872 Energy: 0.6278329313459747 Energy: 0.5236385246871287 Energy: 0.6278329313459747 Energy: 0.5236385246842165 Energy: 0.6278329313459747 Energy: 0.6109634387113555 Energy: 0.5037711380933086 Energy: 0.610963438711679 Energy: 0.5037711380933086 Energy: 0.610963438711679 Energy: 0.5037711380936322 Energy: 0.4927681567432708 Energy: 0.5488215053069001 Energy: 0.4927681567423 Energy: 0.5488215053069001 Energy: 0.4927681567423 Energy: 0.5488215053069001 Energy: 0.5448287211096349 Energy: 0.5412646901667829 Energy: 0.544828721110282 Energy: 0.5412646901667829 Energy: 0.5448287211096349 Energy: 0.5412646901667829 Energy: 0.5659318687120796 Energy: 0.5006891843586575 Energy: 0.5659318687130503 Energy: 0.5188481605140681 Energy: 0.5659318687111087 Energy: 0.5006891843593047 Energy: 0.5240298863872296 Energy: 0.5431182750745506 Energy: 0.5240298863872296 Energy: 0.5431182750748741 Energy: 0.524029886386906 Energy: 0.5431182750745506 Energy: 0.5074802241486512 Energy: 0.5087201622026739 Energy: 0.5074802241486512 Energy: 0.5087201622029975 Energy: 0.5074802241486512 Energy: 0.5087201622026739 Energy: 0.4951671788580366 Energy: 0.6185713488089031 Energy: 0.4951671788577131 Energy: 0.6185713488095503 Energy: 0.49516717885836026 Energy: 0.6185713488089031 Energy: 0.6326719665656951 Energy: 0.554286687029682 Energy: 0.6326719665653715 Energy: 0.5535108324035707 Energy: 0.6326719665656951 Energy: 0.5391291755124049 Energy: 0.5967337513623887 Energy: 0.5118653394914557 Energy: 0.5967337513627123 Energy: 0.5118653394914557 Energy: 0.5967337513623887 Energy: 0.5118653394917794 Energy: 0.6329785574275825 Energy: 0.5430695297404997 Energy: 0.6329785574266117 Energy: 0.5790709299016105 Energy: 0.6329785574269352 Energy: 0.5259139600057003 Energy: 0.4956563496540799 Energy: 0.6186392410541818 Energy: 0.49565634965375627 Energy: 0.6186392410541818 Energy: 0.49565634965343264 Energy: 0.6186392410545054 Energy: 0.5072983613008524 Energy: 0.508370526438742 Energy: 0.5072983613005287 Energy: 0.5083705264390656 Energy: 0.5072983613005287 Energy: 0.508370526438742 Energy: 0.5240494751859803 Energy: 0.5039083848364233 Energy: 0.5240494751859803 Energy: 0.5039083848354525 Energy: 0.524049475186304 Energy: 0.503908384835776 minimum gb energy = 0.4927075203550896 eV minimum distance = 2.58860484748661 Angstroms sigma value = 57 ======================================== theta = 50.47880364135782 ======================================== Energy: 0.31301780977215116 Energy: 0.3177859531786613 Energy: 0.31301780977215116 Energy: 0.3177859531779247 Energy: 0.31301780977215116 Energy: 0.3177859531779247 Energy: 0.5149634049976113 Energy: 0.31344795746765813 Energy: 0.5149634049968747 Energy: 0.31344795746765813 Energy: 0.5149634049968747 Energy: 0.31344795746765813 Energy: 0.3320617126874687 Energy: 0.48347172159960683 Energy: 0.3320617126874687 Energy: 0.48347172159960683 Energy: 0.3320617126874687 Energy: 0.4834717216003435 Energy: 0.3196720684541375 Energy: 0.3183928082933745 Energy: 0.3196720684534009 Energy: 0.3183928082933745 Energy: 0.3196720684541375 Energy: 0.3183928082933745 Energy: 0.37090036184824554 Energy: 0.36861191291194023 Energy: 0.37090036184750896 Energy: 0.36861191291194023 Energy: 0.37090036184824554 Energy: 0.368611912910467 Energy: 0.31324576322790393 Energy: 0.33546665512660007 Energy: 0.31324576322643066 Energy: 0.33546665512733664 Energy: 0.31324576322643066 Energy: 0.33546665512586343 Energy: 0.31338280107836647 Energy: 0.3363935835110454 Energy: 0.31338280107983973 Energy: 0.336393583511782 Energy: 0.3133828010791031 Energy: 0.3363935835110454 Energy: 0.37087745756287854 Energy: 0.36860593416795534 Energy: 0.37087745756140533 Energy: 0.3686059341672187 Energy: 0.37087745756214197 Energy: 0.3686059341672187 Energy: 0.3196727451252545 Energy: 0.3183959051115903 Energy: 0.3196727451252545 Energy: 0.3183959051101171 Energy: 0.31967274512599114 Energy: 0.3183959051108537 Energy: 0.33204920656004194 Energy: 0.48347834532578804 Energy: 0.33204920656004194 Energy: 0.4834783453265246 Energy: 0.33204920655930537 Energy: 0.4834783453272612 Energy: 0.5149015350180822 Energy: 0.3134393179892753 Energy: 0.5149015350180822 Energy: 0.3134393179900119 Energy: 0.5149015350180822 Energy: 0.3134393179892753 Energy: 0.31301780977215116 Energy: 0.3177859531771881 Energy: 0.31301780977215116 Energy: 0.3177859531779247 Energy: 0.31301780977215116 Energy: 0.3177859531771881 Energy: 0.5149634049961381 Energy: 0.31344795746765813 Energy: 0.5149634049968747 Energy: 0.31344795746765813 Energy: 0.5149634049968747 Energy: 0.31344795746765813 Energy: 0.3320617126882053 Energy: 0.48347172159960683 Energy: 0.3320617126882053 Energy: 0.48347172159960683 Energy: 0.3320617126882053 Energy: 0.48347172159960683 Energy: 0.3196720684534009 Energy: 0.31839280829411115 Energy: 0.3196720684534009 Energy: 0.31839280829263794 Energy: 0.3196720684541375 Energy: 0.3183928082933745 Energy: 0.37090036184750896 Energy: 0.36861191291194023 Energy: 0.3709003618467723 Energy: 0.36861191291194023 Energy: 0.37090036184750896 Energy: 0.3686119129126768 Energy: 0.31324576322643066 Energy: 0.33546665512660007 Energy: 0.3132457632271673 Energy: 0.3354666551288099 Energy: 0.31324576322790393 Energy: 0.33546665512660007 Energy: 0.31338280107689326 Energy: 0.33639358351325527 Energy: 0.31338280107836647 Energy: 0.33639358351251863 Energy: 0.31338280107762984 Energy: 0.33639358351325527 Energy: 0.37087745756287854 Energy: 0.36860593416795534 Energy: 0.37087745756287854 Energy: 0.36860593416795534 Energy: 0.37087745756214197 Energy: 0.36860593416795534 minimum gb energy = 0.31301780977215116 eV minimum distance = 2.72126402688662 Angstroms sigma value = 11 ======================================== theta = 55.8767054592047 ======================================== Energy: 0.5356027835141035 Energy: 0.5001806189886279 Energy: 0.5356027835141035 Energy: 0.5001806189891675 Energy: 0.5356027835135639 Energy: 0.5001806189886279 Energy: 0.534884008345242 Energy: 0.4892062454807512 Energy: 0.534884008345242 Energy: 0.4892062454807512 Energy: 0.5348840083447024 Energy: 0.4892062454807512 Energy: 0.5653872600650349 Energy: 0.6830493441008528 Energy: 0.5653872600650349 Energy: 0.6830493441008528 Energy: 0.5653872600650349 Energy: 0.6830493441003133 Energy: 0.5890197697579239 Energy: 0.5012725175361492 Energy: 0.5890197697579239 Energy: 0.5012725175356098 Energy: 0.5890197697579239 Energy: 0.5012725175356098 Energy: 0.4901459257301809 Energy: 0.468392602946179 Energy: 0.4901459257301809 Energy: 0.468392602946179 Energy: 0.4901459257307204 Energy: 0.468392602946179 Energy: 0.5095225462395655 Energy: 0.4830805577961903 Energy: 0.5095225462401052 Energy: 0.48308055779565073 Energy: 0.5095225462401052 Energy: 0.4830805577961903 Energy: 0.478950033744689 Energy: 0.5110006313942909 Energy: 0.5063898398862307 Energy: 0.5110006313948303 Energy: 0.478950033744689 Energy: 0.5110006313942909 Energy: 0.49098973720512656 Energy: 0.45343018300709453 Energy: 0.49098973720566613 Energy: 0.4534301830060153 Energy: 0.49098973720512656 Energy: 0.45343018300709453 Energy: 0.49209833856254726 Energy: 0.45093089845272166 Energy: 0.49209833856254726 Energy: 0.4509308984521821 Energy: 0.49209833856254726 Energy: 0.45093089845272166 Energy: 0.45292489227384125 Energy: 0.5960983291295817 Energy: 0.4529248922743809 Energy: 0.5960983291295817 Energy: 0.45292489227384125 Energy: 0.5960983291290421 Energy: 0.5488893563420615 Energy: 0.5858112612847568 Energy: 0.5488893563420615 Energy: 0.5858112612847568 Energy: 0.5488893563420615 Energy: 0.5858112612847568 Energy: 0.4874502860335233 Energy: 0.4723619745579599 Energy: 0.4874502860340629 Energy: 0.47236197455742035 Energy: 0.4874502860346025 Energy: 0.4723619745579599 Energy: 0.5061751504655948 Energy: 0.5275684031151063 Energy: 0.5061751504655948 Energy: 0.5275684031151063 Energy: 0.5061751504655948 Energy: 0.5275684031151063 Energy: 0.542412181586559 Energy: 0.6832949940902169 Energy: 0.542412181586559 Energy: 0.6832949940902169 Energy: 0.5424121815860193 Energy: 0.6832949940896772 Energy: 0.5353153156642905 Energy: 0.48803139290955744 Energy: 0.5353153156632113 Energy: 0.48803139290955744 Energy: 0.5353153156632113 Energy: 0.48803139290955744 Energy: 0.5362490352338032 Energy: 0.49817650896498916 Energy: 0.5362490352343428 Energy: 0.49817650896498916 Energy: 0.5362490352343428 Energy: 0.49817650896498916 Energy: 0.49191103401838104 Energy: 0.4948035515937214 Energy: 0.4919110340178414 Energy: 0.4948035515931818 Energy: 0.4919110340178414 Energy: 0.4948035515937214 Energy: 0.6110066620912826 Energy: 0.6497306280559667 Energy: 0.6110066620912826 Energy: 0.6497306280559667 Energy: 0.6110066620912826 Energy: 0.6497306280559667 Energy: 0.5216670637847743 Energy: 0.5011750123102727 Energy: 0.5216670637858535 Energy: 0.5011750123102727 Energy: 0.5216670637853139 Energy: 0.5011750123102727 Energy: 0.4870157276478334 Energy: 0.46947957879708485 Energy: 0.4870157276478334 Energy: 0.4694795787965452 Energy: 0.4870157276478334 Energy: 0.46947957879762436 Energy: 0.4530475284752915 Energy: 0.48970442463155 Energy: 0.4530475284758312 Energy: 0.4897044246320896 Energy: 0.4530475284752915 Energy: 0.4897044246320896 Energy: 0.49272817627252263 Energy: 0.5090887883263219 Energy: 0.4927281753135384 Energy: 0.5090887883263219 Energy: 0.4927281761231075 Energy: 0.5090887883268614 Energy: 0.4914512833586514 Energy: 0.5006378158525999 Energy: 0.49145128335811183 Energy: 0.5006378158520604 Energy: 0.4914512833586514 Energy: 0.5006378158525999 Energy: 0.49500562205944904 Energy: 0.4713546841215417 Energy: 0.4950056220589094 Energy: 0.4713546841215417 Energy: 0.4950056220589094 Energy: 0.4713546841215417 Energy: 0.45297792488160604 Energy: 0.6506881291399307 Energy: 0.45297792488160604 Energy: 0.6506881291404703 Energy: 0.45297792488160604 Energy: 0.6506881291410098 Energy: 0.6669539022801229 Energy: 0.587257784427359 Energy: 0.6669539022806624 Energy: 0.5872577844278987 Energy: 0.6669539022806624 Energy: 0.5872577844278987 minimum gb energy = 0.4509308984521821 eV minimum distance = 2.60245139809913 Angstroms sigma value = 41 ======================================== theta = 58.99241699313286 ======================================== Energy: 0.5897203262740199 Energy: 0.48041508370834907 Energy: 0.5897203262735947 Energy: 0.48041508370834907 Energy: 0.5897203262735947 Energy: 0.48041508370834907 Energy: 0.5667981075134055 Energy: 0.5145531359386173 Energy: 0.5667981075134055 Energy: 0.5145531359390426 Energy: 0.5667981075134055 Energy: 0.5145531359386173 Energy: 0.616979984736453 Energy: 0.7483946024461702 Energy: 0.616979984736453 Energy: 0.7483946024461702 Energy: 0.616979984736453 Energy: 0.7483946024457448 Energy: 0.543797204274344 Energy: 0.4737505187968454 Energy: 0.5437972042747693 Energy: 0.4737505187968454 Energy: 0.543797204274344 Energy: 0.47375051879642016 Energy: 0.4634569035922093 Energy: 0.5007513648582586 Energy: 0.4634569035922093 Energy: 0.5007513648582586 Energy: 0.4634569035922093 Energy: 0.5007513648582586 Energy: 0.5427710058047694 Energy: 0.5238104139939515 Energy: 0.5427710058047694 Energy: 0.5238104139943767 Energy: 0.5427710058051947 Energy: 0.5238104139943767 Energy: 0.5026958586333418 Energy: 0.6137416537504744 Energy: 0.5026958586333418 Energy: 0.6137416537504744 Energy: 0.5026958586329165 Energy: 0.6137416537504744 Energy: 0.47871147788254287 Energy: 0.47394509399948626 Energy: 0.47871147788254287 Energy: 0.47394509399948626 Energy: 0.47871147788254287 Energy: 0.47394509399948626 Energy: 0.48952657932792804 Energy: 0.5031199684258897 Energy: 0.48952657932792804 Energy: 0.5031199684258897 Energy: 0.48952657932792804 Energy: 0.5031199684258897 Energy: 0.5573426735406161 Energy: 0.6211335593823352 Energy: 0.5573426735410413 Energy: 0.6211335593827604 Energy: 0.5573426735410413 Energy: 0.6211335593823352 Energy: 0.7031372665150077 Energy: 0.6214589508613341 Energy: 0.7031372665145825 Energy: 0.6214589508613341 Energy: 0.7031372665145825 Energy: 0.6214589508613341 Energy: 0.4677575739527989 Energy: 0.49541793360659 Energy: 0.4677575739523736 Energy: 0.49541793360659 Energy: 0.4677575739527989 Energy: 0.49541793360659 Energy: 0.4959855138100929 Energy: 0.47377069222916923 Energy: 0.49598551381051825 Energy: 0.473770692228744 Energy: 0.49598551381051825 Energy: 0.47377069222916923 Energy: 0.4637642786785882 Energy: 0.6876145071479522 Energy: 0.4637642786785882 Energy: 0.6876145071479522 Energy: 0.46376427867901343 Energy: 0.6876145071479522 Energy: 0.5887197639991161 Energy: 0.5763463208737922 Energy: 0.5887197639991161 Energy: 0.5763463208737922 Energy: 0.5887197639991161 Energy: 0.5763463208737922 Energy: 0.4649476463328024 Energy: 0.5352634773565335 Energy: 0.4649476463328024 Energy: 0.5462098820229048 Energy: 0.4649476463328024 Energy: 0.5180362559736386 Energy: 0.497758114540409 Energy: 0.4739870553335769 Energy: 0.497758114540409 Energy: 0.4739870553335769 Energy: 0.497758114540409 Energy: 0.4739870553335769 Energy: 0.5263761755293962 Energy: 0.6715692032339937 Energy: 0.5263761755293962 Energy: 0.671569203234419 Energy: 0.5263761755293962 Energy: 0.6715692032339937 Energy: 0.6109282676202493 Energy: 0.5146333180772075 Energy: 0.6109282676206746 Energy: 0.5146333180776327 Energy: 0.6109282676206746 Energy: 0.5146333180772075 Energy: 0.5921020396800227 Energy: 0.5721995548875133 Energy: 0.5921020396800227 Energy: 0.5128004590330143 Energy: 0.5921020396800227 Energy: 0.5128004590325891 Energy: 0.4914373474290718 Energy: 0.5278628935697645 Energy: 0.4914373474294971 Energy: 0.5278628935697645 Energy: 0.4914373474290718 Energy: 0.5278628935697645 Energy: 0.5576657928457406 Energy: 0.6296225785716326 Energy: 0.5576657928457406 Energy: 0.6296225785716326 Energy: 0.5576657928461659 Energy: 0.6296225785712074 Energy: 0.5873553545603978 Energy: 0.47228174584490956 Energy: 0.5873553545603978 Energy: 0.47228174584448435 Energy: 0.5873553545603978 Energy: 0.47228174584448435 Energy: 0.4648441055107092 Energy: 0.5331589427098659 Energy: 0.4648441055107092 Energy: 0.5331589427102911 Energy: 0.4648441055107092 Energy: 0.5331589427098659 Energy: 0.46356418019983053 Energy: 0.5244999336108608 Energy: 0.46356418019940526 Energy: 0.5244999336108608 Energy: 0.46356418019940526 Energy: 0.5244999336108608 Energy: 0.5023218670303174 Energy: 0.6413453497089386 Energy: 0.5023218670307427 Energy: 0.6413453497089386 Energy: 0.5023218670298922 Energy: 0.6413453497089386 Energy: 0.4798321627440576 Energy: 0.47220769565471526 Energy: 0.4798321627444829 Energy: 0.47220769565471526 Energy: 0.4798321627440576 Energy: 0.47220769565514054 Energy: 0.48931244551718345 Energy: 0.5289081963666434 Energy: 0.48931244551718345 Energy: 0.5289081963670689 Energy: 0.48931244551718345 Energy: 0.5289081963670689 Energy: 0.5898136096351871 Energy: 0.5297707191175264 Energy: 0.5898136096347618 Energy: 0.5297707191175264 Energy: 0.5898136096347618 Energy: 0.5297707191175264 Energy: 0.6623551445102972 Energy: 0.5140611387954452 Energy: 0.6623551445107225 Energy: 0.51406113879502 Energy: 0.6623551445102972 Energy: 0.5140611387954452 Energy: 0.4676936787768269 Energy: 0.49703999240001945 Energy: 0.4676936787764015 Energy: 0.49703999240001945 Energy: 0.4676936787768269 Energy: 0.49703999240001945 Energy: 0.49926217469252404 Energy: 0.47246249964941006 Energy: 0.49926217469252404 Energy: 0.47246249964941006 Energy: 0.49926217469252404 Energy: 0.47246249964941006 Energy: 0.46361543693551543 Energy: 0.5191490384500865 Energy: 0.46361543693551543 Energy: 0.5191490384496613 Energy: 0.46361543693594076 Energy: 0.5191490384500865 minimum gb energy = 0.4634569035922093 eV minimum distance = 2.60752886145531 Angstroms sigma value = 33 ======================================== theta = 62.439396894736774 ======================================== Energy: 0.5057318192993997 Energy: 0.48118598787970607 Energy: 0.4888477077712245 Energy: 0.48118598787940764 Energy: 0.5057318192996982 Energy: 0.4811859878788107 Energy: 0.7258569722453208 Energy: 0.48284739737189075 Energy: 0.7258569722474101 Energy: 0.48284739737189075 Energy: 0.7258569722453208 Energy: 0.4828473973721892 Energy: 0.6333396641853665 Energy: 0.6921886389598528 Energy: 0.6333396641859634 Energy: 0.6921886389607482 Energy: 0.633339664185665 Energy: 0.6921886389607482 Energy: 0.5972330618558086 Energy: 0.49017761692739104 Energy: 0.5972330618543162 Energy: 0.49017761692768946 Energy: 0.5972330618555102 Energy: 0.4901776169270926 Energy: 0.4857494125998449 Energy: 0.583222596611143 Energy: 0.4857592185650943 Energy: 0.583222596611143 Energy: 0.48574941260014337 Energy: 0.5832225966093522 Energy: 0.5771181639558864 Energy: 0.5261026865647094 Energy: 0.577118163956782 Energy: 0.5261026865644108 Energy: 0.5771181639558864 Energy: 0.5261026865614262 Energy: 0.5415111307741474 Energy: 0.6985869196421401 Energy: 0.5415111307747443 Energy: 0.6985869196418418 Energy: 0.5415111307744459 Energy: 0.6985869196397525 Energy: 0.5671643424343198 Energy: 0.6501096543661897 Energy: 0.567164342433126 Energy: 0.6501096543658913 Energy: 0.5671643424337229 Energy: 0.6501096543646974 Energy: 0.613779810310355 Energy: 0.5212320415468121 Energy: 0.6137785957938123 Energy: 0.5212320415468121 Energy: 0.6137798103106537 Energy: 0.5212320415468121 Energy: 0.7033832033462722 Energy: 0.49368720207033745 Energy: 0.7033832033459738 Energy: 0.49368720207033745 Energy: 0.7033832033459738 Energy: 0.4936872020712329 Energy: 0.6020523476601027 Energy: 0.5920919957947978 Energy: 0.6020523476589088 Energy: 0.5920919957947978 Energy: 0.6020523476598042 Energy: 0.5920919957944993 Energy: 0.5609473138691518 Energy: 0.49024837000431887 Energy: 0.5609473138691518 Energy: 0.49024837000431887 Energy: 0.5609473138691518 Energy: 0.4902483700052143 Energy: 0.5128119186883978 Energy: 0.6231834362180599 Energy: 0.5128119186883978 Energy: 0.6231834362183585 Energy: 0.5128119186892932 Energy: 0.6231834362177614 Energy: 0.5934848344181003 Energy: 0.572538606609108 Energy: 0.5934848344192942 Energy: 0.572538606609108 Energy: 0.5934848344178019 Energy: 0.5725386066070186 Energy: 0.5921280676924211 Energy: 0.5223366397350507 Energy: 0.5921280676921227 Energy: 0.5223366397347522 Energy: 0.5921280676924211 Energy: 0.5223366397356476 Energy: 0.5227371245905169 Energy: 0.5922215182257354 Energy: 0.5227371245905169 Energy: 0.5922215182254369 Energy: 0.5227371245908154 Energy: 0.5922215182275262 Energy: 0.552588689910711 Energy: 0.4859775135897707 Energy: 0.552588689910711 Energy: 0.4859775135897707 Energy: 0.5525886899110094 Energy: 0.48597751359066615 Energy: 0.49732390417283096 Energy: 0.6095457902185022 Energy: 0.4977196672279334 Energy: 0.6095457902188006 Energy: 0.49732390417283096 Energy: 0.6095457902199944 Energy: 0.6908134305592659 Energy: 0.6403266595241216 Energy: 0.6908134305583704 Energy: 0.6403266595241216 Energy: 0.6908134305592659 Energy: 0.6403266595220324 Energy: 0.513108228597999 Energy: 0.5194627986350859 Energy: 0.5131082285982974 Energy: 0.5194627986350859 Energy: 0.513108228597999 Energy: 0.5194627986356828 Energy: 0.48181094965212296 Energy: 0.4892896710595238 Energy: 0.48181094965212296 Energy: 0.4892896710595238 Energy: 0.4818109496518245 Energy: 0.4892896710604192 Energy: 0.48192635519562 Energy: 0.6878170820512228 Energy: 0.4818556770604103 Energy: 0.6878170820512228 Energy: 0.48192635519562 Energy: 0.6878170820509243 Energy: 0.5640248956711745 Energy: 0.5232180331348497 Energy: 0.5640248956705777 Energy: 0.5232180331348497 Energy: 0.5640248956714732 Energy: 0.5232180331330589 Energy: 0.4878802585662855 Energy: 0.6262120103102973 Energy: 0.48788025856568845 Energy: 0.6262120103099987 Energy: 0.4878802585665839 Energy: 0.6262120103111927 Energy: 0.5274678138326676 Energy: 0.48600816481568276 Energy: 0.5274678138326676 Energy: 0.48600816481508585 Energy: 0.5274678138317722 Energy: 0.4860081648153843 Energy: 0.52580133532119 Energy: 0.6297541992868018 Energy: 0.5258013353214883 Energy: 0.6297541992868018 Energy: 0.5258013353208915 Energy: 0.6297541992873986 Energy: 0.611464655670696 Energy: 0.5408508037847727 Energy: 0.6114646556695021 Energy: 0.5408508037844741 Energy: 0.6114646556703975 Energy: 0.5408508037838772 Energy: 0.5080034794429183 Energy: 0.4927857481963124 Energy: 0.4908746871200742 Energy: 0.4927857481963124 Energy: 0.5080034794426199 Energy: 0.4927857481963124 Energy: 0.5210812319477715 Energy: 0.5867135447991523 Energy: 0.5210812319471744 Energy: 0.5867135447994507 Energy: 0.5210812319474729 Energy: 0.5867135448003462 Energy: 0.5206834433200273 Energy: 0.7024153898474368 Energy: 0.520683443319132 Energy: 0.7024153898471384 Energy: 0.5206834433200273 Energy: 0.7024153898471384 Energy: 0.5414141412758369 Energy: 0.48700262480205214 Energy: 0.5414141412773293 Energy: 0.48700262480205214 Energy: 0.5414141412758369 Energy: 0.4870026248026491 Energy: 0.48778868851681106 Energy: 0.5626812519415416 Energy: 0.48778426292520843 Energy: 0.56268125194184 Energy: 0.48778868851651264 Energy: 0.5626812519406462 Energy: 0.5865425328493798 Energy: 0.5279182219097396 Energy: 0.5865425328505737 Energy: 0.5279182219097396 Energy: 0.5865425328493798 Energy: 0.527918221909441 Energy: 0.5933606828305014 Energy: 0.632949982435823 Energy: 0.5933606828307998 Energy: 0.632949982435823 Energy: 0.5933606828305014 Energy: 0.6329499824361214 Energy: 0.5701390120213082 Energy: 0.6435068355625038 Energy: 0.5701390120222037 Energy: 0.6435068355625038 Energy: 0.5701390120210099 Energy: 0.6435068355619067 Energy: 0.5128017794785986 Energy: 0.5155639794979896 Energy: 0.5130144485612608 Energy: 0.5155639794979896 Energy: 0.5128017794785986 Energy: 0.5155639795009742 Energy: 0.4944676003926381 Energy: 0.5502668064942747 Energy: 0.4944676003926381 Energy: 0.5502668064945732 Energy: 0.4944676003923396 Energy: 0.5502668064930809 Energy: 0.5559056098555311 Energy: 0.48632703461614657 Energy: 0.5559056098564265 Energy: 0.48632703461584814 Energy: 0.5559056098552325 Energy: 0.48632703461674354 Energy: 0.5085467338198104 Energy: 0.6899147488969835 Energy: 0.5085681898677417 Energy: 0.689914748897282 Energy: 0.5085467338198104 Energy: 0.6899147488984758 Energy: 0.5189494080518102 Energy: 0.5138139030476018 Energy: 0.5189494080509148 Energy: 0.5138139030470048 Energy: 0.5189494080515117 Energy: 0.5138139030455126 Energy: 0.49093319513399386 Energy: 0.4837180735970548 Energy: 0.4909331951345907 Energy: 0.4837180735970548 Energy: 0.4909331951342923 Energy: 0.4837180735964578 Energy: 0.6543474827976542 Energy: 0.5245594503047893 Energy: 0.6543474827967588 Energy: 0.5245594503050879 Energy: 0.6543474827979527 Energy: 0.5245594503044909 Energy: 0.5206443257257969 Energy: 0.6166591723370408 Energy: 0.5206443257272892 Energy: 0.6166591723370408 Energy: 0.5206443257254985 Energy: 0.6166591723373391 Energy: 0.5749860391656058 Energy: 0.4862409098067003 Energy: 0.5749860391662026 Energy: 0.4862409098067003 Energy: 0.5749860391656058 Energy: 0.48624090980699874 Energy: 0.4882519860870793 Energy: 0.6265074552026573 Energy: 0.4882641632982726 Energy: 0.6265074552026573 Energy: 0.4882519860867809 Energy: 0.6265074552014633 Energy: 0.5782882711220857 Energy: 0.5373341509809848 Energy: 0.5782882711214887 Energy: 0.5373341509812833 Energy: 0.5782882711223842 Energy: 0.5373341509818803 Energy: 0.4816140443965402 Energy: 0.6400860262981741 Energy: 0.48161404439564476 Energy: 0.6400860262984726 Energy: 0.4816140443965402 Energy: 0.6400860262990694 minimum gb energy = 0.4811859878788107 eV minimum distance = 2.63109342418068 Angstroms sigma value = 67 ======================================== theta = 70.52877936550931 ======================================== Energy: 0.38325681781705695 Energy: 0.37389700503099493 Energy: 0.38325681781685295 Energy: 0.373897005031199 Energy: 0.3832568178166716 Energy: 0.37389700503140294 Energy: 0.34694460010539996 Energy: 0.3372830224670723 Energy: 0.3469446001046066 Energy: 0.33728302246727637 Energy: 0.34694460010519595 Energy: 0.33728302246727637 Energy: 0.559463711653027 Energy: 0.7322103247652543 Energy: 0.559463711652823 Energy: 0.7322103247652543 Energy: 0.5898079717353517 Energy: 0.7322103247650502 Energy: 0.34693960030334015 Energy: 0.33725991076746126 Energy: 0.34693960030334015 Energy: 0.33725991076746126 Energy: 0.34693960030293214 Energy: 0.33725991076746126 Energy: 0.38325681781646764 Energy: 0.37389700503158435 Energy: 0.3832568178166716 Energy: 0.37389700503158435 Energy: 0.38325681781646764 Energy: 0.37389700503158435 Energy: 0.346944600105604 Energy: 0.3372830224670723 Energy: 0.34694460010519595 Energy: 0.33728302246727637 Energy: 0.34694460010539996 Energy: 0.3372830224670723 Energy: 0.4700255228112536 Energy: 0.7322103247650502 Energy: 0.47002552281107224 Energy: 0.7322103247652543 Energy: 0.47002552281086823 Energy: 0.7322103247650502 minimum gb energy = 0.33725991076746126 eV minimum distance = 2.6201264445359 Angstroms sigma value = 3 ======================================== theta = 77.88488253796277 ======================================== Energy: 0.670029747324388 Energy: 0.44678424291786983 Energy: 0.6565756839494179 Energy: 0.44678424291599433 Energy: 0.6700297473241412 Energy: 0.4467842429162411 Energy: 0.5233550255494742 Energy: 0.4841587134036547 Energy: 0.5233550255486352 Energy: 0.4841587134025689 Energy: 0.5233550255470065 Energy: 0.4841587134025689 Energy: 0.5134769557330332 Energy: 0.6648851668674898 Energy: 0.5038881513445108 Energy: 0.6648851668694146 Energy: 0.5134769557333292 Energy: 0.6648851668696614 Energy: 0.5391395128617291 Energy: 0.5071821411988137 Energy: 0.539139512862272 Energy: 0.508832109234391 Energy: 0.5391395128617291 Energy: 0.5174851517019421 Energy: 0.4747115492482782 Energy: 0.5166311990370221 Energy: 0.4747115492490679 Energy: 0.516631199038108 Energy: 0.47471154924852504 Energy: 0.5166311990384042 Energy: 0.5242684499578826 Energy: 0.5340672222542165 Energy: 0.5242684499587218 Energy: 0.5340672222555491 Energy: 0.5242684499581789 Energy: 0.5340672222553023 Energy: 0.5850039895005764 Energy: 0.6554000963067604 Energy: 0.5851165452474986 Energy: 0.6554000963073033 Energy: 0.585003989501909 Energy: 0.6554000963070565 Energy: 0.5393238579969011 Energy: 0.5507479075155226 Energy: 0.5393238579971479 Energy: 0.5507479075155226 Energy: 0.5393238579955192 Energy: 0.5507479075158187 Energy: 0.5756148918980668 Energy: 0.5182170965491668 Energy: 0.5756148918983135 Energy: 0.5182170965507955 Energy: 0.5756148918964381 Energy: 0.5182170965510917 Energy: 0.5109581159236798 Energy: 0.5329420910311212 Energy: 0.5109581159228407 Energy: 0.5329420910291963 Energy: 0.5109581159222978 Energy: 0.5329420910294924 Energy: 0.6165744819881 Energy: 0.6535576121985572 Energy: 0.6165744819867673 Energy: 0.6535576121980142 Energy: 0.6165744819848425 Energy: 0.6535576121980142 Energy: 0.5246610016913191 Energy: 0.49956243446854226 Energy: 0.5246610866300339 Energy: 0.5008835345128013 Energy: 0.5246610016921087 Energy: 0.5008835345133442 Energy: 0.5465425290907959 Energy: 0.5440887504458088 Energy: 0.5465425290924247 Energy: 0.544088750445266 Energy: 0.5465425290913389 Energy: 0.544088750445562 Energy: 0.5158694856991668 Energy: 0.5293473250719981 Energy: 0.5158694856999565 Energy: 0.5293473250719981 Energy: 0.5158694857007955 Energy: 0.5293473250719981 Energy: 0.6904399377338722 Energy: 0.6077183480884203 Energy: 0.690439937734415 Energy: 0.6077183480867916 Energy: 0.6904399377338722 Energy: 0.6077183480870877 Energy: 0.6438018356631431 Energy: 0.5271691670032368 Energy: 0.6438018356615144 Energy: 0.5271691670023978 Energy: 0.6438018356628469 Energy: 0.5187978040413302 Energy: 0.5845744693019475 Energy: 0.5241457597606879 Energy: 0.5845744693022437 Energy: 0.5241457597565915 Energy: 0.5845744693035761 Energy: 0.5241457597565915 Energy: 0.5258560988767872 Energy: 0.6048653427620668 Energy: 0.5258560988773301 Energy: 0.6048653427618201 Energy: 0.5258560988773301 Energy: 0.6048653427631526 Energy: 0.6642592805677354 Energy: 0.5130101494005617 Energy: 0.6642592805674392 Energy: 0.5130101494002657 Energy: 0.6642592805685251 Energy: 0.5130101494002657 Energy: 0.532845090812409 Energy: 0.5457287150255744 Energy: 0.5328450908145805 Energy: 0.5457287150239456 Energy: 0.5328450908134948 Energy: 0.5457287150242418 Energy: 0.5559046471145459 Energy: 0.6523854728708987 Energy: 0.5558963427074401 Energy: 0.6523854728700597 Energy: 0.5559046471134601 Energy: 0.6523854728698129 Energy: 0.5015895165808185 Energy: 0.6221205787190206 Energy: 0.5017908766089341 Energy: 0.6221205787176386 Energy: 0.5015895165851618 Energy: 0.6221205787179348 Energy: 0.6505855233408289 Energy: 0.44674773779226695 Energy: 0.6505855233392002 Energy: 0.44674773779310606 Energy: 0.6505855233386573 Energy: 0.4467477377936489 Energy: 0.51542946769297 Energy: 0.5599445239258514 Energy: 0.51542946769297 Energy: 0.5599445239258514 Energy: 0.5154294676932167 Energy: 0.5599445239253084 Energy: 0.5196190367515047 Energy: 0.6523435946191667 Energy: 0.5196190367515047 Energy: 0.6523435946191667 Energy: 0.5196190367528373 Energy: 0.6523435946191667 Energy: 0.4458705054624905 Energy: 0.5707983535507944 Energy: 0.4460090709472624 Energy: 0.5707983535510905 Energy: 0.4458705054624905 Energy: 0.5707983535507944 Energy: 0.6412353176388776 Energy: 0.5046861739098673 Energy: 0.6412353176402596 Energy: 0.5046861739123352 Energy: 0.6412353176388776 Energy: 0.5046861739123352 Energy: 0.5457079196302408 Energy: 0.5107686590679762 Energy: 0.5457079196318695 Energy: 0.510768659065015 Energy: 0.5457079196324124 Energy: 0.510768659065015 Energy: 0.5334936427757858 Energy: 0.5239325549115609 Energy: 0.533493642776082 Energy: 0.523932554911857 Energy: 0.533493642776082 Energy: 0.5239325549121038 Energy: 0.560323406125671 Energy: 0.5156777497444699 Energy: 0.5437012979139686 Energy: 0.5156777497452595 Energy: 0.5603234061264606 Energy: 0.5156777497447167 Energy: 0.7008216744640833 Energy: 0.5198913326994788 Energy: 0.7056297614610922 Energy: 0.519891332698936 Energy: 0.7008216744635403 Energy: 0.519891332698936 Energy: 0.5668550553923875 Energy: 0.5216156353357496 Energy: 0.5668550553915979 Energy: 0.5216156353368355 Energy: 0.5668550553913017 Energy: 0.5216156353362925 Energy: 0.5365416982689126 Energy: 0.5237085271367063 Energy: 0.5365416982661981 Energy: 0.523708527136953 Energy: 0.5365416982661981 Energy: 0.5237085271388778 Energy: 0.5454369475606139 Energy: 0.5391181309702274 Energy: 0.5454369475614037 Energy: 0.5391181309699807 Energy: 0.5454369475595282 Energy: 0.5391181309702274 Energy: 0.5284914724536245 Energy: 0.5583418088510904 Energy: 0.5284914724533283 Energy: 0.5583418088491657 Energy: 0.5284914724544141 Energy: 0.5583418088500047 Energy: 0.5173397364756318 Energy: 0.6534933133323838 Energy: 0.5146490601419474 Energy: 0.653493313331298 Energy: 0.5173397364769645 Energy: 0.653493313331298 Energy: 0.5173145309345198 Energy: 0.5927163229750644 Energy: 0.5175349198849756 Energy: 0.5927163229734357 Energy: 0.5173145309348159 Energy: 0.5927163229734357 Energy: 0.6020809591532473 Energy: 0.442788187451666 Energy: 0.6020809591529511 Energy: 0.4427881874503334 Energy: 0.602080959154037 Energy: 0.4427881874500373 Energy: 0.4391811885886824 Energy: 0.6114627741195612 Energy: 0.4391811885886824 Energy: 0.6114627741198574 Energy: 0.4391811885878927 Energy: 0.611462774120647 Energy: 0.5445868524730051 Energy: 0.653554239875142 Energy: 0.544586852472709 Energy: 0.6535542398713418 Energy: 0.5445868524730051 Energy: 0.6535542398713418 Energy: 0.5280165940452455 Energy: 0.5777165796056732 Energy: 0.5280165941369467 Energy: 0.5777165796097202 Energy: 0.5280165940444558 Energy: 0.5777165796002441 Energy: 0.6380162722384316 Energy: 0.48467046308579576 Energy: 0.6380162722386783 Energy: 0.4846704630828344 Energy: 0.6380162722389745 Energy: 0.4846704630828344 Energy: 0.4587520291505497 Energy: 0.6056319744082037 Energy: 0.45875202915133934 Energy: 0.6056319744060321 Energy: 0.4587520291505497 Energy: 0.6056319744076608 Energy: 0.552976859075286 Energy: 0.5228538450572433 Energy: 0.552976859075286 Energy: 0.5228538450594148 Energy: 0.552976859074743 Energy: 0.5228538450594148 Energy: 0.6452398120592534 Energy: 0.5167346947917824 Energy: 0.6452398120595496 Energy: 0.5167346947917824 Energy: 0.6452398120587106 Energy: 0.5167346947917824 Energy: 0.6105187133314085 Energy: 0.43900797912213413 Energy: 0.6105187133338763 Energy: 0.43900797912183803 Energy: 0.6105187133335802 Energy: 0.43900797912183803 Energy: 0.4980647666082831 Energy: 0.5420032643109327 Energy: 0.49806473182452393 Energy: 0.5420032643117224 Energy: 0.49806476660586463 Energy: 0.5420032643117224 Energy: 0.5130225862434024 Energy: 0.5427748097390749 Energy: 0.5130225862417737 Energy: 0.542774809738532 Energy: 0.5130225862434024 Energy: 0.542774809738532 Energy: 0.5291213931305694 Energy: 0.5194371365294269 Energy: 0.5291213931302732 Energy: 0.5194371365291307 Energy: 0.5291213931321981 Energy: 0.5194371365294269 Energy: 0.5397699575486472 Energy: 0.5582665782465871 Energy: 0.5397699575486472 Energy: 0.558266578246834 Energy: 0.5397699575478082 Energy: 0.5582665782473768 Energy: 0.5197212858881162 Energy: 0.5335366585731617 Energy: 0.5198370099777687 Energy: 0.5335366585756294 Energy: 0.5197212858864876 Energy: 0.5335366585761723 minimum gb energy = 0.43900797912183803 eV minimum distance = 2.5286482091975 Angstroms sigma value = 81 ======================================== theta = 80.63108442154517 ======================================== Energy: 0.6693648550883055 Energy: 0.52974144352106 Energy: 0.6487162954349251 Energy: 0.5297414435221778 Energy: 0.6693648550890506 Energy: 0.5297414435221778 Energy: 0.48450106995390685 Energy: 0.5270572014439188 Energy: 0.48450106995390685 Energy: 0.527057201444664 Energy: 0.48450106995465203 Energy: 0.5270572014450365 Energy: 0.5236343229502546 Energy: 0.5887246963554061 Energy: 0.507287138583913 Energy: 0.5887246963572689 Energy: 0.5236343229509997 Energy: 0.5887246963565238 Energy: 0.43587149495665745 Energy: 0.46823729440403195 Energy: 0.43587149495665745 Energy: 0.46823729440440454 Energy: 0.43587149495703004 Energy: 0.46823729440440454 Energy: 0.6114157358849683 Energy: 0.46730311584642914 Energy: 0.6114157358845959 Energy: 0.4673031158471743 Energy: 0.6114157358853409 Energy: 0.4673031158471743 Energy: 0.5179272483673165 Energy: 0.45318837446796106 Energy: 0.5179272483661987 Energy: 0.4531883744668434 Energy: 0.5179272483658263 Energy: 0.45318837446721594 Energy: 0.5220520044829062 Energy: 0.6291867561276958 Energy: 0.5221044098060893 Energy: 0.6291867561288135 Energy: 0.5220520044821612 Energy: 0.6291867561288135 Energy: 0.5444066695747612 Energy: 0.5823626922390069 Energy: 0.5444087512476972 Energy: 0.5823626922393794 Energy: 0.5444066695736436 Energy: 0.5823626922393794 Energy: 0.578051665752601 Energy: 0.4905900146364602 Energy: 0.5780516657522285 Energy: 0.49059001463757784 Energy: 0.5780516657522285 Energy: 0.49059001463757784 Energy: 0.5153419844687983 Energy: 0.6052210670265277 Energy: 0.515341984469171 Energy: 0.6052210670257826 Energy: 0.5153419844699161 Energy: 0.6052210670257826 Energy: 0.5104590520919784 Energy: 0.6965336679881466 Energy: 0.5104590520919784 Energy: 0.6965336679862838 Energy: 0.5104590520923511 Energy: 0.6965336679862838 Energy: 0.5053292628799748 Energy: 0.5214480112858024 Energy: 0.5053292628796024 Energy: 0.5214480112850574 Energy: 0.5053292628796024 Energy: 0.5214480112854298 Energy: 0.5805884735433202 Energy: 0.5349891022586525 Energy: 0.5805884735436928 Energy: 0.5349891022571622 Energy: 0.5805884735433202 Energy: 0.5349891022571622 Energy: 0.49299182832333965 Energy: 0.5522992801034237 Energy: 0.49299182832371224 Energy: 0.5522992801011883 Energy: 0.4929918283229672 Energy: 0.5522992801019334 Energy: 0.5897743012260664 Energy: 0.52924887584654 Energy: 0.5897743012264389 Energy: 0.5292488758450496 Energy: 0.5897743012268115 Energy: 0.5292488758450496 Energy: 0.5441295091991937 Energy: 0.4974547286373057 Energy: 0.5441295091984485 Energy: 0.4974547286380509 Energy: 0.544129509198076 Energy: 0.49745472863767837 Energy: 0.5748915795165218 Energy: 0.6050523282835202 Energy: 0.5744226769389311 Energy: 0.6050523282831476 Energy: 0.5748915795176395 Energy: 0.6050523282831476 Energy: 0.5239864951465629 Energy: 0.5577955296442382 Energy: 0.5239981466678395 Energy: 0.5577955296434929 Energy: 0.5239864951465629 Energy: 0.5577955296457283 Energy: 0.5884083238560581 Energy: 0.5359431635083458 Energy: 0.5884083238564306 Energy: 0.5359431635068554 Energy: 0.5884083238553129 Energy: 0.535943163506483 Energy: 0.46683878178068955 Energy: 0.4939678962673809 Energy: 0.4668387817810621 Energy: 0.4939678962666358 Energy: 0.4668387817810621 Energy: 0.4939678962670083 Energy: 0.5541319676783185 Energy: 0.6110169582641762 Energy: 0.5541319676779459 Energy: 0.6110169582630586 Energy: 0.5541319676779459 Energy: 0.611016958263431 Energy: 0.5251570916591954 Energy: 0.5383064659608331 Energy: 0.5044927493692873 Energy: 0.5383064659612057 Energy: 0.5251570916591954 Energy: 0.5383064659612057 Energy: 0.7207692544531225 Energy: 0.5980591522641707 Energy: 0.7001233509660708 Energy: 0.5980591522641707 Energy: 0.7207692544523774 Energy: 0.5980591522637981 Energy: 0.582736839314857 Energy: 0.543505865697071 Energy: 0.5827368393144844 Energy: 0.5435058656966986 Energy: 0.582736839314857 Energy: 0.5435058656966986 Energy: 0.49049582902001226 Energy: 0.577697524034293 Energy: 0.49049582902001226 Energy: 0.577697524034293 Energy: 0.49049582901926714 Energy: 0.577697524034293 Energy: 0.6606951860439902 Energy: 0.6480757368159404 Energy: 0.6606951860439902 Energy: 0.6480757368174307 Energy: 0.6606951860447353 Energy: 0.6480757368174307 Energy: 0.5213277074527243 Energy: 0.4358549221636934 Energy: 0.5213277074534693 Energy: 0.4358549221636934 Energy: 0.5213277074534693 Energy: 0.4358549221636934 Energy: 0.5046600696786515 Energy: 0.45345213410899105 Energy: 0.5048800525086156 Energy: 0.4534521341108539 Energy: 0.49641456958192254 Energy: 0.4534521341119716 Energy: 0.5336102405568195 Energy: 0.5843904253085557 Energy: 0.5336061779147747 Energy: 0.5843904253081832 Energy: 0.533610240557937 Energy: 0.5843904253081832 Energy: 0.5607536343413181 Energy: 0.43506803355718776 Energy: 0.560753634340573 Energy: 0.43506803355867796 Energy: 0.5607536343409455 Energy: 0.43506803355867796 Energy: 0.467748349681931 Energy: 0.5836417678533083 Energy: 0.4677483496815585 Energy: 0.5836417678536807 Energy: 0.4677483496815585 Energy: 0.5836417678540534 Energy: 0.5047909344037237 Energy: 0.5447625124565363 Energy: 0.5047909344037237 Energy: 0.5447625124569088 Energy: 0.5047909344037237 Energy: 0.5447625124569088 Energy: 0.5858948215679953 Energy: 0.4486864535235864 Energy: 0.5858948215679953 Energy: 0.4486864535235864 Energy: 0.5858948215679953 Energy: 0.44868645352321385 Energy: 0.6931992424042598 Energy: 0.5901344401542928 Energy: 0.6931992424038871 Energy: 0.5901344401550379 Energy: 0.6931992424046324 Energy: 0.5901344401550379 Energy: 0.48163733615310367 Energy: 0.5929743528190023 Energy: 0.48163809671361935 Energy: 0.5929743528733626 Energy: 0.48163733615310367 Energy: 0.5929743528402046 Energy: 0.4919286002759363 Energy: 0.46742059801046637 Energy: 0.4919286002755637 Energy: 0.46742059801270175 Energy: 0.4919286002751912 Energy: 0.46742059801158403 Energy: 0.5287690185095337 Energy: 0.5518586220061461 Energy: 0.528769018510279 Energy: 0.5518586220065187 Energy: 0.528769018510279 Energy: 0.5518586220065187 Energy: 0.6946521871980506 Energy: 0.5550244688734638 Energy: 0.6946521871980506 Energy: 0.5550244688730913 Energy: 0.6946521871991683 Energy: 0.5550244688730913 minimum gb energy = 0.43506803355718776 eV minimum distance = 2.50653143655061 Angstroms sigma value = 43 ======================================== theta = 82.945868617881 ======================================== Energy: 0.59980743931072 Energy: 0.45729678878934205 Energy: 0.59980743931072 Energy: 0.45729678878934205 Energy: 0.59980743931072 Energy: 0.45729678878934205 Energy: 0.5763880446619775 Energy: 0.49001922580761353 Energy: 0.5763880446619775 Energy: 0.49001922580761353 Energy: 0.5763880446619775 Energy: 0.49001922580761353 Energy: 0.49088946368397657 Energy: 0.6565830549038842 Energy: 0.49088946368397657 Energy: 0.6565830549038842 Energy: 0.502751139912115 Energy: 0.6565830549038842 Energy: 0.5430802315574672 Energy: 0.522178439666622 Energy: 0.5430802315574672 Energy: 0.522178439666622 Energy: 0.5430802315574672 Energy: 0.522178439666622 Energy: 0.5836112558020162 Energy: 0.51933347885052 Energy: 0.5836112558020162 Energy: 0.51933347885052 Energy: 0.5836112558020162 Energy: 0.51933347885052 Energy: 0.5011242286256338 Energy: 0.4795935452409313 Energy: 0.5011242286256338 Energy: 0.4795935452409313 Energy: 0.5011242286256338 Energy: 0.4795935452409313 Energy: 0.5993229900321587 Energy: 0.5341756064865452 Energy: 0.5993229900321587 Energy: 0.5341756064865452 Energy: 0.5993229900321587 Energy: 0.5341756064865452 Energy: 0.5193655451027717 Energy: 0.4861521152919014 Energy: 0.5193655451027717 Energy: 0.48615211529235897 Energy: 0.5193655451023141 Energy: 0.4861521152919014 Energy: 0.5671913750309506 Energy: 0.5064357171362512 Energy: 0.5671913750309506 Energy: 0.5064357171362512 Energy: 0.5671913750309506 Energy: 0.5064357171357936 Energy: 0.5012773836914971 Energy: 0.5614621224043872 Energy: 0.5012773836914971 Energy: 0.5614621224039296 Energy: 0.5012773836914971 Energy: 0.5614621224039296 Energy: 0.5558133554536561 Energy: 0.5600227537138243 Energy: 0.5558133554536561 Energy: 0.5600227537138243 Energy: 0.5558133554536561 Energy: 0.560022753714282 Energy: 0.5193764615035379 Energy: 0.5170510646218137 Energy: 0.5193764615035379 Energy: 0.5170510646218137 Energy: 0.5193764615035379 Energy: 0.5170510646218137 Energy: 0.5275776035414611 Energy: 0.5642274738249503 Energy: 0.5275776035419186 Energy: 0.5642274738244927 Energy: 0.5275776035419186 Energy: 0.5642274738249503 Energy: 0.42935312585748536 Energy: 0.5803658640398723 Energy: 0.42935312585794305 Energy: 0.5803658640394148 Energy: 0.42935312585794305 Energy: 0.5803658640394148 Energy: 0.5018694310791897 Energy: 0.5142380633110415 Energy: 0.5018694310791897 Energy: 0.5142380633110415 Energy: 0.5018694310796473 Energy: 0.5142380633110415 Energy: 0.529070431559671 Energy: 0.5734926838209972 Energy: 0.529070431559671 Energy: 0.5734926838209972 Energy: 0.529070431559671 Energy: 0.5734926838209972 Energy: 0.5337647492538998 Energy: 0.5110993935321433 Energy: 0.5337647492534422 Energy: 0.5110993935321433 Energy: 0.5337647492534422 Energy: 0.5110993935321433 Energy: 0.5522776952758137 Energy: 0.5188681003158433 Energy: 0.5522776952762714 Energy: 0.5188681003163008 Energy: 0.5522776952758137 Energy: 0.5188681003158433 Energy: 0.5510008772441944 Energy: 0.5054247025447903 Energy: 0.5510008772441944 Energy: 0.5054247025447903 Energy: 0.5510008772441944 Energy: 0.5054247025447903 Energy: 0.5339553767993702 Energy: 0.5722533643073511 Energy: 0.5339553767998279 Energy: 0.5722533643073511 Energy: 0.5339553767998279 Energy: 0.5722533643073511 Energy: 0.5284379572984647 Energy: 0.5917126121639701 Energy: 0.5284379572984647 Energy: 0.5917126121639701 Energy: 0.5284379572984647 Energy: 0.5917126121639701 Energy: 0.5510822039766468 Energy: 0.5182065803070377 Energy: 0.5510822039766468 Energy: 0.5182065803070377 Energy: 0.5510822039766468 Energy: 0.5182065803070377 Energy: 0.4297145552816896 Energy: 0.5160103927856683 Energy: 0.42971455528123204 Energy: 0.5160103927856683 Energy: 0.4297145552821473 Energy: 0.5160103927856683 Energy: 0.5396319009699767 Energy: 0.58213973198019 Energy: 0.5396319009704345 Energy: 0.58213973198019 Energy: 0.5396319009704345 Energy: 0.58213973198019 Energy: 0.5192974322488816 Energy: 0.5146842452350789 Energy: 0.5192974322488816 Energy: 0.5146842452350789 Energy: 0.5192974322488816 Energy: 0.5146842452350789 Energy: 0.5721059407714859 Energy: 0.5023813650461029 Energy: 0.5721059407714859 Energy: 0.5023813650461029 Energy: 0.5721059407714859 Energy: 0.5023813650456452 Energy: 0.5254620997511922 Energy: 0.5482912325512367 Energy: 0.5254620997507347 Energy: 0.5482912325516944 Energy: 0.5254620997511922 Energy: 0.5482912325512367 Energy: 0.5937099881368889 Energy: 0.5841036613125346 Energy: 0.5937099881368889 Energy: 0.5841036613125346 Energy: 0.5937099881368889 Energy: 0.5841036613125346 Energy: 0.5194106461647306 Energy: 0.48747715423584853 Energy: 0.5194106461647306 Energy: 0.48747715423584853 Energy: 0.5194106461647306 Energy: 0.48747715423584853 Energy: 0.5858999608614872 Energy: 0.6054020298476562 Energy: 0.5858999608614872 Energy: 0.6054020298476562 Energy: 0.5858999608614872 Energy: 0.6054020298476562 Energy: 0.5017835275384791 Energy: 0.47965344700661106 Energy: 0.5017835275384791 Energy: 0.47965344700706863 Energy: 0.5017835275380215 Energy: 0.47965344700569573 minimum gb energy = 0.42935312585748536 eV minimum distance = 2.64927384901774 Angstroms sigma value = 57 ======================================== theta = 86.6277133165661 ======================================== Energy: 0.583146688479641 Energy: 0.45405376171116996 Energy: 0.583146688479641 Energy: 0.45405376171116996 Energy: 0.583146688479641 Energy: 0.45405376171057743 Energy: 0.548020737870567 Energy: 0.4301522319448778 Energy: 0.548020737870567 Energy: 0.4301522319442852 Energy: 0.548020737870567 Energy: 0.4301522319454703 Energy: 0.550263464631533 Energy: 0.5782024459913957 Energy: 0.550263464631533 Energy: 0.5782024459908032 Energy: 0.5502634646321255 Energy: 0.5782024459913957 Energy: 0.6352437062910704 Energy: 0.47875079441196333 Energy: 0.6352437062916629 Energy: 0.47875079441196333 Energy: 0.6352437062910704 Energy: 0.47875079441255586 Energy: 0.6287243728740521 Energy: 0.5558090815839233 Energy: 0.6287243728740521 Energy: 0.5558090815839233 Energy: 0.6287243728740521 Energy: 0.5558090815839233 Energy: 0.5494538673742847 Energy: 0.5443591596872159 Energy: 0.5494538673736922 Energy: 0.5443591596872159 Energy: 0.5494538673736922 Energy: 0.5443591596878085 Energy: 0.5303252517567141 Energy: 0.5262335792136773 Energy: 0.5303252517567141 Energy: 0.5262335792136773 Energy: 0.5303252517567141 Energy: 0.5262335792130848 Energy: 0.5341370813718986 Energy: 0.5033516184002107 Energy: 0.5341370813718986 Energy: 0.5033516184002107 Energy: 0.5341370813713061 Energy: 0.5033516184002107 Energy: 0.5685433962755523 Energy: 0.5117834348246965 Energy: 0.5685433962755523 Energy: 0.5117834348246965 Energy: 0.5685433962755523 Energy: 0.5117834348246965 Energy: 0.4350247025837206 Energy: 0.5053324468570329 Energy: 0.4350247025831282 Energy: 0.4993330520792572 Energy: 0.4350247025831282 Energy: 0.49171074535436643 Energy: 0.5515182360290748 Energy: 0.6161382725137647 Energy: 0.5515182360290748 Energy: 0.6161382725137647 Energy: 0.5515182360290748 Energy: 0.6161382725143573 Energy: 0.5688255322068311 Energy: 0.5686193582207136 Energy: 0.5688255322068311 Energy: 0.568619358220121 Energy: 0.5688255322068311 Energy: 0.568619358220121 Energy: 0.4880439745451448 Energy: 0.5119980389290136 Energy: 0.4880439745451448 Energy: 0.5119980389290136 Energy: 0.48804397454455234 Energy: 0.5119980389290136 Energy: 0.5614181702341356 Energy: 0.4342931036004369 Energy: 0.5614181702341356 Energy: 0.43429310359984447 Energy: 0.5614181702341356 Energy: 0.4342931036004369 Energy: 0.5225607495653372 Energy: 0.5022391308448217 Energy: 0.5225607495647446 Energy: 0.5022391308448217 Energy: 0.5225607495653372 Energy: 0.5022391308448217 Energy: 0.568827128570497 Energy: 0.5713660858137205 Energy: 0.568827128570497 Energy: 0.5713660858137205 Energy: 0.5688271285699044 Energy: 0.5713660858137205 Energy: 0.4322134111289581 Energy: 0.4909252413139429 Energy: 0.4322134111289581 Energy: 0.49092524131335036 Energy: 0.4322134111289581 Energy: 0.4909252413139429 Energy: 0.5279660282020878 Energy: 0.4863530920457175 Energy: 0.5279660282020878 Energy: 0.4863530920457175 Energy: 0.5279660282020878 Energy: 0.4863530920457175 Energy: 0.4322627069525803 Energy: 0.49082049273093126 Energy: 0.4322627069525803 Energy: 0.4908204927303387 Energy: 0.4322627069531728 Energy: 0.49082049273093126 Energy: 0.5687901478254455 Energy: 0.5713561006803821 Energy: 0.5687901478254455 Energy: 0.5713561006797897 Energy: 0.5687901478254455 Energy: 0.5713561006803821 Energy: 0.5226092733213478 Energy: 0.5021873716147177 Energy: 0.5226092733213478 Energy: 0.5021873716147177 Energy: 0.5226092733207552 Energy: 0.5021873716147177 Energy: 0.5611546821882721 Energy: 0.47863982688458734 Energy: 0.5611546821882721 Energy: 0.47863982688458734 Energy: 0.5611546821882721 Energy: 0.47863982688399487 Energy: 0.4880604691400251 Energy: 0.5119882354768798 Energy: 0.4880604691406176 Energy: 0.5119882354768798 Energy: 0.4880604691400251 Energy: 0.5119882354768798 Energy: 0.5689337039886703 Energy: 0.568567162734975 Energy: 0.5689337039892628 Energy: 0.5685671627343825 Energy: 0.5689337039886703 Energy: 0.5685671627343825 minimum gb energy = 0.4301522319442852 eV minimum distance = 2.52255829571298 Angstroms sigma value = 17 ======================================== theta = 93.3722866834339 ======================================== Energy: 0.6461380728118904 Energy: 0.48126452994291163 Energy: 0.6461380728118904 Energy: 0.48126452994291163 Energy: 0.6461380728118904 Energy: 0.48126452994291163 Energy: 0.5255847960611457 Energy: 0.5354988026286108 Energy: 0.5255847960603077 Energy: 0.5354988026286108 Energy: 0.5255847960611457 Energy: 0.5354988026294488 Energy: 0.5053785024433796 Energy: 0.5023765674119118 Energy: 0.5053785024442174 Energy: 0.5023765674119118 Energy: 0.5053785024442174 Energy: 0.5023765674127498 Energy: 0.6011199617561834 Energy: 0.5954654165522529 Energy: 0.6011199617561834 Energy: 0.5954654165522529 Energy: 0.6011199617553455 Energy: 0.5954654165522529 Energy: 0.6006164371202497 Energy: 0.5842678495212075 Energy: 0.6006164371202497 Energy: 0.5842678495212075 Energy: 0.6006164371202497 Energy: 0.5842678495212075 Energy: 0.5684604516253968 Energy: 0.5640299261344863 Energy: 0.5684604516253968 Energy: 0.5640299261344863 Energy: 0.5684604516253968 Energy: 0.5640299261344863 Energy: 0.5112968237311499 Energy: 0.525500442630557 Energy: 0.5112968237311499 Energy: 0.525500442630557 Energy: 0.511296823730312 Energy: 0.525500442630557 Energy: 0.6009793483458912 Energy: 0.5915717667198115 Energy: 0.6009793483467291 Energy: 0.5915717667198115 Energy: 0.6009793483458912 Energy: 0.5915717667198115 Energy: 0.5038590270168047 Energy: 0.5430437632373614 Energy: 0.5038590270168047 Energy: 0.5430437632373614 Energy: 0.5038590270168047 Energy: 0.5430437632373614 Energy: 0.5496658410084391 Energy: 0.5345020843702836 Energy: 0.5496658410084391 Energy: 0.5345020843702836 Energy: 0.5496658410084391 Energy: 0.5345020843702836 Energy: 0.46275178757942553 Energy: 0.5078970752769698 Energy: 0.46275178757942553 Energy: 0.5078970752769698 Energy: 0.46275178757942553 Energy: 0.5078970752769698 Energy: 0.5188853644504998 Energy: 0.5420832755540679 Energy: 0.5188853644504998 Energy: 0.5420832755540679 Energy: 0.5188853644504998 Energy: 0.5420832755540679 Energy: 0.44630463055793157 Energy: 0.5182371759502177 Energy: 0.44630463055793157 Energy: 0.5182371759510556 Energy: 0.44630463055793157 Energy: 0.5182371759502177 Energy: 0.4718865026417603 Energy: 0.5319106457649763 Energy: 0.4718865026409224 Energy: 0.5319106457649763 Energy: 0.4718865026417603 Energy: 0.5319106457649763 Energy: 0.577675280016727 Energy: 0.5632017546928604 Energy: 0.577675280016727 Energy: 0.5632017546928604 Energy: 0.577675280016727 Energy: 0.5632017546928604 Energy: 0.4925298801145867 Energy: 0.5700306771776291 Energy: 0.4925298801145867 Energy: 0.5700306771776291 Energy: 0.4925298801145867 Energy: 0.5700306771776291 Energy: 0.47075080266575026 Energy: 0.5319656878841141 Energy: 0.47075080266575026 Energy: 0.5319656878841141 Energy: 0.4707508026649123 Energy: 0.5319656878841141 minimum gb energy = 0.44630463055793157 eV minimum distance = 2.61746586017469 Angstroms sigma value = 17 ======================================== theta = 97.054131382119 ======================================== Energy: 0.6356991140714936 Energy: 0.4490546255883422 Energy: 0.63569911407117 Energy: 0.44905462558801856 Energy: 0.63569911407117 Energy: 0.4490546255883422 Energy: 0.5171777369576775 Energy: 0.4949132684067107 Energy: 0.5171777369576775 Energy: 0.47982721050171584 Energy: 0.5171777369576775 Energy: 0.49491326840638716 Energy: 0.48756320740341735 Energy: 0.46035528708952433 Energy: 0.48756320740277026 Energy: 0.46035528708952433 Energy: 0.48756320740277026 Energy: 0.46035528708952433 Energy: 0.5886099085255998 Energy: 0.4875967876938217 Energy: 0.5886099085255998 Energy: 0.4875963166563388 Energy: 0.5886099085255998 Energy: 0.48759678769414533 Energy: 0.5766104973362868 Energy: 0.49262538873499134 Energy: 0.5766104973359631 Energy: 0.49262538873531486 Energy: 0.5766104973359631 Energy: 0.4926253887356385 Energy: 0.4892544188976242 Energy: 0.4412216927689814 Energy: 0.4892544188976242 Energy: 0.44122169276865775 Energy: 0.48925441889794774 Energy: 0.44122169276865775 Energy: 0.6006285842786526 Energy: 0.51266502174089 Energy: 0.6006285842786526 Energy: 0.51266502174089 Energy: 0.6006285842786526 Energy: 0.5126650217405665 Energy: 0.5720964290598353 Energy: 0.5535336715059523 Energy: 0.5720964290598353 Energy: 0.5535336715059523 Energy: 0.5720964290601589 Energy: 0.5535336715059523 Energy: 0.5172391815667419 Energy: 0.5236724852295859 Energy: 0.5172391815664183 Energy: 0.5236724852289389 Energy: 0.5172391815667419 Energy: 0.5236724852299095 Energy: 0.511680491254098 Energy: 0.4715534087549494 Energy: 0.5116804912537745 Energy: 0.4715534087552729 Energy: 0.5116804912537745 Energy: 0.4715534087552729 Energy: 0.5798838182055569 Energy: 0.5358448051982467 Energy: 0.5798838182061747 Energy: 0.5358448051985704 Energy: 0.5798838182061747 Energy: 0.5358448051985704 Energy: 0.4911096407508756 Energy: 0.5904485616833013 Energy: 0.4911096407508756 Energy: 0.5904485616836249 Energy: 0.4911096407508756 Energy: 0.5904485616836249 Energy: 0.5027899642030448 Energy: 0.511609310633551 Energy: 0.502789964202074 Energy: 0.511609310633551 Energy: 0.502789964202074 Energy: 0.511609310633551 Energy: 0.5088494811116127 Energy: 0.4944672329690204 Energy: 0.508849481111289 Energy: 0.4944672329690204 Energy: 0.508849481111289 Energy: 0.4944672329690204 Energy: 0.5490138401528023 Energy: 0.594683947011985 Energy: 0.5490138401528023 Energy: 0.5946839470116615 Energy: 0.5490138401528023 Energy: 0.594683947011985 Energy: 0.4800594441696801 Energy: 0.5323170931028339 Energy: 0.4800594441696801 Energy: 0.5330426990025828 Energy: 0.4800594441693565 Energy: 0.5123152350861744 Energy: 0.4550099601058018 Energy: 0.4798781808226507 Energy: 0.4550099601061254 Energy: 0.4798781808229743 Energy: 0.4550099601061254 Energy: 0.4798781808226507 Energy: 0.5322844849337329 Energy: 0.5528087018345592 Energy: 0.5322844849334093 Energy: 0.5528087018342358 Energy: 0.5322844849337329 Energy: 0.5528087018345592 Energy: 0.5133028742738259 Energy: 0.5833981950526489 Energy: 0.5133028742738259 Energy: 0.5833981950526489 Energy: 0.5133028742741496 Energy: 0.5833981950526489 Energy: 0.4549269375303425 Energy: 0.46369641704957365 Energy: 0.45492693753066615 Energy: 0.46369641704925013 Energy: 0.4549269375293717 Energy: 0.46369641704957365 Energy: 0.5132932168766797 Energy: 0.5836318232402986 Energy: 0.5132932168770032 Energy: 0.5836318232402986 Energy: 0.5132932168773269 Energy: 0.5836318232402986 Energy: 0.5324816424729266 Energy: 0.5528204224001856 Energy: 0.532481642472603 Energy: 0.5528204224005091 Energy: 0.532481642472603 Energy: 0.5528204224001856 Energy: 0.4549945795484477 Energy: 0.47977298592577644 Energy: 0.4549945795487712 Energy: 0.4797729859254528 Energy: 0.45499457954909484 Energy: 0.47977298592577644 Energy: 0.4798645733909258 Energy: 0.5505336277433416 Energy: 0.47986457339124944 Energy: 0.5505336277439887 Energy: 0.47986457339157296 Energy: 0.5505336277436652 Energy: 0.5490244362425907 Energy: 0.5946285633882986 Energy: 0.5490244362432378 Energy: 0.5946285633886222 Energy: 0.5490244362425907 Energy: 0.5946285633882986 Energy: 0.5089963763906485 Energy: 0.4943142843556587 Energy: 0.5089963763906485 Energy: 0.4943142843556587 Energy: 0.5089963763906485 Energy: 0.4943142843556587 Energy: 0.5026212967636033 Energy: 0.5114081700107489 Energy: 0.5026212967632797 Energy: 0.5114081700097782 Energy: 0.5026212967632797 Energy: 0.5114081700104254 Energy: 0.49127125008555833 Energy: 0.5904007531382052 Energy: 0.4912712500852347 Energy: 0.5904007531382052 Energy: 0.49127125008555833 Energy: 0.5904007531382052 Energy: 0.5799188225153502 Energy: 0.5357862533882304 Energy: 0.5799188225150266 Energy: 0.5357862533882304 Energy: 0.5799188225153502 Energy: 0.5357862533885539 Energy: 0.5117572724304523 Energy: 0.5067318472164277 Energy: 0.5117572724304523 Energy: 0.5067318472167514 Energy: 0.5117572724301288 Energy: 0.5067318472164277 Energy: 0.5172800642742115 Energy: 0.5236969787602085 Energy: 0.517280064274535 Energy: 0.5236969787598849 Energy: 0.5172800642742115 Energy: 0.5236969787602085 Energy: 0.5721282356638266 Energy: 0.5535194356741636 Energy: 0.5721282356638266 Energy: 0.5535194356741636 Energy: 0.5721282356638266 Energy: 0.5535194356738401 Energy: 0.6006921280456717 Energy: 0.5126605663114309 Energy: 0.6006921280456717 Energy: 0.5126605663117545 Energy: 0.6006921280459953 Energy: 0.5126605663114309 Energy: 0.4891888987913275 Energy: 0.4487669649036533 Energy: 0.4891888987916511 Energy: 0.4487669649033297 Energy: 0.4891888987913275 Energy: 0.4487669649036533 Energy: 0.5769228040281266 Energy: 0.492555071498765 Energy: 0.5769228040284501 Energy: 0.492555071497147 Energy: 0.5769228040284501 Energy: 0.49255507149779415 Energy: 0.5886384020943393 Energy: 0.48064934227757716 Energy: 0.5886384020940157 Energy: 0.48064934227757716 Energy: 0.5886384020943393 Energy: 0.48064934227757716 Energy: 0.48749598576542585 Energy: 0.46096331041497807 Energy: 0.4874959857657494 Energy: 0.46096331041497807 Energy: 0.4874959857657494 Energy: 0.46096331041497807 Energy: 0.5172104168234677 Energy: 0.49970971054189783 Energy: 0.5172104168234677 Energy: 0.4997097105422213 Energy: 0.5172104168234677 Energy: 0.4997097105422213 Energy: 0.6356991140721409 Energy: 0.44905462558801856 Energy: 0.6356991140721409 Energy: 0.44905462558801856 Energy: 0.6356991140721409 Energy: 0.44905462558801856 Energy: 0.5171777369580011 Energy: 0.4949132684070343 Energy: 0.5171777369580011 Energy: 0.4949132684067107 Energy: 0.5171777369580011 Energy: 0.4949132684070343 Energy: 0.4875632074017994 Energy: 0.4603552870914658 Energy: 0.4875632074014759 Energy: 0.46035528709081863 Energy: 0.4875632074017994 Energy: 0.46035528709114226 Energy: 0.5886099085249527 Energy: 0.47813951367440055 Energy: 0.588609908524629 Energy: 0.4781395136740769 Energy: 0.588609908524629 Energy: 0.47813951367440055 Energy: 0.5766104973356396 Energy: 0.4926253887346677 Energy: 0.5766104973359631 Energy: 0.4926253887346677 Energy: 0.5766104973356396 Energy: 0.4926253887346677 minimum gb energy = 0.44122169276865775 eV minimum distance = 2.59028610120766 Angstroms sigma value = 57 ======================================== theta = 99.36891557845483 ======================================== Energy: 0.6148623853676836 Energy: 0.42189698534163783 Energy: 0.6148623853682105 Energy: 0.42189698534163783 Energy: 0.6148623853682105 Energy: 0.42189698534163783 Energy: 0.4791847636430954 Energy: 0.4529720327182404 Energy: 0.4791847636430954 Energy: 0.4529720327182404 Energy: 0.47918476364362234 Energy: 0.4529720327182404 Energy: 0.46152274503538543 Energy: 0.4775905670036792 Energy: 0.46152274503433166 Energy: 0.47759056700420616 Energy: 0.4615227450348586 Energy: 0.4775905670026255 Energy: 0.5698527628881904 Energy: 0.4683647213735915 Energy: 0.5698527628887174 Energy: 0.46836472137464524 Energy: 0.5698527628881904 Energy: 0.46836472137464524 Energy: 0.5295558771719632 Energy: 0.41309213534648465 Energy: 0.5295558771719632 Energy: 0.41309213534753847 Energy: 0.5295558771719632 Energy: 0.4130921353470116 Energy: 0.46334076315008427 Energy: 0.4826328462957818 Energy: 0.46334076315008427 Energy: 0.4826328462957818 Energy: 0.46334076315008427 Energy: 0.4826328462957818 Energy: 0.5417442942821575 Energy: 0.4853216970834378 Energy: 0.5417442942816307 Energy: 0.4853216970834378 Energy: 0.5417442942826846 Energy: 0.4853216970834378 Energy: 0.5261836259785623 Energy: 0.5307975369338209 Energy: 0.5261836259785623 Energy: 0.5307975369343478 Energy: 0.5261836259785623 Energy: 0.5307975369338209 Energy: 0.46298480547219933 Energy: 0.48148809193636105 Energy: 0.46298480547219933 Energy: 0.48148809193583414 Energy: 0.46298480547219933 Energy: 0.48148809193583414 Energy: 0.4805616717609621 Energy: 0.46799096936567175 Energy: 0.4805616717604351 Energy: 0.46799096936567175 Energy: 0.4805616717609621 Energy: 0.46799096936567175 Energy: 0.5391195878488771 Energy: 0.5327848330316203 Energy: 0.539119587849404 Energy: 0.5327848330321471 Energy: 0.5391195878488771 Energy: 0.5327848330321471 Energy: 0.44542448923304145 Energy: 0.5369721266311449 Energy: 0.44542448923304145 Energy: 0.5369721266306179 Energy: 0.4454244892325146 Energy: 0.5369721266306179 Energy: 0.48862668800997805 Energy: 0.48487082258667175 Energy: 0.48862668800997805 Energy: 0.48487082258667175 Energy: 0.48862668800997805 Energy: 0.4848708225871986 Energy: 0.4810349329476437 Energy: 0.4887530107860635 Energy: 0.4810349329481706 Energy: 0.4887530107860635 Energy: 0.4810349329486497 Energy: 0.48875301078500977 Energy: 0.45973723376313114 Energy: 0.5800700868782855 Energy: 0.4597372337620774 Energy: 0.5800700868782855 Energy: 0.4597372337626043 Energy: 0.5800700868782855 Energy: 0.46844794154540453 Energy: 0.48174868592529335 Energy: 0.46844794154540453 Energy: 0.48174868592529335 Energy: 0.4684479415448776 Energy: 0.48174868592529335 Energy: 0.46663168604881694 Energy: 0.46794139941589397 Energy: 0.46663168604934385 Energy: 0.46794139941589397 Energy: 0.4666316860482901 Energy: 0.46794139941589397 Energy: 0.509039432060901 Energy: 0.5754784734094567 Energy: 0.509039432060901 Energy: 0.5754784734094567 Energy: 0.5090394320614279 Energy: 0.5754784734094567 Energy: 0.4477522245631287 Energy: 0.4963612612368932 Energy: 0.44775222456418245 Energy: 0.4963612612368932 Energy: 0.4477522245636556 Energy: 0.4963612612368932 Energy: 0.4621740931921114 Energy: 0.4619758761516955 Energy: 0.4621740931921114 Energy: 0.4619758761516955 Energy: 0.4621740931921114 Energy: 0.4619758761511687 Energy: 0.5039237484384194 Energy: 0.5387393087791773 Energy: 0.5039237484378926 Energy: 0.5387393087786504 Energy: 0.5039237484384194 Energy: 0.5387393087786504 Energy: 0.4457778771105294 Energy: 0.5472676079086879 Energy: 0.4457778771105294 Energy: 0.5472676079092147 Energy: 0.4457778771105294 Energy: 0.5472676079086879 Energy: 0.42813936154844145 Energy: 0.4459346645349053 Energy: 0.4281393615494952 Energy: 0.4459346645349053 Energy: 0.4281393615479145 Energy: 0.4459346645349053 Energy: 0.47799928540337294 Energy: 0.5877278305570034 Energy: 0.47799928540337294 Energy: 0.5877278305570034 Energy: 0.4779992854028461 Energy: 0.5877278305570034 Energy: 0.49995870814526916 Energy: 0.51796079689138 Energy: 0.499958708145796 Energy: 0.5179607968919069 Energy: 0.499958708145796 Energy: 0.5179607968919069 Energy: 0.4208612522490011 Energy: 0.4432481535695487 Energy: 0.4208612522490011 Energy: 0.44324815356902175 Energy: 0.4208612522490011 Energy: 0.4432481535695487 Energy: 0.4443169104075582 Energy: 0.4931965478345527 Energy: 0.44431691040808513 Energy: 0.4931965478345527 Energy: 0.44431691040808513 Energy: 0.4931965478345527 minimum gb energy = 0.41309213534648465 eV minimum distance = 2.54421113586995 Angstroms sigma value = 43 ======================================== theta = 102.11511746203723 ======================================== Energy: 0.5730048459847452 Energy: 0.38163118656107015 Energy: 0.5730048459851291 Energy: 0.38163118656107015 Energy: 0.5730048459843613 Energy: 0.38163118656107015 Energy: 0.4244808498030449 Energy: 0.43123382367538027 Energy: 0.4244808498026611 Energy: 0.43123382367538027 Energy: 0.4244808498030449 Energy: 0.4312338236757642 Energy: 0.42133670712833166 Energy: 0.432026753495262 Energy: 0.42133670712833166 Energy: 0.43202675349564584 Energy: 0.42133670712833166 Energy: 0.432026753495262 Energy: 0.5358521992694156 Energy: 0.410648283301634 Energy: 0.5358521992697995 Energy: 0.41064828330125014 Energy: 0.5358521992697995 Energy: 0.41064828330125014 Energy: 0.4614437963754111 Energy: 0.41949635410153374 Energy: 0.461443796375795 Energy: 0.41949635410153374 Energy: 0.4614437963754111 Energy: 0.41949635410153374 Energy: 0.404705920391712 Energy: 0.41996062723693833 Energy: 0.4047059203920959 Energy: 0.41996062723732225 Energy: 0.4047059203920959 Energy: 0.41996062723693833 Energy: 0.5089129449734809 Energy: 0.43415473314919556 Energy: 0.5089129449734809 Energy: 0.4341547331495795 Energy: 0.5089129449734809 Energy: 0.4341547331495795 Energy: 0.4965112452389449 Energy: 0.4607031417127704 Energy: 0.4965112452389449 Energy: 0.4607031417127704 Energy: 0.4965112452389449 Energy: 0.46070314171315424 Energy: 0.38935037380588855 Energy: 0.4187551863625183 Energy: 0.38935037380627235 Energy: 0.4187551863625183 Energy: 0.38935037380627235 Energy: 0.4187551863625183 Energy: 0.5019942874335055 Energy: 0.4027363113633743 Energy: 0.5019942874331217 Energy: 0.4027363113633743 Energy: 0.5019942874335055 Energy: 0.4027363113633743 Energy: 0.46301454305544787 Energy: 0.4537713208161634 Energy: 0.46301454305583184 Energy: 0.4537713208161634 Energy: 0.46301454305544787 Energy: 0.4537713208161634 Energy: 0.39258611208528094 Energy: 0.41788312577034625 Energy: 0.392586112084897 Energy: 0.41788312577073017 Energy: 0.392586112084897 Energy: 0.41788312577034625 Energy: 0.4206817221293492 Energy: 0.3917395667350277 Energy: 0.42068172212896526 Energy: 0.3917395667350277 Energy: 0.4206817221293492 Energy: 0.3917395667350277 Energy: 0.472210067354553 Energy: 0.47766709249523437 Energy: 0.472210067354937 Energy: 0.47766709249523437 Energy: 0.472210067354937 Energy: 0.47766709249523437 Energy: 0.4215463617970708 Energy: 0.49001055212437644 Energy: 0.42154636179745475 Energy: 0.4900105521247604 Energy: 0.42154636179745475 Energy: 0.49001055212437644 Energy: 0.42772847119602403 Energy: 0.4011057813860277 Energy: 0.427728471196408 Energy: 0.4011057813860277 Energy: 0.42772847119564017 Energy: 0.4011057813860277 Energy: 0.4696374093903944 Energy: 0.4765243671533374 Energy: 0.4696374093903944 Energy: 0.4765243671537212 Energy: 0.4696374093907783 Energy: 0.4765243671537212 Energy: 0.38989991997239276 Energy: 0.5000217792634708 Energy: 0.3898999199720088 Energy: 0.5000217792634708 Energy: 0.38989991997239276 Energy: 0.5000217792634708 Energy: 0.416307591237171 Energy: 0.4252832296114429 Energy: 0.416307591237171 Energy: 0.42528322961182674 Energy: 0.416307591237171 Energy: 0.42528322961182674 Energy: 0.4804401101571523 Energy: 0.46931743416439553 Energy: 0.48044011015676846 Energy: 0.46931743416477933 Energy: 0.48044011015676846 Energy: 0.46931743416439553 Energy: 0.4054040928226557 Energy: 0.5246478003587663 Energy: 0.4054040928234235 Energy: 0.5246478003591503 Energy: 0.40540409282303963 Energy: 0.5246478003587663 Energy: 0.4356466679184485 Energy: 0.4263828065081297 Energy: 0.4356466679184485 Energy: 0.4263828065077458 Energy: 0.4356466679184485 Energy: 0.4263828065077458 Energy: 0.43311258226130905 Energy: 0.41455867965756904 Energy: 0.4331125822609251 Energy: 0.41455867965795284 Energy: 0.43311258226130905 Energy: 0.4145586796571851 Energy: 0.4408644389432511 Energy: 0.5659000445896748 Energy: 0.4408644389428673 Energy: 0.5659000445896748 Energy: 0.4408644389432511 Energy: 0.5659000445896748 Energy: 0.42128228378777455 Energy: 0.433043611844784 Energy: 0.42128228378777455 Energy: 0.433043611844784 Energy: 0.42128228378777455 Energy: 0.4330436118444002 Energy: 0.41933846603923525 Energy: 0.4084715144619305 Energy: 0.41933846603885133 Energy: 0.4084715144615466 Energy: 0.41933846603885133 Energy: 0.4084715144619305 Energy: 0.4053724887970708 Energy: 0.5305598539380711 Energy: 0.4053724887970708 Energy: 0.5305598539380711 Energy: 0.4015877653718493 Energy: 0.5305598539380711 Energy: 0.37029722006516125 Energy: 0.4622495435116348 Energy: 0.37029722006477744 Energy: 0.46224954351201863 Energy: 0.37029722006516125 Energy: 0.46224954351201863 Energy: 0.41352707104001296 Energy: 0.38691886335975456 Energy: 0.41352707104078074 Energy: 0.38691886335975456 Energy: 0.41352707104001296 Energy: 0.38691886335975456 Energy: 0.40083212638501614 Energy: 0.5021080054555258 Energy: 0.40083212638540006 Energy: 0.5021080054555258 Energy: 0.40083212638501614 Energy: 0.5021080054555258 Energy: 0.37455360570865653 Energy: 0.5002710248492382 Energy: 0.37455360570865653 Energy: 0.5002710248488544 Energy: 0.4126116146013044 Energy: 0.5002710248488544 Energy: 0.4166577605001403 Energy: 0.37510130595949664 Energy: 0.4166577605005243 Energy: 0.37510130595949664 Energy: 0.4166577605005243 Energy: 0.37510130595949664 Energy: 0.38995590088594334 Energy: 0.4995472261383938 Energy: 0.38995590088594334 Energy: 0.4995472261383938 Energy: 0.3899559008855594 Energy: 0.4995472261383938 Energy: 0.4573085604911367 Energy: 0.5106578732094438 Energy: 0.4573085604911367 Energy: 0.5106578732094438 Energy: 0.4573085604911367 Energy: 0.5106578732094438 Energy: 0.42342541549605883 Energy: 0.40802409197669676 Energy: 0.42342541549605883 Energy: 0.40802409197669676 Energy: 0.42342541549605883 Energy: 0.40802409197669676 Energy: 0.3661634131728586 Energy: 0.4499882235998019 Energy: 0.3661634131728586 Energy: 0.4499882235998019 Energy: 0.3661634131728586 Energy: 0.44998822359941804 minimum gb energy = 0.3661634131728586 eV minimum distance = 2.42154244099242 Angstroms sigma value = 81 ======================================== theta = 109.47122063449069 ======================================== Energy: 0.08457891021060773 Energy: 0.10610237205786488 Energy: 0.08457891021046347 Energy: 0.10610237205773666 Energy: 0.08457891021060773 Energy: 0.10610237205786488 Energy: 0.3447100210351854 Energy: 0.08579899868751123 Energy: 0.3447100210351854 Energy: 0.08579899867581049 Energy: 0.3447100210350411 Energy: 0.08579899867355047 Energy: 0.3447268219084678 Energy: 0.08512383145058659 Energy: 0.3447268219086121 Energy: 0.0851238314466436 Energy: 0.3447268219087563 Energy: 0.08512383145045836 Energy: 0.08457891021060773 Energy: 0.10610237205800915 Energy: 0.08457891021046347 Energy: 0.10610237205786488 Energy: 0.08457891021046347 Energy: 0.10610237205773666 Energy: 0.3447100210351854 Energy: 0.08579899868807223 Energy: 0.3447100210351854 Energy: 0.08579899857289193 Energy: 0.3447100210350411 Energy: 0.08579899862857471 Energy: 0.3447268219086121 Energy: 0.08512383150514737 Energy: 0.3447268219084678 Energy: 0.08512383150120438 Energy: 0.3447268219086121 Energy: 0.08512383150699064 Energy: 0.08457891021046347 Energy: 0.10610237205773666 Energy: 0.08457891021046347 Energy: 0.10610237205786488 Energy: 0.08457891021046347 Energy: 0.1061023720575924 Energy: 0.3447100210351854 Energy: 0.08579899861857296 Energy: 0.3447100210351854 Energy: 0.08579899861674573 Energy: 0.34471002103532966 Energy: 0.0857989986102542 Energy: 0.3447268219086121 Energy: 0.08512383150655788 Energy: 0.3447268219086121 Energy: 0.08512383151545365 Energy: 0.3447268219083236 Energy: 0.08512383151022838 Energy: 0.08457891021060773 Energy: 0.10610237205773666 Energy: 0.08457891021060773 Energy: 0.10610237205800915 Energy: 0.08457891021060773 Energy: 0.10610237205773666 minimum gb energy = 0.08457891021046347 eV minimum distance = 2.83450849735823 Angstroms sigma value = 3 ======================================== theta = 117.56060310526324 ======================================== Energy: 0.43997199511854307 Energy: 0.4465744095685877 Energy: 0.43997199511854307 Energy: 0.4465744095685877 Energy: 0.43997199511854307 Energy: 0.4465744095685877 Energy: 0.3982031829909694 Energy: 0.4169016297994969 Energy: 0.3982031829905473 Energy: 0.4169016297990747 Energy: 0.3982031829905473 Energy: 0.4169016297994969 Energy: 0.4632803242456127 Energy: 0.41788677505496 Energy: 0.4632803242456127 Energy: 0.41788677505496 Energy: 0.4632803242456127 Energy: 0.41788677505496 Energy: 0.46182391993749133 Energy: 0.41033556482891714 Energy: 0.46182391993749133 Energy: 0.41033556482891714 Energy: 0.46182391993749133 Energy: 0.41033556482891714 Energy: 0.4084786994115295 Energy: 0.4385476041078631 Energy: 0.40847869941110737 Energy: 0.4385476041078631 Energy: 0.4084786994115295 Energy: 0.4385476041078631 Energy: 0.4055939065550053 Energy: 0.41408516824478436 Energy: 0.4055939065554274 Energy: 0.41408516824478436 Energy: 0.4055939065550053 Energy: 0.41408516824478436 Energy: 0.4403423340410627 Energy: 0.425499606240298 Energy: 0.4403423340406598 Energy: 0.425499606240298 Energy: 0.4403423340406598 Energy: 0.425499606240298 Energy: 0.41757846333070797 Energy: 0.4217012296449932 Energy: 0.41757846333070797 Energy: 0.4217012296449932 Energy: 0.41757846333070797 Energy: 0.4217012296454153 Energy: 0.4083340310406565 Energy: 0.4007738488175505 Energy: 0.4083340310410786 Energy: 0.4007738488179726 Energy: 0.4083340310410786 Energy: 0.4007738488179726 Energy: 0.4126931057848621 Energy: 0.4013091491145119 Energy: 0.4126931057848621 Energy: 0.4013091491140898 Energy: 0.4126931057848621 Energy: 0.4013091491145119 Energy: 0.4130547596415065 Energy: 0.4292827319164179 Energy: 0.4130547596415065 Energy: 0.42928273191684 Energy: 0.4130547596415065 Energy: 0.42928273191684 Energy: 0.4279966450301659 Energy: 0.4178981577241638 Energy: 0.4279966450301659 Energy: 0.4178981577241638 Energy: 0.4279966450297437 Energy: 0.4178981577241638 Energy: 0.42228129901385014 Energy: 0.3926635418843373 Energy: 0.42228129901385014 Energy: 0.3926635418843373 Energy: 0.42228129901385014 Energy: 0.3926635418847594 Energy: 0.4132928099238747 Energy: 0.4028652198939648 Energy: 0.4132928099234526 Energy: 0.4028652198939648 Energy: 0.4132928099238747 Energy: 0.4028652198939648 Energy: 0.4109838347318581 Energy: 0.4141377814696475 Energy: 0.41098383473143607 Energy: 0.4141377814696475 Energy: 0.41098383473143607 Energy: 0.4141377814696475 Energy: 0.43734144317268886 Energy: 0.41668127562015017 Energy: 0.43734144317268886 Energy: 0.41668127562015017 Energy: 0.43734144317268886 Energy: 0.41668127562015017 Energy: 0.41899573034220267 Energy: 0.40822764189638683 Energy: 0.41899573034178056 Energy: 0.40822764189596467 Energy: 0.41899573034178056 Energy: 0.40822764189638683 Energy: 0.41636400328258977 Energy: 0.40878140149710257 Energy: 0.41636400328258977 Energy: 0.40878140149710257 Energy: 0.41636400328258977 Energy: 0.40878140149710257 Energy: 0.4166137156031046 Energy: 0.412078576151925 Energy: 0.41661371560268246 Energy: 0.412078576151925 Energy: 0.41661371560268246 Energy: 0.412078576151925 Energy: 0.4279595698350473 Energy: 0.4236826468397975 Energy: 0.4279595698350473 Energy: 0.4236826468397975 Energy: 0.4279595698350473 Energy: 0.4236826468397975 Energy: 0.4036060213064538 Energy: 0.3944333099150703 Energy: 0.4036060213064538 Energy: 0.3944333099150703 Energy: 0.4036060213064538 Energy: 0.3944333099150703 Energy: 0.43323855062731564 Energy: 0.4025357466459094 Energy: 0.4332385506277378 Energy: 0.4025357466459094 Energy: 0.4332385506277378 Energy: 0.4025357466459094 Energy: 0.41046336928737526 Energy: 0.42809025384069094 Energy: 0.41046336928737526 Energy: 0.4280902538402689 Energy: 0.41046336928737526 Energy: 0.4280902538402689 Energy: 0.40733717287453935 Energy: 0.40538235135342693 Energy: 0.4073371728749614 Energy: 0.40538235135342693 Energy: 0.40733717287453935 Energy: 0.40538235135342693 Energy: 0.4021483274718054 Energy: 0.4195656801722621 Energy: 0.4021483274718054 Energy: 0.4195656801722621 Energy: 0.4021483274718054 Energy: 0.4195656801722621 Energy: 0.3960293477165397 Energy: 0.40349328745119684 Energy: 0.3960293477161176 Energy: 0.40349328745161894 Energy: 0.3960293477161176 Energy: 0.40349328745119684 Energy: 0.4751235313641679 Energy: 0.3881440551418793 Energy: 0.4751235313641679 Energy: 0.3881440551414572 Energy: 0.4751235313641679 Energy: 0.3881440551418793 Energy: 0.39597344408607354 Energy: 0.40955459600844263 Energy: 0.39597344408565155 Energy: 0.40955459600844263 Energy: 0.39597344408607354 Energy: 0.40955459600844263 Energy: 0.37890390459169176 Energy: 0.4217351075494123 Energy: 0.37890390459169176 Energy: 0.4217351075494123 Energy: 0.37890390459169176 Energy: 0.4217351075494123 Energy: 0.49355641484882523 Energy: 0.39923275768883465 Energy: 0.49355641484882523 Energy: 0.39923275768925676 Energy: 0.49355641484882523 Energy: 0.39923275768925676 Energy: 0.429197323862203 Energy: 0.4223586386565124 Energy: 0.429197323862203 Energy: 0.4223586386565124 Energy: 0.429197323862203 Energy: 0.42235863865693457 Energy: 0.3993935026565863 Energy: 0.43130053182870653 Energy: 0.3993935026565863 Energy: 0.43130053182870653 Energy: 0.3993935026565863 Energy: 0.43130053182870653 Energy: 0.403862728635223 Energy: 0.4050616901225301 Energy: 0.403862728635223 Energy: 0.405061690122108 Energy: 0.403862728635223 Energy: 0.405061690122108 minimum gb energy = 0.37890390459169176 eV minimum distance = 2.6461300701723 Angstroms sigma value = 67 ======================================== theta = 121.00758300686714 ======================================== Energy: 0.47998769969782995 Energy: 0.5079787701473162 Energy: 0.47998769969782995 Energy: 0.5079787701479177 Energy: 0.47998769969782995 Energy: 0.5079787701473162 Energy: 0.4612956874727646 Energy: 0.47972863561241713 Energy: 0.461295687473366 Energy: 0.4797286356118156 Energy: 0.461295687473366 Energy: 0.4797286356118156 Energy: 0.5398769941293392 Energy: 0.4796622632081159 Energy: 0.5535042851692016 Energy: 0.4796622632081159 Energy: 0.5535042851679987 Energy: 0.4796622632081159 Energy: 0.4771632653870625 Energy: 0.4716664213566735 Energy: 0.4771632653870625 Energy: 0.471666421357275 Energy: 0.4771632653870625 Energy: 0.471666421357275 Energy: 0.44777968032695387 Energy: 0.5071285087570079 Energy: 0.44777968032695387 Energy: 0.5071285087570079 Energy: 0.44777968032695387 Energy: 0.5071285087576092 Energy: 0.4994120282047184 Energy: 0.48212053217278866 Energy: 0.499412028204117 Energy: 0.48212053217278866 Energy: 0.499412028204117 Energy: 0.48212053217278866 Energy: 0.5274486870711077 Energy: 0.49558987352166384 Energy: 0.5274486870711077 Energy: 0.4955898735222653 Energy: 0.5274486870711077 Energy: 0.4955898735222653 Energy: 0.47396998304398197 Energy: 0.5059326062320559 Energy: 0.47396998304398197 Energy: 0.5059326062320559 Energy: 0.47396998304398197 Energy: 0.5059326062320559 Energy: 0.49917068365653466 Energy: 0.5256116097427054 Energy: 0.499170683657136 Energy: 0.5256116097427054 Energy: 0.49917068365653466 Energy: 0.5256116097427054 Energy: 0.4920414383310209 Energy: 0.49273426966203626 Energy: 0.4920414383310209 Energy: 0.49273426966203626 Energy: 0.4920414383304195 Energy: 0.49273426966203626 Energy: 0.48218994629610634 Energy: 0.477573491383109 Energy: 0.48218994629610634 Energy: 0.4775734913837104 Energy: 0.4821899462955048 Energy: 0.4775734913837104 Energy: 0.47230278673454906 Energy: 0.4802978316036442 Energy: 0.47230278673454906 Energy: 0.4802978316036442 Energy: 0.47230278673454906 Energy: 0.4802978316036442 Energy: 0.4725376184599303 Energy: 0.4853063512083513 Energy: 0.4725376184599303 Energy: 0.4853063512083513 Energy: 0.4725376184599303 Energy: 0.4853063512083513 Energy: 0.4970298353941976 Energy: 0.5142200225282916 Energy: 0.4970298353941976 Energy: 0.5142200225282916 Energy: 0.4970298353941976 Energy: 0.5142200225282916 Energy: 0.4601092597302907 Energy: 0.46496319193685204 Energy: 0.46010925972968925 Energy: 0.46496319193685204 Energy: 0.4601092597302907 Energy: 0.46496319193685204 Energy: 0.48554894857657016 Energy: 0.4893470927883173 Energy: 0.48554894857657016 Energy: 0.4893470927883173 Energy: 0.4855489485771716 Energy: 0.4893470927883173 Energy: 0.4657689467819807 Energy: 0.5143726684629244 Energy: 0.4657689467819807 Energy: 0.5143726684623229 Energy: 0.4657689467819807 Energy: 0.5143726684629244 Energy: 0.49896224563021113 Energy: 0.45090081823713707 Energy: 0.49896224563021113 Energy: 0.45090081823713707 Energy: 0.49896224563021113 Energy: 0.45090081823773853 Energy: 0.5109499971094902 Energy: 0.4939835382061451 Energy: 0.5109499971094902 Energy: 0.4939835382055437 Energy: 0.5109499971094902 Energy: 0.4939835382055437 Energy: 0.5040816123425237 Energy: 0.501592243031747 Energy: 0.5040816123431251 Energy: 0.501592243031747 Energy: 0.5040816123425237 Energy: 0.501592243031747 Energy: 0.4977949834123122 Energy: 0.4518713871078733 Energy: 0.4977949834128863 Energy: 0.4518713871078733 Energy: 0.4977949834123122 Energy: 0.4518713871078733 Energy: 0.4775521144741203 Energy: 0.5140279170113183 Energy: 0.4775521144741203 Energy: 0.5140279170113183 Energy: 0.4775521144741203 Energy: 0.5140279170113183 Energy: 0.48387692625256146 Energy: 0.500695380263952 Energy: 0.48387692625256146 Energy: 0.500695380263952 Energy: 0.48387692625256146 Energy: 0.500695380263952 minimum gb energy = 0.44777968032695387 eV minimum distance = 2.57070530579354 Angstroms sigma value = 33 ======================================== theta = 124.1232945407953 ======================================== Energy: 0.5144762023892439 Energy: 0.5341153470174335 Energy: 0.5144762023896253 Energy: 0.5341153470170519 Energy: 0.5144762023896253 Energy: 0.5341153470170519 Energy: 0.5256042058915148 Energy: 0.5139111798287538 Energy: 0.5256042058915148 Energy: 0.5139111798287538 Energy: 0.5256042058915148 Energy: 0.5139111798287538 Energy: 0.5266861921688943 Energy: 0.5139800764753664 Energy: 0.5266861921688943 Energy: 0.5139800764749849 Energy: 0.5266861921688943 Energy: 0.5139800764753664 Energy: 0.5065733254410358 Energy: 0.49945072317156364 Energy: 0.5065733254414173 Energy: 0.49945072317156364 Energy: 0.5065733254414173 Energy: 0.49945072317194517 Energy: 0.4968354291598974 Energy: 0.5658050421504403 Energy: 0.496835429160279 Energy: 0.5658050421504403 Energy: 0.496835429160279 Energy: 0.5658050421504403 Energy: 0.5587021039845212 Energy: 0.5549932203985872 Energy: 0.5587021039845212 Energy: 0.5549932203985872 Energy: 0.5587021039845212 Energy: 0.5549932203982056 Energy: 0.549315935365107 Energy: 0.5580925943770704 Energy: 0.5493159353647254 Energy: 0.558092594376689 Energy: 0.549315935365107 Energy: 0.5580925943770704 Energy: 0.5173448891990268 Energy: 0.5061036493795802 Energy: 0.5173448891994082 Energy: 0.5061036493799618 Energy: 0.5173448891990268 Energy: 0.5061036493799618 Energy: 0.5111468157200078 Energy: 0.5210382806925172 Energy: 0.5111468157200078 Energy: 0.5210382806925172 Energy: 0.5111468157200078 Energy: 0.5210382806925172 Energy: 0.5565889882150306 Energy: 0.5020286463041692 Energy: 0.556588988214649 Energy: 0.5245583087487719 Energy: 0.556588988214649 Energy: 0.5238980504681694 Energy: 0.541033480623074 Energy: 0.5480698845849797 Energy: 0.541033480623074 Energy: 0.5480698845845983 Energy: 0.541033480623074 Energy: 0.5480698845845983 Energy: 0.49475773075295687 Energy: 0.4983559161331981 Energy: 0.49475773075295687 Energy: 0.49835591613357966 Energy: 0.49475773075295687 Energy: 0.49835591613357966 Energy: 0.5327678883883435 Energy: 0.5178151843983266 Energy: 0.5327678883883435 Energy: 0.5178151843983266 Energy: 0.5327678883883435 Energy: 0.5178151843983266 Energy: 0.5274705134693252 Energy: 0.49354117119912216 Energy: 0.5274705134693252 Energy: 0.4935411711987407 Energy: 0.5274705134697067 Energy: 0.49354117119912216 Energy: 0.5094078715162488 Energy: 0.5164598379581291 Energy: 0.5094078715162488 Energy: 0.5164598379581291 Energy: 0.5094078715162488 Energy: 0.5164598379585107 Energy: 0.5383718844250069 Energy: 0.5298564853271164 Energy: 0.5383718844253884 Energy: 0.5298564853267349 Energy: 0.5383718844250069 Energy: 0.5298564853271164 Energy: 0.5254241582098433 Energy: 0.5350952730861362 Energy: 0.5254241582102249 Energy: 0.5350952730861362 Energy: 0.5254241582106064 Energy: 0.5350952730865178 Energy: 0.5439327212384143 Energy: 0.5509012313027093 Energy: 0.5439327212376512 Energy: 0.5509012313030907 Energy: 0.5439327212380328 Energy: 0.5509012313027093 Energy: 0.5147052341636271 Energy: 0.5258094427478534 Energy: 0.5147052341632455 Energy: 0.5258094427478534 Energy: 0.514705234162864 Energy: 0.5258094427478534 Energy: 0.5591735091682254 Energy: 0.5139839414275974 Energy: 0.5591735091682254 Energy: 0.5139839414275974 Energy: 0.5591735091682254 Energy: 0.5139839414275974 Energy: 0.536894893107651 Energy: 0.5291050588479974 Energy: 0.536894893107651 Energy: 0.5291050588476158 Energy: 0.536894893107651 Energy: 0.5291050588476158 Energy: 0.5080366138310481 Energy: 0.4874614417945532 Energy: 0.5080366138318112 Energy: 0.48746144179417156 Energy: 0.5080366138314296 Energy: 0.48746144179417156 Energy: 0.5019545820593011 Energy: 0.5478515511706997 Energy: 0.5019545820589195 Energy: 0.5478515511703181 Energy: 0.5019545820589195 Energy: 0.5478515511703181 Energy: 0.5304786460812909 Energy: 0.5240112054064902 Energy: 0.5304786460816724 Energy: 0.5240112054064902 Energy: 0.5304786460812909 Energy: 0.5240112054064902 Energy: 0.5136882438700301 Energy: 0.5293355171353283 Energy: 0.5136882438700301 Energy: 0.5293355171353283 Energy: 0.5136882438700301 Energy: 0.5293355171353283 Energy: 0.4983503496807999 Energy: 0.597457306081622 Energy: 0.4983503496807999 Energy: 0.597457306081622 Energy: 0.4983503496807999 Energy: 0.597457306081622 Energy: 0.549146828950358 Energy: 0.4885532313448965 Energy: 0.5491468289499765 Energy: 0.4885532313448965 Energy: 0.549146828949595 Energy: 0.4885532313448965 Energy: 0.5371289989255621 Energy: 0.5560557513365985 Energy: 0.5371289989255621 Energy: 0.5560557513365985 Energy: 0.5371289989251806 Energy: 0.5560557513365985 Energy: 0.5164697276255951 Energy: 0.5660350594772408 Energy: 0.5164697276252135 Energy: 0.5660350594776223 Energy: 0.5164697276255951 Energy: 0.5660350594772408 Energy: 0.5275357078386215 Energy: 0.50779242579834 Energy: 0.5275357078386215 Energy: 0.5077924257979587 Energy: 0.5275357078386215 Energy: 0.5077924257979587 Energy: 0.5592927050863622 Energy: 0.5517790174981838 Energy: 0.5592927050863622 Energy: 0.5517790174978022 Energy: 0.5592927050863622 Energy: 0.5517790174981838 Energy: 0.4981461763605644 Energy: 0.5135709738746258 Energy: 0.498146176360946 Energy: 0.5135709738750074 Energy: 0.4981461763605644 Energy: 0.5135709738746258 Energy: 0.5052237382705604 Energy: 0.5116338678646163 Energy: 0.5052237382705604 Energy: 0.5116338678649979 Energy: 0.5052237382705604 Energy: 0.5116338678646163 Energy: 0.5080027763232876 Energy: 0.5136463049665752 Energy: 0.5080027763236691 Energy: 0.5136463049665752 Energy: 0.5080027763236691 Energy: 0.5136463049665752 Energy: 0.5275739325319295 Energy: 0.5139104074351573 Energy: 0.5275739325319295 Energy: 0.5139104074351573 Energy: 0.5275739325315479 Energy: 0.5139104074351573 Energy: 0.559187028883357 Energy: 0.5186525555729906 Energy: 0.5591870288829756 Energy: 0.5186525555729906 Energy: 0.5591870288829756 Energy: 0.5186525555729906 Energy: 0.49319559504476945 Energy: 0.5018148421106969 Energy: 0.49319559504476945 Energy: 0.5018148421106969 Energy: 0.49319559504476945 Energy: 0.5018148421103155 minimum gb energy = 0.48746144179417156 eV minimum distance = 2.60919056477736 Angstroms sigma value = 41 ======================================== theta = 129.5211963586422 ======================================== Energy: 0.546381741127357 Energy: 0.5640401259086137 Energy: 0.546381741127357 Energy: 0.5640401259086137 Energy: 0.5463817411263152 Energy: 0.5640401259086137 Energy: 0.5539279627855751 Energy: 0.5605870419722038 Energy: 0.5539279627855751 Energy: 0.5605870419722038 Energy: 0.5539279627855751 Energy: 0.5605870419722038 Energy: 0.6351783042470766 Energy: 0.5580678625659281 Energy: 0.6656638802782194 Energy: 0.5580678625659281 Energy: 0.6017031615649867 Energy: 0.5580678625659281 Energy: 0.6150629850391339 Energy: 0.6429667160476287 Energy: 0.6150629850380922 Energy: 0.6429667160476287 Energy: 0.6150629850391339 Energy: 0.6429667160476287 Energy: 0.6253331411601425 Energy: 0.604882512272343 Energy: 0.6253331411601425 Energy: 0.604882512272343 Energy: 0.6253331411601425 Energy: 0.604882512272343 Energy: 0.5956966386845068 Energy: 0.5948244861961356 Energy: 0.5956966386845068 Energy: 0.5948244861961356 Energy: 0.5956966386845068 Energy: 0.5948244861961356 Energy: 0.6056592526669408 Energy: 0.5358554654881221 Energy: 0.6056592526679824 Energy: 0.5358554654881221 Energy: 0.6056592526679824 Energy: 0.5358554654881221 Energy: 0.5585332111973398 Energy: 0.5808212923456 Energy: 0.5585332111973398 Energy: 0.5808212923456 Energy: 0.5585332111973398 Energy: 0.5808212923456 Energy: 0.5546061354254668 Energy: 0.5725759733348805 Energy: 0.5546061354254668 Energy: 0.5725759733348805 Energy: 0.5546061354254668 Energy: 0.5725759733348805 Energy: 0.5853141882147921 Energy: 0.5713901089564317 Energy: 0.5853141882147921 Energy: 0.5713901089564317 Energy: 0.5853141882147921 Energy: 0.5713901089564317 Energy: 0.5560652502526447 Energy: 0.5591325863331021 Energy: 0.5560652502526447 Energy: 0.5591325863331021 Energy: 0.5560652502526447 Energy: 0.5591325863331021 Energy: 0.5767321702138977 Energy: 0.5606145521786974 Energy: 0.5767321702138977 Energy: 0.5606145521786974 Energy: 0.5767321702138977 Energy: 0.5606145521786974 Energy: 0.5902322574926182 Energy: 0.555258356559655 Energy: 0.5902322574926182 Energy: 0.555258356559655 Energy: 0.5902322574926182 Energy: 0.555258356559655 Energy: 0.6057555301307447 Energy: 0.6050762163455655 Energy: 0.6057555301307447 Energy: 0.6050762163455655 Energy: 0.6057555301307447 Energy: 0.6050762163455655 minimum gb energy = 0.5358554654881221 eV minimum distance = 2.46353175909723 Angstroms sigma value = 11 ======================================== theta = 135.99657265110037 ======================================== Energy: 0.6123233369562213 Energy: 0.6159996441404805 Energy: 0.6123233369566791 Energy: 0.6159996441404805 Energy: 0.6123233369562213 Energy: 0.6159996441404805 Energy: 0.6120117932231435 Energy: 0.6142235448178447 Energy: 0.6120117932231435 Energy: 0.6142235448178447 Energy: 0.6120117932231435 Energy: 0.6142235448178447 Energy: 0.6404449964003834 Energy: 0.5847479457592296 Energy: 0.6404449964003834 Energy: 0.5847479457592296 Energy: 0.6378551553545857 Energy: 0.5847479457592296 Energy: 0.58688135563017 Energy: 0.5644953807692342 Energy: 0.58688135563017 Energy: 0.5644953807692342 Energy: 0.58688135563017 Energy: 0.5644953807692342 Energy: 0.620045764734885 Energy: 0.5841484635901428 Energy: 0.620045764734885 Energy: 0.5841484635901428 Energy: 0.620045764734885 Energy: 0.5841484635901428 Energy: 0.5672472717469795 Energy: 0.5990072629145052 Energy: 0.5672472717469795 Energy: 0.5990072629145052 Energy: 0.5672472717469795 Energy: 0.5990072629145052 Energy: 0.5825585372331706 Energy: 0.5790581256389827 Energy: 0.5825585372336283 Energy: 0.5790581256389827 Energy: 0.5825585372336283 Energy: 0.5790581256394405 Energy: 0.573155063236497 Energy: 0.5821167551404963 Energy: 0.573155063236497 Energy: 0.5821167551400387 Energy: 0.573155063236497 Energy: 0.5821167551400387 Energy: 0.5791761315368629 Energy: 0.5922925658561312 Energy: 0.5791761315368629 Energy: 0.5922925658561312 Energy: 0.5791761315364051 Energy: 0.5922925658556736 Energy: 0.5779712397054654 Energy: 0.5851591932856162 Energy: 0.5779712397054654 Energy: 0.5851591932856162 Energy: 0.5779712397054654 Energy: 0.5851591932856162 Energy: 0.5949352822852286 Energy: 0.6142439461743107 Energy: 0.5949352822856863 Energy: 0.6142439461743107 Energy: 0.5949352822852286 Energy: 0.6142439461743107 Energy: 0.5949858972330372 Energy: 0.6034332118246414 Energy: 0.5949858972330372 Energy: 0.6034332118246414 Energy: 0.5949858972330372 Energy: 0.6034332118246414 Energy: 0.5871031775692557 Energy: 0.5753843018108055 Energy: 0.5871031775692557 Energy: 0.5753843018108055 Energy: 0.5871031775692557 Energy: 0.5753843018108055 Energy: 0.6152696884111539 Energy: 0.598990039868188 Energy: 0.6152696884106964 Energy: 0.598990039868188 Energy: 0.6152696884106964 Energy: 0.598990039868188 Energy: 0.5615394852434373 Energy: 0.5826513091637203 Energy: 0.5615394852434373 Energy: 0.5826513091637203 Energy: 0.5615394852434373 Energy: 0.5826513091637203 Energy: 0.5921676410328017 Energy: 0.6064534699743209 Energy: 0.5921676410328017 Energy: 0.6064534699738633 Energy: 0.5921676410328017 Energy: 0.6064534699734057 Energy: 0.5646647338794224 Energy: 0.6129838837227145 Energy: 0.5646647338794224 Energy: 0.6129838837227145 Energy: 0.5646647338794224 Energy: 0.6129838837227145 Energy: 0.5758743521070904 Energy: 0.5884369362555326 Energy: 0.575874352107548 Energy: 0.5884369362555326 Energy: 0.5758743521070904 Energy: 0.5884369362555326 Energy: 0.5871749294561602 Energy: 0.6008223445398407 Energy: 0.5871749294561602 Energy: 0.6008223445398407 Energy: 0.5871749294561602 Energy: 0.6008223445398407 Energy: 0.6300997234140918 Energy: 0.5900993606232334 Energy: 0.6300997234140918 Energy: 0.5900993606232334 Energy: 0.6300997234140918 Energy: 0.5900993606232334 Energy: 0.5736400155227853 Energy: 0.5637260114796712 Energy: 0.5736400155227853 Energy: 0.5637260114796712 Energy: 0.5736400155227853 Energy: 0.5637260114796712 Energy: 0.6089263268108019 Energy: 0.6193730277828003 Energy: 0.6089263268112596 Energy: 0.6193730277828003 Energy: 0.6089263268112596 Energy: 0.6193730277828003 Energy: 0.567635976012253 Energy: 0.579138566433002 Energy: 0.567635976012253 Energy: 0.579138566433002 Energy: 0.5676359760117954 Energy: 0.579138566433002 Energy: 0.5911998739709848 Energy: 0.5977674574577193 Energy: 0.5911998739709848 Energy: 0.5977674574577193 Energy: 0.5911998739709848 Energy: 0.5977674574577193 Energy: 0.585664775850784 Energy: 0.5991358646766961 Energy: 0.585664775850784 Energy: 0.5991358646766961 Energy: 0.585664775850784 Energy: 0.5991358646766961 Energy: 0.5730337544789313 Energy: 0.6086772172729352 Energy: 0.5730337544789313 Energy: 0.6086772172729352 Energy: 0.5730337544789313 Energy: 0.6086772172729352 Energy: 0.5866408644334631 Energy: 0.6018462810403941 Energy: 0.5866408644334631 Energy: 0.6018462810403941 Energy: 0.5866408644334631 Energy: 0.6018462810403941 Energy: 0.5939692426014156 Energy: 0.5644444839390591 Energy: 0.5939692426014156 Energy: 0.5644444839390591 Energy: 0.5939692426014156 Energy: 0.5644444839390591 Energy: 0.5863037553382285 Energy: 0.608258106114945 Energy: 0.5863037553382285 Energy: 0.608258106114945 Energy: 0.5863037553382285 Energy: 0.608258106114945 Energy: 0.5619862278605098 Energy: 0.5419779710551632 Energy: 0.5619862278605098 Energy: 0.5419779710547057 Energy: 0.5619862278605098 Energy: 0.5419779710547057 Energy: 0.5807304105835135 Energy: 0.6284051642872572 Energy: 0.580730410583971 Energy: 0.6284051642872572 Energy: 0.580730410583971 Energy: 0.6284051642872572 minimum gb energy = 0.5419779710547057 eV minimum distance = 2.46809811610235 Angstroms sigma value = 57 ======================================== theta = 141.05755873101862 ======================================== Energy: 0.5162323289701399 Energy: 0.4853310868036179 Energy: 0.5162323289701399 Energy: 0.4853310868036179 Energy: 0.5162323289701399 Energy: 0.4853310868036179 Energy: 0.5390087717482368 Energy: 0.5194966265952558 Energy: 0.5390087717482368 Energy: 0.5194966265952558 Energy: 0.5390087717490512 Energy: 0.5194966265952558 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5110123383684291 Energy: 0.5018908141292011 Energy: 0.5110123383684291 Energy: 0.5018908141292011 Energy: 0.5110123383676147 Energy: 0.5018908141300155 Energy: 0.5363507908353083 Energy: 0.5232786246696887 Energy: 0.5363507908353083 Energy: 0.5232786246696887 Energy: 0.5363507908353083 Energy: 0.5232786246696887 Energy: 0.5371071957709374 Energy: 0.5474336926196152 Energy: 0.5371071957709374 Energy: 0.569550402333236 Energy: 0.5371071957701231 Energy: 0.5010459177112062 Energy: 0.5162323289701399 Energy: 0.48533108680198916 Energy: 0.5162323289701399 Energy: 0.48533108680198916 Energy: 0.5162323289701399 Energy: 0.48533108680198916 Energy: 0.5390087717482368 Energy: 0.5194966265960701 Energy: 0.5390087717482368 Energy: 0.5194966265960701 Energy: 0.5390087717490512 Energy: 0.5194966265960701 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5110123383676147 Energy: 0.4936102949173363 Energy: 0.5110123383684291 Energy: 0.4936102949173363 Energy: 0.5110123383684291 Energy: 0.4936102949173363 Energy: 0.536350790834494 Energy: 0.5232786246696887 Energy: 0.536350790834494 Energy: 0.5232786246696887 Energy: 0.536350790834494 Energy: 0.5232786246696887 Energy: 0.5371071957709374 Energy: 0.501045917712002 Energy: 0.5371071957709374 Energy: 0.5010459177112062 Energy: 0.5371071957701231 Energy: 0.501045917712002 Energy: 0.5162323289701399 Energy: 0.4853310868036179 Energy: 0.5162323289701399 Energy: 0.4853310868036179 Energy: 0.5162323289701399 Energy: 0.4853310868036179 Energy: 0.5390087717482368 Energy: 0.5194966265952558 Energy: 0.5390087717482368 Energy: 0.5194966265952558 Energy: 0.5390087717482368 Energy: 0.5194966265952558 Energy: 0.5362967950299372 Energy: 0.5233014897142984 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5362967950299372 Energy: 0.523301489713484 Energy: 0.5110123383684291 Energy: 0.49361029491815067 Energy: 0.5110123383684291 Energy: 0.49361029491815067 Energy: 0.5110123383676147 Energy: 0.49361029491815067 Energy: 0.5363507908353083 Energy: 0.5232786246696887 Energy: 0.5363507908353083 Energy: 0.5232786246696887 Energy: 0.5363507908353083 Energy: 0.5232786246696887 minimum gb energy = 0.48533108680198916 eV minimum distance = 2.52155656299439 Angstroms sigma value = 9 ======================================== theta = 148.41366190347208 ======================================== Energy: 0.6078603729535085 Energy: 0.5436939604158776 Energy: 0.6078603729535085 Energy: 0.5436939604165426 Energy: 0.6078603729535085 Energy: 0.5436939604165426 Energy: 0.6104157526889893 Energy: 0.564511149309412 Energy: 0.6104157526889893 Energy: 0.564511149309412 Energy: 0.6104157526889893 Energy: 0.564511149309412 Energy: 0.5995870581565202 Energy: 0.5735181715091883 Energy: 0.61694825343082 Energy: 0.5735181715098532 Energy: 0.616948253431485 Energy: 0.5735181715091883 Energy: 0.5727738536523966 Energy: 0.6533449822946141 Energy: 0.5727738536523966 Energy: 0.6533449822946141 Energy: 0.5727738536523966 Energy: 0.6533449822946141 Energy: 0.5569100966720676 Energy: 0.5875820459071656 Energy: 0.5569100966720676 Energy: 0.5875820459071656 Energy: 0.5569100966720676 Energy: 0.5875820459078305 Energy: 0.5469688757392501 Energy: 0.5914190761265392 Energy: 0.5469688757392501 Energy: 0.5914190761265392 Energy: 0.5469688757392501 Energy: 0.5914190761265392 Energy: 0.5807022001926537 Energy: 0.6044612594195092 Energy: 0.5807022001919888 Energy: 0.6044612594195092 Energy: 0.5807022001926537 Energy: 0.6044612594195092 Energy: 0.5478656738300902 Energy: 0.6039314845204068 Energy: 0.5478656738294253 Energy: 0.6039314845197419 Energy: 0.5478656738294253 Energy: 0.6039314845204068 Energy: 0.5791497782092436 Energy: 0.6148867771373623 Energy: 0.5791497782092436 Energy: 0.6148867771373623 Energy: 0.5791497782092436 Energy: 0.6148867771373623 Energy: 0.5805374952693757 Energy: 0.5834581167210582 Energy: 0.5805374952693757 Energy: 0.5834581167210582 Energy: 0.5805374952693757 Energy: 0.5834581167210582 Energy: 0.544073914663382 Energy: 0.5705631599346469 Energy: 0.544073914663382 Energy: 0.5705631599346469 Energy: 0.544073914663382 Energy: 0.5705631599346469 Energy: 0.5844321368407557 Energy: 0.5882463648656476 Energy: 0.5844321368407557 Energy: 0.5882463648656476 Energy: 0.5844321368407557 Energy: 0.5882463648656476 Energy: 0.5603166115342598 Energy: 0.6267861296797925 Energy: 0.5603166115342598 Energy: 0.6267861296804574 Energy: 0.5603166115342598 Energy: 0.6267861296797925 Energy: 0.6053257631845121 Energy: 0.6040151965236662 Energy: 0.6053257631845121 Energy: 0.6040151965236662 Energy: 0.6053257631845121 Energy: 0.6040151965236662 Energy: 0.5520607598383236 Energy: 0.5798589912967002 Energy: 0.5520607598383236 Energy: 0.5798589912967002 Energy: 0.5520607598383236 Energy: 0.5798589912967002 Energy: 0.6095904764553108 Energy: 0.5622520579901016 Energy: 0.6095904764553108 Energy: 0.5622520579901016 Energy: 0.6095904764553108 Energy: 0.5622520579901016 Energy: 0.5965202810003387 Energy: 0.5641229887775807 Energy: 0.5965202809996737 Energy: 0.5641229887775807 Energy: 0.5965202809996737 Energy: 0.5641229887775807 Energy: 0.629520098351057 Energy: 0.5799497960471065 Energy: 0.629520098351057 Energy: 0.5799497960471065 Energy: 0.629520098351057 Energy: 0.5799497960471065 Energy: 0.5712186393250424 Energy: 0.6132766243334117 Energy: 0.5712186393250424 Energy: 0.6132766243334117 Energy: 0.5712186393250424 Energy: 0.6132766243327468 Energy: 0.5655139363268527 Energy: 0.5928135441938461 Energy: 0.5655139363275176 Energy: 0.5928135441938461 Energy: 0.5655139363275176 Energy: 0.5928135441938461 Energy: 0.5908834616072077 Energy: 0.6038126081278505 Energy: 0.5908834616078726 Energy: 0.6038126081278505 Energy: 0.5908834616072077 Energy: 0.6038126081278505 minimum gb energy = 0.5436939604158776 eV minimum distance = 2.52660250357805 Angstroms sigma value = 27 ======================================== theta = 153.4746479833903 ======================================== Energy: 0.6373866595265086 Energy: 0.5963398791504146 Energy: 0.6373866595265086 Energy: 0.5963398791504146 Energy: 0.6373866595265086 Energy: 0.5963398791504146 Energy: 0.5979012005756269 Energy: 0.6092941484412157 Energy: 0.5979012005761873 Energy: 0.6092941484412157 Energy: 0.5979012005761873 Energy: 0.6092941484412157 Energy: 0.6683327973159059 Energy: 0.5979809272632761 Energy: 0.6683327973164662 Energy: 0.5979809272632761 Energy: 0.6683327973164662 Energy: 0.5979809272632761 Energy: 0.7276655593234034 Energy: 0.7233705427645635 Energy: 0.7276655593234034 Energy: 0.7233705427645635 Energy: 0.7276655593234034 Energy: 0.7233705427645635 Energy: 0.6112454579289512 Energy: 0.5534898064878445 Energy: 0.6112454579295118 Energy: 0.5534898064878445 Energy: 0.6112454579295118 Energy: 0.5534898064878445 Energy: 0.561925065148711 Energy: 0.6337158630941848 Energy: 0.5619250651492715 Energy: 0.6337158630941848 Energy: 0.5619250651492715 Energy: 0.6337158630941848 Energy: 0.6266206021788392 Energy: 0.5745806100219019 Energy: 0.6266206021788392 Energy: 0.5745806100219019 Energy: 0.6266206021788392 Energy: 0.5745806100219019 Energy: 0.6453747535402143 Energy: 0.649662324078492 Energy: 0.6453747535402143 Energy: 0.649662324078492 Energy: 0.6453747535402143 Energy: 0.649662324078492 Energy: 0.5621706515760848 Energy: 0.633696491982094 Energy: 0.5621706515755243 Energy: 0.633696491982094 Energy: 0.5621706515755243 Energy: 0.633696491982094 Energy: 0.7317602104692345 Energy: 0.5788985491071709 Energy: 0.7317602104697951 Energy: 0.5788985491071709 Energy: 0.7317602104692345 Energy: 0.5788985491066103 Energy: 0.7277785649119594 Energy: 0.6011180037521544 Energy: 0.7277785649119594 Energy: 0.6011180037521544 Energy: 0.7277785649119594 Energy: 0.6011180037521544 Energy: 0.5779261011318912 Energy: 0.6267657240672107 Energy: 0.5779261011318912 Energy: 0.6267657240677712 Energy: 0.5779261011318912 Energy: 0.6267657240672107 Energy: 0.653246262112646 Energy: 0.6416398107038318 Energy: 0.6532462621132065 Energy: 0.6416398107038318 Energy: 0.6532462621132065 Energy: 0.6416398107038318 Energy: 0.6315044078585033 Energy: 0.562548585522304 Energy: 0.6315044078585033 Energy: 0.5625485855217436 Energy: 0.6315044078585033 Energy: 0.5625485855217436 Energy: 0.5688120085627424 Energy: 0.6336660532625379 Energy: 0.5688120085627424 Energy: 0.6336660532630983 Energy: 0.5688120085627424 Energy: 0.6336660532630983 Energy: 0.6102428276396361 Energy: 0.5537317120062214 Energy: 0.6102428276396361 Energy: 0.5537317120062214 Energy: 0.6102428276396361 Energy: 0.5537317120062214 Energy: 0.621790827104328 Energy: 0.6670995085997574 Energy: 0.6217908271037675 Energy: 0.667099508599197 Energy: 0.6217908271037675 Energy: 0.667099508600318 Energy: 0.7265196966108516 Energy: 0.5769901973587565 Energy: 0.7265196966108516 Energy: 0.5769901973587565 Energy: 0.7265196966108516 Energy: 0.5769901973587565 Energy: 0.5883240500126689 Energy: 0.6219113934111147 Energy: 0.5883240500126689 Energy: 0.6219113934111147 Energy: 0.5883240500126689 Energy: 0.6219113934111147 Energy: 0.6373866595270691 Energy: 0.5963398791504146 Energy: 0.6373866595270691 Energy: 0.5963398791504146 Energy: 0.6373866595270691 Energy: 0.5963398791504146 Energy: 0.5979012005761873 Energy: 0.6092941484417762 Energy: 0.5979012005761873 Energy: 0.6092941484417762 Energy: 0.5979012005761873 Energy: 0.6092941484417762 Energy: 0.6683327973147849 Energy: 0.5979809272627157 Energy: 0.6683327973147849 Energy: 0.5979809272621552 Energy: 0.6683327973147849 Energy: 0.5979809272627157 Energy: 0.7276655593234034 Energy: 0.7233705427640029 Energy: 0.7276655593228429 Energy: 0.7233705427640029 Energy: 0.7276655593234034 Energy: 0.7233705427640029 Energy: 0.6112454579289512 Energy: 0.5534898064867237 Energy: 0.6112454579289512 Energy: 0.5534898064867237 Energy: 0.6112454579289512 Energy: 0.5534898064867237 Energy: 0.561925065148711 Energy: 0.6337158630936244 Energy: 0.561925065148711 Energy: 0.6337158630936244 Energy: 0.5619250651492715 Energy: 0.6337158630936244 minimum gb energy = 0.5534898064867237 eV minimum distance = 2.56013453988652 Angstroms sigma value = 19 ======================================== theta = 157.15649268207542 ======================================== Energy: 0.6099353316735252 Energy: 0.6096058364604469 Energy: 0.6099353316730415 Energy: 0.6096058364609307 Energy: 0.6099353316735252 Energy: 0.6096058364609307 Energy: 0.6384211535388779 Energy: 0.5875769273822088 Energy: 0.638421153538394 Energy: 0.5875769273822088 Energy: 0.638421153538394 Energy: 0.5875769273822088 Energy: 0.6269423232106944 Energy: 0.5813877664006329 Energy: 0.6437535969486962 Energy: 0.5813877664006329 Energy: 0.6241150082585393 Energy: 0.5813877664006329 Energy: 0.5863653646163892 Energy: 0.6067423783553404 Energy: 0.5863653646163892 Energy: 0.6067423783553404 Energy: 0.5863653646163892 Energy: 0.6067423783553404 Energy: 0.5906327253446754 Energy: 0.5999404441873767 Energy: 0.5906327253446754 Energy: 0.5999404441873767 Energy: 0.5906327253446754 Energy: 0.5999404441873767 Energy: 0.6212362907258209 Energy: 0.5932437969388997 Energy: 0.6212362907258209 Energy: 0.5932437969388997 Energy: 0.6212362907263047 Energy: 0.5932437969388997 Energy: 0.5834761943744993 Energy: 0.6676222932841392 Energy: 0.5834761943740154 Energy: 0.6676222932841392 Energy: 0.5834761943740154 Energy: 0.6676222932841392 Energy: 0.592487484353034 Energy: 0.6767072661634397 Energy: 0.5924874843535178 Energy: 0.6767072661634397 Energy: 0.5924874843535178 Energy: 0.6767072661634397 Energy: 0.6340814707776464 Energy: 0.5804483074392321 Energy: 0.6340814707771626 Energy: 0.5804483074392321 Energy: 0.6340814707776464 Energy: 0.5804483074392321 Energy: 0.5987310645909958 Energy: 0.6128606328305819 Energy: 0.5987310645909958 Energy: 0.6128606328305819 Energy: 0.5987310645909958 Energy: 0.6128606328305819 Energy: 0.5812204803074191 Energy: 0.6202828394866792 Energy: 0.581220480307903 Energy: 0.620282839487163 Energy: 0.5812204803074191 Energy: 0.620282839487163 Energy: 0.6767123850485973 Energy: 0.5877842247661992 Energy: 0.6767123850485973 Energy: 0.5877842247661992 Energy: 0.6767123850485973 Energy: 0.5877842247661992 Energy: 0.622652119969501 Energy: 0.6070914926190861 Energy: 0.6226521199699848 Energy: 0.6070914926190861 Energy: 0.622652119969501 Energy: 0.6070914926190861 Energy: 0.5917440472156348 Energy: 0.6057558721247784 Energy: 0.5917440472156348 Energy: 0.6057558721247784 Energy: 0.5917440472156348 Energy: 0.6057558721247784 Energy: 0.6231854849353263 Energy: 0.5744972286658553 Energy: 0.6231854849353263 Energy: 0.5744972286653715 Energy: 0.6231854849353263 Energy: 0.5744972286648876 Energy: 0.6059674157126023 Energy: 0.5780880237691151 Energy: 0.6059674157126023 Energy: 0.5780880237691151 Energy: 0.6059674157126023 Energy: 0.5780880237691151 Energy: 0.5906031768201344 Energy: 0.6425989828349407 Energy: 0.5906031768201344 Energy: 0.6425989828349407 Energy: 0.5906031768201344 Energy: 0.6425989828349407 Energy: 0.5960980807125836 Energy: 0.6540725743095908 Energy: 0.5960980807125836 Energy: 0.6540725743095908 Energy: 0.5960980807125836 Energy: 0.6540725743100745 Energy: 0.6183305061388201 Energy: 0.5925070479547146 Energy: 0.6183305061388201 Energy: 0.5925070479542308 Energy: 0.646124703648802 Energy: 0.5925070479542308 Energy: 0.5836455884192484 Energy: 0.5952073656715986 Energy: 0.5836455884187646 Energy: 0.5952073656720824 Energy: 0.5836455884187646 Energy: 0.5952073656720824 Energy: 0.5710339550776189 Energy: 0.6491441067561886 Energy: 0.5710339550776189 Energy: 0.6491441067566726 Energy: 0.5710339550776189 Energy: 0.6491441067566726 Energy: 0.631655803865417 Energy: 0.5813237330553599 Energy: 0.631655803865417 Energy: 0.5813237330553599 Energy: 0.6316558038649331 Energy: 0.5813237330553599 Energy: 0.6210214945728126 Energy: 0.5951380961963781 Energy: 0.6210214945728126 Energy: 0.5951380961963781 Energy: 0.6210214945728126 Energy: 0.5951380961963781 Energy: 0.6124704587775358 Energy: 0.6236111735785481 Energy: 0.6124704587775358 Energy: 0.6236111735785481 Energy: 0.6124704587770521 Energy: 0.6236111735785481 Energy: 0.5789883566951975 Energy: 0.5781777353345894 Energy: 0.5789883566947137 Energy: 0.5781777353341057 Energy: 0.5789883566951975 Energy: 0.5781777353345894 Energy: 0.6301907562021126 Energy: 0.5744810380200465 Energy: 0.6301907562021126 Energy: 0.5744810380200465 Energy: 0.6301907562021126 Energy: 0.5744810380200465 Energy: 0.5780928135491883 Energy: 0.5894976899206817 Energy: 0.5780928135491883 Energy: 0.5894976899206817 Energy: 0.5780928135491883 Energy: 0.5894976899206817 Energy: 0.6418493706716304 Energy: 0.592685615813816 Energy: 0.6418493706711466 Energy: 0.5926856158133321 Energy: 0.6418493706716304 Energy: 0.5926856158133321 Energy: 0.6405358598289275 Energy: 0.5925000408143289 Energy: 0.6405358598289275 Energy: 0.5925000408148128 Energy: 0.6405358598289275 Energy: 0.5925000408143289 minimum gb energy = 0.5710339550776189 eV minimum distance = 2.55332667620827 Angstroms sigma value = 101 ======================================== theta = 159.95002427584853 ======================================== Energy: 0.5690545663212523 Energy: 0.5973134986402883 Energy: 0.5690545663212523 Energy: 0.5973134986402883 Energy: 0.5690545663212523 Energy: 0.5973134986398629 Energy: 0.5788823357489115 Energy: 0.5779232333812926 Energy: 0.5788823357484861 Energy: 0.5777373941929111 Energy: 0.5788823357489115 Energy: 0.5706257193016931 Energy: 0.6028126969773664 Energy: 0.5449262841690148 Energy: 0.6028126969773664 Energy: 0.5449262841690148 Energy: 0.6028126969777917 Energy: 0.5449262841690148 Energy: 0.5311087565706295 Energy: 0.6248341231003979 Energy: 0.5311087565702043 Energy: 0.6453010147172772 Energy: 0.5311087565702043 Energy: 0.6206468490429584 Energy: 0.556541389390871 Energy: 0.5858656356851655 Energy: 0.5565413893904458 Energy: 0.5858656356851655 Energy: 0.556541389390871 Energy: 0.5858656356855907 Energy: 0.603335364253016 Energy: 0.5398102498411567 Energy: 0.603335364253016 Energy: 0.5398102498411567 Energy: 0.603335364253016 Energy: 0.5398102498411567 Energy: 0.5704788921384301 Energy: 0.5731113125081994 Energy: 0.5704788921384301 Energy: 0.5731113125120268 Energy: 0.5704788921384301 Energy: 0.5731113125094752 Energy: 0.5346841735806026 Energy: 0.6502432466332986 Energy: 0.5346841735806026 Energy: 0.6502432466332986 Energy: 0.5346841735810279 Energy: 0.6502432466332986 Energy: 0.5977995442068091 Energy: 0.540480025960211 Energy: 0.5977995442068091 Energy: 0.540480025960211 Energy: 0.5977995442068091 Energy: 0.540480025960211 Energy: 0.58124995893224 Energy: 0.6038575615415132 Energy: 0.5812499589326653 Energy: 0.5924720506686705 Energy: 0.5812499589326653 Energy: 0.578117529175553 Energy: 0.5298835802193793 Energy: 0.6927622118378682 Energy: 0.5298835802193793 Energy: 0.6927622118378682 Energy: 0.5298835802193793 Energy: 0.6927622118378682 Energy: 0.5912341928152294 Energy: 0.5482885892351635 Energy: 0.5912341928143787 Energy: 0.5482885892351635 Energy: 0.5912341928143787 Energy: 0.5482885892351635 Energy: 0.569886967628262 Energy: 0.5447345739822822 Energy: 0.5698869676278366 Energy: 0.5447345739822822 Energy: 0.5698869676278366 Energy: 0.5447345739822822 Energy: 0.5713351194313844 Energy: 0.6270929127414455 Energy: 0.5713351194313844 Energy: 0.6490860877041116 Energy: 0.5713351194313844 Energy: 0.5972615685517347 Energy: 0.5820405889913768 Energy: 0.5917546211650161 Energy: 0.5820405889913768 Energy: 0.5917546211654413 Energy: 0.5820405889913768 Energy: 0.5917546211654413 Energy: 0.6015017168214154 Energy: 0.5456414453622721 Energy: 0.6015017168209902 Energy: 0.5456414453622721 Energy: 0.6015017168214154 Energy: 0.5456414453622721 Energy: 0.5290810675545526 Energy: 0.6005042253034152 Energy: 0.5290810675545526 Energy: 0.6005042253034152 Energy: 0.5290810675541466 Energy: 0.6005042253038404 Energy: 0.5279037613014912 Energy: 0.6107515124042963 Energy: 0.5279037613019165 Energy: 0.610751512403871 Energy: 0.5279037613019165 Energy: 0.6107515124042963 Energy: 0.593021199916856 Energy: 0.5403726829538597 Energy: 0.5930211999172813 Energy: 0.5403726829538597 Energy: 0.593021199916856 Energy: 0.5403726829538597 Energy: 0.5645446421349432 Energy: 0.6044932575146995 Energy: 0.5645446421353684 Energy: 0.6044932575146995 Energy: 0.5645446421353684 Energy: 0.6044932575146995 Energy: 0.536247358085499 Energy: 0.6663523314567501 Energy: 0.5362473580859242 Energy: 0.6663523314571755 Energy: 0.5362473580859242 Energy: 0.6663523314571755 Energy: 0.604052803828593 Energy: 0.539805421407173 Energy: 0.604052803828593 Energy: 0.539805421407173 Energy: 0.6040528038290184 Energy: 0.539805421407173 Energy: 0.6197575666445712 Energy: 0.5391291758320546 Energy: 0.6197575666441459 Energy: 0.5391291758316293 Energy: 0.6197575666441459 Energy: 0.5391291758316293 Energy: 0.53122161999435 Energy: 0.6329934614780228 Energy: 0.53122161999435 Energy: 0.6329934614775976 Energy: 0.53122161999435 Energy: 0.6329934614780228 Energy: 0.6771576821498473 Energy: 0.6231781999815961 Energy: 0.677157682149422 Energy: 0.6231781999815961 Energy: 0.677157682149422 Energy: 0.6231781999815961 Energy: 0.5659906780826444 Energy: 0.5455690302483438 Energy: 0.5659906780826444 Energy: 0.5455690302483438 Energy: 0.5659906780830697 Energy: 0.5455690302483438 Energy: 0.5690781323917287 Energy: 0.6041178954960038 Energy: 0.5690781323917287 Energy: 0.6041178954960038 Energy: 0.5690781323917287 Energy: 0.6041178954960038 Energy: 0.5878716252414391 Energy: 0.6056070090126409 Energy: 0.5878716252414391 Energy: 0.6056070090126409 Energy: 0.5878716252414391 Energy: 0.6056070090126409 Energy: 0.6310245941889668 Energy: 0.544112412671048 Energy: 0.6310245941889668 Energy: 0.544112412671048 Energy: 0.6310245941889668 Energy: 0.544112412671048 Energy: 0.5282198240107421 Energy: 0.6492330771808781 Energy: 0.5282198240103168 Energy: 0.6492330771813033 Energy: 0.5282198240107421 Energy: 0.6492330771813033 Energy: 0.5303793893435552 Energy: 0.594371425005376 Energy: 0.53037938934313 Energy: 0.5943714250049505 Energy: 0.5303793893435552 Energy: 0.5943714250058012 Energy: 0.6189123539661919 Energy: 0.5398808315352809 Energy: 0.6189123539661919 Energy: 0.5398808315352809 Energy: 0.6189123539666171 Energy: 0.5398808315357061 Energy: 0.6040738367693893 Energy: 0.5626497561637739 Energy: 0.6040738367685389 Energy: 0.5626497561637739 Energy: 0.6040738367685389 Energy: 0.5626497561637739 minimum gb energy = 0.5279037613014912 eV minimum distance = 2.54365835060201 Angstroms sigma value = 33 ======================================== theta = 180.0 ======================================== Energy: 0.01168150625085084 Energy: 0.5040853827425418 Energy: 0.01168150625085084 Energy: 0.5040853827425418 Energy: 0.01168150625085084 Energy: 0.5040853827422082 Energy: 0.012401548932412769 Energy: 0.17462271272150767 Energy: 0.012401548932412769 Energy: 0.17462271272150767 Energy: 0.012401548932412769 Energy: 0.17462271272115432 Energy: 0.6190991353072485 Energy: 0.1740842066993291 Energy: 0.8520097618274008 Energy: 0.17420191829697645 Energy: 1.1403041928833868 Energy: 0.17421106367609435 Energy: 0.012401548932412769 Energy: 0.17462271272150767 Energy: 0.012401548932412769 Energy: 0.17462271272150767 Energy: 0.012401548932059416 Energy: 0.17462271272150767 minimum gb energy = 0.01168150625085084 eV minimum distance = 2.83788990012898 Angstroms sigma value = 1