Model name: model_name=EAM_Dynamo_Foiles_1985_Ni__MO_010059867259_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Ni Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.519999977946282 cohesive_energy=4.450349978791505 mass=58.6934 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=60.0 Max. denominator: max_denominator=8 Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5 Min. number unit cell repetitions along x direction: x_repeat=1 Min. number unit cell repetitions along z direction: z_repeat=1 Min. cell height (Angstroms): min_cell_height=10.0 Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25 Isolated atom energy: 0.0 eV ======================================== theta = 0.0 ======================================== Energy: 0.022239471441069063 Energy: 0.6386340920849971 Energy: 1.61864168815646 Energy: 0.6386051177442685 Energy: 0.022239471441069063 Energy: 0.6386340920876377 Energy: 0.6585240593427418 Energy: 0.6579291951537154 Energy: 0.022569522465840736 Energy: 0.3570285783852296 Energy: 0.022506023560778105 Energy: 0.6579291951457934 Energy: 0.022569522463200074 Energy: 0.3570285783852296 Energy: 0.022239471441069063 Energy: 0.6386340920849971 Energy: 1.6186416881538193 Energy: 0.6386051177442685 Energy: 0.022239471441069063 Energy: 0.6386340920849971 Energy: 0.6585240593401013 Energy: 0.6579291951537154 Energy: 0.022569522465840736 Energy: 0.357028578382589 Energy: 0.022506023560778105 Energy: 0.6579291951457934 Energy: 0.022569522463200074 Energy: 0.3570285783852296 Energy: 0.022239471441069063 Energy: 0.6386340920849971 Energy: 0.9218478565790513 Energy: 0.6386051177442685 Energy: 0.022239471441069063 Energy: 0.6386340920849971 Energy: 0.6585240593401013 Energy: 0.6579291951563561 Energy: 0.022569522465840736 Energy: 0.357028578382589 Energy: 0.022506023560778105 Energy: 0.6579291951457934 Energy: 0.022569522460559405 Energy: 0.3570285783852296 minimum gb energy = 0.022239471441069063 eV minimum distance = 2.47007644158551 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 1.5622542809737927 Energy: 1.4823503900191108 Energy: 1.5794678490724026 Energy: 1.4830859783159145 Energy: 1.5622542809512687 Energy: 1.4823503900287889 Energy: 1.5483204058917892 Energy: 1.469187451263194 Energy: 1.4754823197614986 Energy: 1.466897115497138 Energy: 1.499094781432803 Energy: 1.469187451253516 Energy: 1.475482319774403 Energy: 1.466897115535792 Energy: 1.4580120167025064 Energy: 1.4592579028172203 Energy: 1.5222115948495363 Energy: 1.5020324080733352 Energy: 1.4580120167250885 Energy: 1.4592579027946964 Energy: 1.5222115948205013 Energy: 1.5847207133850263 Energy: 1.4787745731412771 Energy: 1.441716743461833 Energy: 1.4923871489356766 Energy: 1.584720713404383 Energy: 1.478774573147729 Energy: 1.4417167434328566 Energy: 1.4740633068495492 Energy: 1.4469140885666518 Energy: 1.5586663512160144 Energy: 1.4515734042096688 Energy: 1.4740633068914881 Energy: 1.4469140885698781 Energy: 1.5586663512579533 Energy: 1.5253094363550543 Energy: 1.4814193128042812 Energy: 1.5115460972476706 Energy: 1.4730760964151097 Energy: 1.5253094363679 Energy: 1.4814193127849247 Energy: 1.5115460972315402 Energy: 1.4532412825879435 Energy: 1.4830841669381623 Energy: 1.5559743147288645 Energy: 1.4803059832762946 Energy: 1.4532412825524563 Energy: 1.483084166954234 Energy: 1.5559743147256384 Energy: 1.454261542219198 Energy: 1.464827683090734 Energy: 1.477192864635752 Energy: 1.4641271735346155 Energy: 1.4542615422031266 Energy: 1.4648276830616993 Energy: 1.4771928646163952 Energy: 1.4367725015981259 Energy: 1.4928530718875803 Energy: 1.465364738440829 Energy: 1.4719311316757868 Energy: 1.4367725015497932 Energy: 1.4928530718811281 Energy: 1.4653647384505073 Energy: 1.475319617144618 Energy: 1.4852709776275037 Energy: 1.5041452468524708 Energy: 1.4810518490661788 Energy: 1.4753196171542966 Energy: 1.485270977637182 Energy: 1.5041452468524708 Energy: 1.4680287956503801 Energy: 1.4782617359081829 Energy: 1.5134809119622175 Energy: 1.5553730096545577 Energy: 1.4680287956536062 Energy: 1.4782617358823742 Energy: 1.513480911942861 Energy: 1.5092608004154568 Energy: 1.4699329567083457 Energy: 1.5294288823391944 Energy: 1.4555185426351684 Energy: 1.5092608004767525 Energy: 1.4699329566954413 Energy: 1.5294288823133857 Energy: 1.5824593893091479 Energy: 1.5670784402693014 Energy: 1.4787474906763922 Energy: 1.480293793514694 Energy: 1.5824593892801717 Energy: 1.5670784402145166 Energy: 1.478747490679618 Energy: 1.4523143761455148 Energy: 1.5455999498066024 Energy: 1.4667680641128287 Energy: 1.4591818962058662 Energy: 1.4523143761648127 Energy: 1.5455999498162805 Energy: 1.466768064083853 Energy: 1.4757242952625982 Energy: 1.475726548859076 Energy: 1.53332035584697 Energy: 1.4855218122457958 Energy: 1.4757242952819545 Energy: 1.4757265488752067 Energy: 1.5333203558437438 Energy: 1.5199007681459014 Energy: 1.558419692995536 Energy: 1.4778744071457455 Energy: 1.6116547249981077 Energy: 1.5199007681362815 Energy: 1.5584196929761795 Energy: 1.477874407168328 Energy: 1.4687990088690215 Energy: 1.489429092178831 Energy: 1.5130371311307518 Energy: 1.5029952668584774 Energy: 1.468799008888378 Energy: 1.4894290922143179 Energy: 1.5130371311501085 Energy: 1.4548828406200658 Energy: 1.4518758130113683 Energy: 1.4840689276086805 Energy: 1.5088261918777954 Energy: 1.4548828406394223 Energy: 1.4518758130274985 Energy: 1.4840689275860979 Energy: 1.492859804381667 Energy: 1.4717386552418428 Energy: 1.47388334838403 Energy: 1.4931963178698275 Energy: 1.492859804391345 Energy: 1.4717386552676515 Energy: 1.4738833483711253 Energy: 1.4730871357609177 Energy: 1.4534667739739853 Energy: 1.4823674080367077 Energy: 1.4533144801612343 Energy: 1.4730871357705373 Energy: 1.4534667739578548 Energy: 1.4823674080334817 Energy: 1.4533523562700008 Energy: 1.4797445746360565 Energy: 1.4941870981120897 Energy: 1.4756976198107583 Energy: 1.453352356279679 Energy: 1.4797445746489606 Energy: 1.4941870980701504 Energy: 1.4536698147359914 Energy: 1.4701167259325882 Energy: 1.4728681580585077 Energy: 1.4706543124786546 Energy: 1.4536698147423848 Energy: 1.4701167259003274 Energy: 1.4728681580649599 Energy: 1.4679459392841363 Energy: 1.4614324431813457 Energy: 1.5139884569510256 Energy: 1.461929025184138 Energy: 1.4679459392938148 Energy: 1.4614324431845718 Energy: 1.5139884569961326 Energy: 1.518627305172806 Energy: 1.4742696022810136 Energy: 1.5367083010236193 Energy: 1.4808290719284283 Energy: 1.5186273052179127 Energy: 1.4742696022391328 Energy: 1.5367083010332974 Energy: 1.4751889953979205 Energy: 1.4818145088618178 Energy: 1.510766261636523 Energy: 1.478880139760728 Energy: 1.475188995391527 Energy: 1.4818145088521395 Energy: 1.5107662616494273 Energy: 1.475759403287983 Energy: 1.4790417734578292 Energy: 1.4663565165481112 Energy: 1.5326265581289016 Energy: 1.4757594032815309 Energy: 1.4790417734997685 Energy: 1.4663565165577899 Energy: 1.5476432173596988 Energy: 1.450652244598886 Energy: 1.5264939820372647 Energy: 1.4669671953277543 Energy: 1.5476432173693773 Energy: 1.4506522446214687 Energy: 1.526493982053395 Energy: 1.529194296190737 Energy: 1.5293021040282362 Energy: 1.4737477450372398 Energy: 1.5295973438140962 Energy: 1.529194296190737 Energy: 1.529302104018558 Energy: 1.4737477450404657 Energy: 1.5339990515781046 Energy: 1.4834717322444335 Energy: 1.4958690004489903 Energy: 1.4503034450227987 Energy: 1.5339990515716522 Energy: 1.4834717323283118 Energy: 1.4958690004231816 Energy: 1.4548274719731837 Energy: 1.4614435722557841 Energy: 1.63699392304946 Energy: 1.48733191900065 Energy: 1.4548274720150645 Energy: 1.4614435722396537 Energy: 1.6369939230623642 Energy: 1.4741845793243404 Energy: 1.5403250078416308 Energy: 1.5472090396883453 Energy: 1.5320994296795512 Energy: 1.4741845793082105 Energy: 1.5403250078255006 Energy: 1.5472090396947973 Energy: 1.5171149593405253 Energy: 1.462113311206862 Energy: 1.4841154893143724 Energy: 1.4633273394678419 Energy: 1.51711495929536 Energy: 1.4621133112133144 Energy: 1.4841154893272768 Energy: 1.4814659563731734 Energy: 1.4669331428726085 Energy: 1.612980251284016 Energy: 1.4620457511956608 Energy: 1.4814659563667212 Energy: 1.4669331428855126 Energy: 1.612980251316218 Energy: 1.4900045399131372 Energy: 1.4649990175850611 Energy: 1.4715594612431775 Energy: 1.4646044135506855 Energy: 1.4900045399002912 Energy: 1.464999017620548 Energy: 1.471559461185108 Energy: 1.4531779314522 Energy: 1.460594507296808 Energy: 1.5231778622259362 Energy: 1.4659393591914445 Energy: 1.453177931455426 Energy: 1.4605945072903561 Energy: 1.5231778622452927 Energy: 1.4728500042252066 Energy: 1.484479452658507 Energy: 1.4715377623996206 Energy: 1.4793018006180672 Energy: 1.4728500042445634 Energy: 1.4844794526294722 Energy: 1.4715377624092987 Energy: 1.4367932825152392 Energy: 1.4933817412753705 Energy: 1.4704050965404145 Energy: 1.470975584164285 Energy: 1.4367932825442737 Energy: 1.4933817412818224 Energy: 1.4704050965436406 Energy: 1.459494360439178 Energy: 1.4788502304308446 Energy: 1.576896890489866 Energy: 1.4509147434044658 Energy: 1.4594943604262733 Energy: 1.4788502304663314 Energy: 1.5768968904705094 Energy: 1.4648206169143938 Energy: 1.5137474359788274 Energy: 1.4897229494065596 Energy: 1.4799119379065386 Energy: 1.4648206168853588 Energy: 1.5137474359691492 Energy: 1.489722949409786 Energy: 1.5112799429063941 Energy: 1.4760153055303964 Energy: 1.4773164225230246 Energy: 1.4893390266556852 Energy: 1.5112799429160721 Energy: 1.4760153054691008 Energy: 1.4773164225585116 Energy: 1.5447338870878498 Energy: 1.4787602716061237 Energy: 1.4982793905138234 Energy: 1.5441433770002382 Energy: 1.5447338870362326 Energy: 1.478760271583541 Energy: 1.4982793904976928 Energy: 1.5150088281424154 Energy: 1.4595908628148617 Energy: 1.4672625089834557 Energy: 1.4825138165726577 Energy: 1.5150088281101548 Energy: 1.459590862827766 Energy: 1.4672625089802294 Energy: 1.5818947039578994 Energy: 1.4796333114771634 Energy: 1.5057348445839045 Energy: 1.493280899227535 Energy: 1.5818947039062823 Energy: 1.479633311470711 Energy: 1.5057348446064875 Energy: 1.5426070179733495 Energy: 1.4677122459275762 Energy: 1.5290853765530983 Energy: 1.457964253734636 Energy: 1.5426070179991584 Energy: 1.4677122459340284 Energy: 1.529085376540194 Energy: 1.4367144933993168 Energy: 1.4899212063122989 Energy: 1.496130143807226 Energy: 1.4881708332706363 Energy: 1.4367144934186733 Energy: 1.4899212063058467 Energy: 1.4961301438394283 Energy: 1.4729261767901327 Energy: 1.5419167944566803 Energy: 1.5593557759738355 Energy: 1.5316194675018961 Energy: 1.4729261767869068 Energy: 1.5419167944470022 Energy: 1.5593557759609311 Energy: 1.436751910974224 Energy: 1.47665647945023 Energy: 1.499401449842847 Energy: 1.4707967844793866 Energy: 1.4367519109516413 Energy: 1.4766564794921107 Energy: 1.4994014498332275 minimum gb energy = 1.4367144933993168 eV minimum distance = 2.23643485766972 Angstroms sigma value = 401 ======================================== theta = 27.79577249602797 ======================================== Energy: 1.5921976861297225 Energy: 1.5227353182098142 Energy: 1.5276301311902876 Energy: 1.5144443397380456 Energy: 1.5921976861223985 Energy: 1.5227353182244623 Energy: 1.51057786437469 Energy: 1.4597069282026245 Energy: 1.4842654862042222 Energy: 1.5250287233955067 Energy: 1.5015913966175163 Energy: 1.4597069282062864 Energy: 1.4842654862188702 Energy: 1.5250287234028306 Energy: 1.4567766315898147 Energy: 1.4917715467551422 Energy: 1.5290313208348545 Energy: 1.5017230071802385 Energy: 1.4567766315824913 Energy: 1.4917715467478183 Energy: 1.5290313208385162 Energy: 1.4887233642857065 Energy: 1.5141085276486537 Energy: 1.5888938202873233 Energy: 1.474176911296607 Energy: 1.4887233642820445 Energy: 1.5141085276486537 Energy: 1.5274756874926316 Energy: 1.4892279671422002 Energy: 1.490631514209952 Energy: 1.5450106126233676 Energy: 1.4752713794186136 Energy: 1.4892279671348763 Energy: 1.490631514195304 Energy: 1.524459498221692 Energy: 1.4563844822422225 Energy: 1.4821877080787005 Energy: 1.4454703082980962 Energy: 1.4883318937535739 Energy: 1.4563844822422225 Energy: 1.4821877080860244 Energy: 1.4454703083054201 Energy: 1.4832604377781915 Energy: 1.5122305876482003 Energy: 1.5191637517240928 Energy: 1.4796979146495841 Energy: 1.4832604377562195 Energy: 1.512230587673767 Energy: 1.5147506378833635 Energy: 1.4884711108841386 Energy: 1.4654134193367816 Energy: 1.4661462476819094 Energy: 1.4994347746046668 Energy: 1.4884711108987858 Energy: 1.4654134193477675 Energy: 1.4661462476819094 Energy: 1.4558135534397598 Energy: 1.4748555770297018 Energy: 1.57880492568618 Energy: 1.4893130667768655 Energy: 1.455813553414126 Energy: 1.4748555770443497 Energy: 1.578596575804232 Energy: 1.4881176335008852 Energy: 1.5218409420613441 Energy: 1.5519451005181308 Energy: 1.480295513473588 Energy: 1.488117633504547 Energy: 1.5218409420613441 Energy: 1.5629635914066131 Energy: 1.4880200643084462 Energy: 1.5393244586967636 Energy: 1.6222905501515577 Energy: 1.4804687220797335 Energy: 1.488020064312108 Energy: 1.5393244587113446 Energy: 1.5057518778639707 Energy: 1.4562268182078086 Energy: 1.4932643112476003 Energy: 1.6130621948321913 Energy: 1.5033946019326947 Energy: 1.4562268182261182 Energy: 1.4932643112439383 Energy: 1.6842979257854935 Energy: 1.4824516710808555 Energy: 1.4807331602252853 Energy: 1.651661128693144 Energy: 1.5006656102766704 Energy: 1.4824516710808555 Energy: 1.4807331602289477 Energy: 1.6727188964789275 Energy: 1.4913414621224261 Energy: 1.5227353182171384 Energy: 1.506751054161595 Energy: 1.5144443397417073 Energy: 1.4913414621627075 Energy: 1.522735318235448 Energy: 1.5338278724447336 Energy: 1.4597069281953006 Energy: 1.484265486215208 Energy: 1.5689350874978674 Energy: 1.5034791064968027 Energy: 1.4597069281989625 Energy: 1.484265486222532 Energy: 1.5250287234064923 Energy: 1.456776631586153 Energy: 1.4917715467697903 Energy: 1.5290313208385162 Energy: 1.5017230071802385 Energy: 1.456776631578829 Energy: 1.4917715467551422 Energy: 1.5290313208421784 Energy: 1.4887233642930302 Energy: 1.5122431638651828 Energy: 1.5888938202983092 Energy: 1.4741769113075929 Energy: 1.4887233642893685 Energy: 1.512243163861521 Energy: 1.5274756874962934 Energy: 1.489227967145862 Energy: 1.4991549762267848 Energy: 1.5687460570290297 Energy: 1.4752713794259373 Energy: 1.489227967138538 Energy: 1.4991549762011511 Energy: 1.5687460570290297 Energy: 1.4564049998267554 Energy: 1.4821877080823624 Energy: 1.4454703082980962 Energy: 1.4883318937608976 Energy: 1.4564049998304174 Energy: 1.4821877080750383 Energy: 1.4454703083017582 Energy: 1.4829603494499277 Energy: 1.512230587651862 Energy: 1.5261023719879567 Energy: 1.4796979146532463 Energy: 1.4829603494609138 Energy: 1.512230587673767 Energy: 1.478900531504172 Energy: 1.4878912331558114 Energy: 1.4654134193367816 Energy: 1.4661462476855711 Energy: 1.500164992420916 Energy: 1.4878912331484877 Energy: 1.4654134193477675 Energy: 1.466146247678247 Energy: 1.4558135534360976 Energy: 1.47485557702604 Energy: 1.6037336673202622 Energy: 1.4893130667695413 Energy: 1.455813553414126 Energy: 1.4748555770406877 Energy: 1.6032694477921774 Energy: 1.4881176335008852 Energy: 1.5218409420576822 Energy: 1.5640652270111501 Energy: 1.480295513473588 Energy: 1.4881176334972228 Energy: 1.521840942065006 Energy: 1.5496385360251768 Energy: 1.4880200643084462 Energy: 1.526793905469425 Energy: 1.4898702337670326 Energy: 1.4804687220870572 Energy: 1.4880200643084462 Energy: 1.5267939054730872 Energy: 1.480752625450298 Energy: 1.4558859884034145 Energy: 1.4932643112402764 Energy: 1.6593517775032294 Energy: 1.5033946019400186 Energy: 1.4558859884034145 Energy: 1.4932643112366146 Energy: 1.6782066471140578 Energy: 1.4623921460368519 Energy: 1.4807331602216236 Energy: 1.5982674854455123 Energy: 1.5006656102839944 Energy: 1.4623921460441758 Energy: 1.4807331602216236 Energy: 1.6588710208212463 Energy: 1.5921976861333842 Energy: 1.5227353182207999 Energy: 1.5067510541725808 Energy: 1.5144443397380456 Energy: 1.5921976861260603 Energy: 1.522735318235448 Energy: 1.5276301312012737 Energy: 1.4597069281989625 Energy: 1.484265486211546 Energy: 1.5250287233955067 Energy: 1.5015913966175163 Energy: 1.4597069282026245 Energy: 1.4842654862261941 Energy: 1.5250287234064923 Energy: 1.4567766315824913 Energy: 1.4917715467661279 Energy: 1.5290313208348545 Energy: 1.5017230071765768 Energy: 1.4567766315751671 Energy: 1.4917715467478183 Energy: 1.5290313208458401 Energy: 1.4887233642893685 Energy: 1.5141085276449917 Energy: 1.5274756875036173 Energy: 1.4741769113002687 Energy: 1.4887233642857065 Energy: 1.5141085276486537 Energy: 1.5274756874999553 Energy: 1.4892279671422002 Energy: 1.4906315142136137 Energy: 1.524459498221692 Energy: 1.4752713794222758 Energy: 1.489227967138538 Energy: 1.490631514195304 Energy: 1.5244594982180302 Energy: 1.4563844822312366 Energy: 1.4821877080823624 Energy: 1.4454703083017582 Energy: 1.4883318937572356 Energy: 1.4563844822312366 Energy: 1.4821877080860244 Energy: 1.4454703083017582 Energy: 1.4832604377708676 Energy: 1.512230587644538 Energy: 1.5147506378723772 Energy: 1.4796979146532463 Energy: 1.4832604377488958 Energy: 1.5122305876701052 Energy: 1.4789005315114958 Energy: 1.4884711108768145 Energy: 1.4654134193404438 Energy: 1.4661462476819094 Energy: 1.4994347746010046 Energy: 1.4884711108987858 Energy: 1.4654134193477675 Energy: 1.4661462476709235 Energy: 1.4558135534434216 Energy: 1.47485557702604 Energy: 1.5757013299020541 Energy: 1.4893130667768655 Energy: 1.45581355342145 Energy: 1.4748555770406877 Energy: 1.5757013298983922 Energy: 1.4881176335008852 Energy: 1.5218409420576822 Energy: 1.5430558417445996 Energy: 1.4802955134809117 Energy: 1.4881176335008852 Energy: 1.521840942065006 Energy: 1.5743076872087687 Energy: 1.4880200643084462 Energy: 1.5393244586931016 Energy: 1.4898702337633707 Energy: 1.4804687220797335 Energy: 1.4880200643084462 Energy: 1.539324458704021 Energy: 1.5057518778566468 Energy: 1.4562268182041467 Energy: 1.4932643112439383 Energy: 1.6338724927370534 Energy: 1.503394601921709 Energy: 1.4562268182224565 Energy: 1.4932643112366146 Energy: 1.6553070169934778 Energy: 1.4824516710881792 Energy: 1.4807331602289477 Energy: 1.598267485449174 Energy: 1.5006656102839944 Energy: 1.4824516710918412 Energy: 1.4807331602289477 Energy: 1.6211925012400448 Energy: 1.4913414621187644 Energy: 1.522735318213476 Energy: 1.4985507817690975 Energy: 1.5144443397417073 Energy: 1.4913414621663699 Energy: 1.522735318228124 Energy: 1.5709216301387852 Energy: 1.4597069282062864 Energy: 1.484265486215208 Energy: 1.5250287233918445 Energy: 1.5034791064968027 Energy: 1.4597069282099484 Energy: 1.4842654862188702 Energy: 1.5250287233991684 minimum gb energy = 1.4454703082980962 eV minimum distance = 2.22085836457174 Angstroms sigma value = 311 ======================================== theta = 32.20422750397202 ======================================== Energy: 1.569140574020906 Energy: 1.501531051351948 Energy: 1.6164909950368427 Energy: 1.501659762249995 Energy: 1.5691405740137176 Energy: 1.5015310513536393 Energy: 1.5949927224035376 Energy: 1.5477718558873637 Energy: 1.528911704918999 Energy: 1.5733121642505365 Energy: 1.5403031701292456 Energy: 1.5477718558835578 Energy: 1.5289117049215362 Energy: 1.5733121642564567 Energy: 1.5216373629032085 Energy: 1.4797235666419888 Energy: 1.6228801357559095 Energy: 1.5197580799010206 Energy: 1.5216373629112425 Energy: 1.479723566639452 Energy: 1.6163728335413485 Energy: 1.5131154086342529 Energy: 1.4964294268367357 Energy: 1.627366210129379 Energy: 1.4900781808378016 Energy: 1.513115408631293 Energy: 1.4964294268333533 Energy: 1.6273662101306476 Energy: 1.5461138204153089 Energy: 1.51688629167114 Energy: 1.6087972321781356 Energy: 1.528974280445911 Energy: 1.546113820414463 Energy: 1.5168862916779058 Energy: 1.6369986050999055 Energy: 1.4979913965186684 Energy: 1.4941850915036397 Energy: 1.5563136204552128 Energy: 1.4793602667489196 Energy: 1.4979913965190912 Energy: 1.494185091497297 Energy: 1.5563136204535215 Energy: 1.4964911039015192 Energy: 1.5106860891623901 Energy: 1.5282858093036042 Energy: 1.5297633201739917 Energy: 1.4964911038947537 Energy: 1.5106860891632359 Energy: 1.5338260244931339 Energy: 1.498287478950348 Energy: 1.5119305844001605 Energy: 1.6067489904921353 Energy: 1.5259521135828693 Energy: 1.4982874789465421 Energy: 1.511930584401006 Energy: 1.606748990493827 Energy: 1.5218705344951449 Energy: 1.5219196901403824 Energy: 1.5655558524955253 Energy: 1.5338796872729106 Energy: 1.521870534497682 Energy: 1.521919690143765 Energy: 1.5655558524828397 Energy: 1.5028103574208433 Energy: 1.530143136332305 Energy: 1.6373802162893225 Energy: 1.50930010246998 Energy: 1.5028103574149234 Energy: 1.5301431363327278 Energy: 1.6373802162872082 Energy: 1.5739597877588565 Energy: 1.5205339599664953 Energy: 1.557893770988816 Energy: 1.490820794279951 Energy: 1.5739597877499771 Energy: 1.5205339599677639 Energy: 1.5578937709905076 Energy: 1.570045993764628 Energy: 1.5395096210906278 Energy: 1.5694294969245912 Energy: 1.5511709434526977 Energy: 1.5700459937790046 Energy: 1.5395096210982007 Energy: 1.5694294969271285 Energy: 1.5553507004295752 Energy: 1.5187905981992944 Energy: 1.5977486054198953 Energy: 1.5323054001115965 Energy: 1.5553507004295752 Energy: 1.518790598200563 Energy: 1.5977486054080556 Energy: 1.5417466257318748 Energy: 1.5457680117155066 Energy: 1.5601884999626383 Energy: 1.5516190154578082 Energy: 1.541746625731452 Energy: 1.5457680117104327 Energy: 1.560188499963061 Energy: 1.5749665585817407 Energy: 1.5055453947125819 Energy: 1.5943905596752983 Energy: 1.5187921437523935 Energy: 1.5749665585813175 Energy: 1.5055453947138506 Energy: 1.5943905596685328 Energy: 1.5641832589613867 Energy: 1.551428946269852 Energy: 1.5777590245816595 Energy: 1.5401474169477134 Energy: 1.5641832589647695 Energy: 1.551428946265201 Energy: 1.5777590245757394 Energy: 1.5738741112499077 Energy: 1.504925639279088 Energy: 1.557895215974909 Energy: 1.4989162697644043 Energy: 1.5738741112554044 Energy: 1.5049256392862762 Energy: 1.5578952159808288 Energy: 1.5028155275653814 Energy: 1.5107945736214812 Energy: 1.5360838671684152 Energy: 1.5276817081682241 Energy: 1.5028155275641126 Energy: 1.5107945736345896 Energy: 1.5360838671709525 Energy: 1.4966010235515823 Energy: 1.5109906374433395 Energy: 1.5165777425130733 Energy: 1.511745291139949 Energy: 1.4966010235579248 Energy: 1.5109906374403796 Energy: 1.516577742509691 Energy: 1.4982310009492221 Energy: 1.5063179002658689 Energy: 1.6059757667465364 Energy: 1.5171868322003634 Energy: 1.4982310009483764 Energy: 1.506317900265446 Energy: 1.605975766753302 Energy: 1.496554114509054 Energy: 1.5312346711789022 Energy: 1.570036366403255 Energy: 1.5094095187600678 Energy: 1.4965541145191639 Energy: 1.5312346711822469 Energy: 1.5700363663990267 Energy: 1.49772749170824 Energy: 1.514264544970805 Energy: 1.5551366855192221 Energy: 1.4808557672007403 Energy: 1.497727491706126 Energy: 1.5142645449839132 Energy: 1.5551366855204907 Energy: 1.5459466967416848 Energy: 1.5183070283693452 Energy: 1.4762343886944536 Energy: 1.5169358082030504 Energy: 1.5459466967454907 Energy: 1.5183070283761109 Energy: 1.4762343886974139 Energy: 1.4974228246853027 Energy: 1.4941263838698704 Energy: 1.6290576355943978 Energy: 1.508913324045927 Energy: 1.4974228246899544 Energy: 1.494126383856762 Energy: 1.629057635601586 Energy: 1.521155799550598 Energy: 1.5186692498912335 Energy: 1.6005065372926661 Energy: 1.5450538210952094 Energy: 1.5211557995577867 Energy: 1.5186692498895422 Energy: 1.600506537289706 Energy: 1.5605288741476913 Energy: 1.4955170533510167 Energy: 1.5559211325854987 Energy: 1.528855950272043 Energy: 1.5605288741464227 Energy: 1.4955170533565136 Energy: 1.5559211325825386 Energy: 1.5811573194188422 Energy: 1.5016270547571737 Energy: 1.6036757048165424 Energy: 1.5027892734533197 Energy: 1.5811573194264537 Energy: 1.5016270547622474 Energy: 1.603675704821194 Energy: 1.5553890807106492 Energy: 1.5406146190151022 Energy: 1.5430913987466501 Energy: 1.49895361740507 Energy: 1.5553890807051522 Energy: 1.5406146190193306 Energy: 1.5430913987381931 Energy: 1.4967589810909059 Energy: 1.5156131386804481 Energy: 1.621717336308671 Energy: 1.5189866674068107 Energy: 1.4967589810913289 Energy: 1.5156131386875982 Energy: 1.6217173363162818 Energy: 1.497447802511172 Energy: 1.5070260907552442 Energy: 1.586019652861119 Energy: 1.4851904857087912 Energy: 1.4974478025099034 Energy: 1.5070260907548212 Energy: 1.5860196528615416 Energy: 1.5460937575090905 Energy: 1.5168443851494278 Energy: 1.5968377722410025 Energy: 1.51978418719063 Energy: 1.5460937575086677 Energy: 1.5168443851435078 Energy: 1.5968377722405793 Energy: 1.4979171036228371 Energy: 1.4807232272801292 Energy: 1.551527833707948 Energy: 1.5256590282117237 Energy: 1.4979171036143804 Energy: 1.4807232272881248 Energy: 1.5515278337151364 Energy: 1.4965921397187236 Energy: 1.5331805628645085 Energy: 1.5773667184318114 Energy: 1.531230885338318 Energy: 1.4965921397107278 Energy: 1.5331805628700055 Energy: 1.577366718425469 Energy: 1.4981507471079507 Energy: 1.5114233786289744 Energy: 1.5914372592200465 Energy: 1.5068217793591003 Energy: 1.4981507471087967 Energy: 1.5114233786230546 Energy: 1.5914372592276578 Energy: 1.4967235397101881 Energy: 1.5219218155180063 Energy: 1.5590742892632063 Energy: 1.5167864412663759 Energy: 1.496723539715262 Energy: 1.521921815521812 Energy: 1.5590742892627836 Energy: 1.5025904525150897 Energy: 1.5301758912666905 Energy: 1.6187292119603132 Energy: 1.50920156025166 Energy: 1.5025904525117069 Energy: 1.5301758912599248 Energy: 1.6187292119624275 minimum gb energy = 1.4762343886944536 eV minimum distance = 2.24400001088923 Angstroms sigma value = 39 ======================================== theta = 38.21321070173819 ======================================== Energy: 1.5067291578365207 Energy: 1.5419197954590949 Energy: 1.5908179241134135 Energy: 1.542023631801642 Energy: 1.5067291578494957 Energy: 1.5419197954531065 Energy: 1.5722753557820008 Energy: 1.4895879243850758 Energy: 1.5086384739378165 Energy: 1.4216917962652953 Energy: 1.5064180204674353 Energy: 1.4895879244100279 Energy: 1.5086384739497933 Energy: 1.4216917962523206 Energy: 1.5065185372111856 Energy: 1.4130903706241589 Energy: 1.5418891181041356 Energy: 1.4976752824614836 Energy: 1.5065185372311474 Energy: 1.4130903706331415 Energy: 1.5418891181041356 Energy: 1.5011359646304823 Energy: 1.500937768893849 Energy: 1.421652811316246 Energy: 1.5358874769342388 Energy: 1.5011359646359719 Energy: 1.5009377689018335 Energy: 1.4216528113077624 Energy: 1.5893390326604115 Energy: 1.4974470607604042 Energy: 1.4944847274296025 Energy: 1.4977282917240946 Energy: 1.5893390326594135 Energy: 1.4974470607449337 Energy: 1.4859743729481545 Energy: 1.501138363673454 Energy: 1.498508996045992 Energy: 1.596229512866683 Energy: 1.5285568944071952 Energy: 1.5011383636689626 Energy: 1.498508996063912 Energy: 1.5962295128646868 Energy: 1.6088702719925727 Energy: 1.4976421803719981 Energy: 1.4752074801491246 Energy: 1.4969654383731017 Energy: 1.6088702719751065 Energy: 1.497642180371 Energy: 1.5174406850771678 Energy: 1.4901600403666138 Energy: 1.4215455429209367 Energy: 1.6487551417508726 Energy: 1.421579696029067 Energy: 1.4901600403785908 Energy: 1.4215455429314166 Energy: 1.6487551417498745 Energy: 1.6098565661958608 Energy: 1.4971283089936185 Energy: 1.5443576925236697 Energy: 1.497898797315771 Energy: 1.6098565661993542 Energy: 1.4971283090045973 Energy: 1.561326013109141 Energy: 1.5010810036217053 Energy: 1.5283884240202787 Energy: 1.5961232590170054 Energy: 1.4991588950332397 Energy: 1.5010810036271947 Energy: 1.5283884240013152 Energy: 1.5961232590249903 Energy: 1.5880005970497302 Energy: 1.497952301897815 Energy: 1.466206958021881 Energy: 1.4974759131755149 Energy: 1.5880005970422448 Energy: 1.4979523019322487 Energy: 1.4660262629293679 Energy: 1.50148887223945 Energy: 1.5362043548191824 Energy: 1.4215604136543623 Energy: 1.5012540636047342 Energy: 1.5014888722224826 Energy: 1.536204354826668 Energy: 1.4215604136742783 Energy: 1.5069262566162296 Energy: 1.4978273434372766 Energy: 1.5060404996931769 Energy: 1.4131481434101554 Energy: 1.5069262566092885 Energy: 1.4978273434592342 Energy: 1.495034902194609 Energy: 1.4892110296272099 Energy: 1.507164297234746 Energy: 1.4214998322990116 Energy: 1.5087813432405177 Energy: 1.4892110296331984 Energy: 1.5071642972162815 Energy: 1.421499832278551 Energy: 1.5067291578335265 Energy: 1.5419197954580968 Energy: 1.5736453430089643 Energy: 1.5420236318070861 Energy: 1.5067291578460025 Energy: 1.5419197954546036 Energy: 1.5637126200109748 Energy: 1.489587924386074 Energy: 1.508638473933824 Energy: 1.4216917962652953 Energy: 1.5064180204649402 Energy: 1.4895879244085308 Energy: 1.5086384739438048 Energy: 1.421691796257311 Energy: 1.5065185372086907 Energy: 1.4130903706191682 Energy: 1.5418891181051337 Energy: 1.4976752824584894 Energy: 1.5065185372366365 Energy: 1.413090370629648 Energy: 1.5418891181021395 Energy: 1.5011359646324784 Energy: 1.5009377688948473 Energy: 1.4216528113122537 Energy: 1.5358874769307456 Energy: 1.5011359646344749 Energy: 1.5009377688993386 Energy: 1.4216528113057663 Energy: 1.5893390326519279 Energy: 1.4974470607628991 Energy: 1.4950372201186621 Energy: 1.4977282917191492 Energy: 1.5893390326499317 Energy: 1.4974470607509225 Energy: 1.4950372201406197 Energy: 1.5011383636714577 Energy: 1.4985089960489866 Energy: 1.596229512866184 Energy: 1.5285568944121857 Energy: 1.501138363673953 Energy: 1.498508996061417 Energy: 1.5962295128626907 Energy: 1.608870271998062 Energy: 1.4976421803719981 Energy: 1.4775750340506255 Energy: 1.4969654383740998 Energy: 1.6088702719820929 Energy: 1.497642180371 Energy: 1.477575034055117 Energy: 1.490160040369109 Energy: 1.4215455429214354 Energy: 1.6487551417518707 Energy: 1.421579696030065 Energy: 1.4901600403855322 Energy: 1.4215455429314166 Energy: 1.6487551417463813 Energy: 1.609856566196859 Energy: 1.4971283089926204 Energy: 1.4934451094880838 Energy: 1.4978987973122775 Energy: 1.6098565662108322 Energy: 1.4971283089981098 Energy: 1.5472454674956508 Energy: 1.5010810036276936 Energy: 1.528388424015787 Energy: 1.5961232590085217 Energy: 1.4991588950357349 Energy: 1.5010810036286917 Energy: 1.5283884239993188 Energy: 1.5961232590145102 Energy: 1.5880005970497302 Energy: 1.4979523018993122 Energy: 1.4236532007431943 Energy: 1.4974759131785091 Energy: 1.5880005970277726 Energy: 1.4979523019252619 Energy: 1.423653200760661 Energy: 1.5014888722399489 Energy: 1.5362043548186832 Energy: 1.4215604136608044 Energy: 1.5012540636062317 Energy: 1.5014888722264748 Energy: 1.536204354823674 Energy: 1.4215604136752764 Energy: 1.5069262566097872 Energy: 1.4978273434382747 Energy: 1.5322784127985762 Energy: 1.4131481434041673 Energy: 1.506926256603799 Energy: 1.4978273434567388 Energy: 1.5322784128080578 Energy: 1.4892110296222194 Energy: 1.5071642972362431 Energy: 1.4214998322975143 Energy: 1.508781343243512 Energy: 1.4892110296272099 Energy: 1.5071642972252643 Energy: 1.4214998322760557 Energy: 1.5067291578370197 Energy: 1.5419197954575978 Energy: 1.5735173217629626 Energy: 1.542023631801143 Energy: 1.5067291578489967 Energy: 1.5419197954531065 Energy: 1.5758490436073012 Energy: 1.489587924385575 Energy: 1.5086384739403118 Energy: 1.4216917962628004 Energy: 1.5064180204664372 Energy: 1.489587924412024 Energy: 1.5086384739512904 Energy: 1.4216917962533187 minimum gb energy = 1.4130903706191682 eV minimum distance = 2.27219722451276 Angstroms sigma value = 21 ======================================== theta = 46.82644889274107 ======================================== Energy: 1.5678434945811073 Energy: 1.5938115661485026 Energy: 1.6064773804742611 Energy: 1.594236743008824 Energy: 1.5678434945768664 Energy: 1.593811566143656 Energy: 1.6064773804754726 Energy: 1.5854259869027343 Energy: 1.4990911478786295 Energy: 1.4087794609373758 Energy: 1.498980349913976 Energy: 1.5854259868954645 Energy: 1.4990911478883227 Energy: 1.4087794609337412 Energy: 1.5689672680368705 Energy: 1.4757001727408452 Energy: 1.5237776909216085 Energy: 1.4932392502502716 Energy: 1.5689672680271773 Energy: 1.4757001727408452 Energy: 1.52377769090952 Energy: 1.5780248784762478 Energy: 1.4989909221550326 Energy: 1.4604386168353467 Energy: 1.4992907963578526 Energy: 1.5780248784877307 Energy: 1.498990922145973 Energy: 1.4604386168523094 Energy: 1.5043891795935587 Energy: 1.442952673251077 Energy: 1.5009784649396707 Energy: 1.4436820712309333 Energy: 1.5043891795923474 Energy: 1.4429526732419897 Energy: 1.5312829410042295 Energy: 1.5778379143996633 Energy: 1.451540150700711 Energy: 1.5425336644778604 Energy: 1.499871047621129 Energy: 1.5778379143845178 Energy: 1.451540150707981 Energy: 1.542533664468773 Energy: 1.566470320880554 Energy: 1.4430589648188776 Energy: 1.5010862026889817 Energy: 1.5231095861404436 Energy: 1.5664703208938815 Energy: 1.4430589648200893 Energy: 1.5312548827061079 Energy: 1.5692700309244534 Energy: 1.4997613140736932 Energy: 1.5515918560649942 Energy: 1.4995882843239654 Energy: 1.5692700309196068 Energy: 1.4997613140821469 Energy: 1.5515918560553286 Energy: 1.5663176937201142 Energy: 1.5003203889098626 Energy: 1.5214129764956024 Energy: 1.5250474920035182 Energy: 1.5663176937164793 Energy: 1.5003203889104688 Energy: 1.5214129765161726 Energy: 1.555960567520233 Energy: 1.5160472057456722 Energy: 1.5171148102326721 Energy: 1.4992971255294518 Energy: 1.555960567507539 Energy: 1.5160472057595782 Energy: 1.5171148102326721 Energy: 1.5700944693906835 Energy: 1.5148506489090663 Energy: 1.537318270245897 Energy: 1.5076142813973865 Energy: 1.5700944693906835 Energy: 1.5148506489181532 Energy: 1.537318270251349 Energy: 1.4255966957260415 Energy: 1.4442695611488874 Energy: 1.495794967665844 Energy: 1.4447444871007031 Energy: 1.4255966957230124 Energy: 1.4442695611464644 Energy: 1.4957949676743254 Energy: 1.5693961663615046 Energy: 1.5085541729294707 Energy: 1.5307596871461044 Energy: 1.500058698423582 Energy: 1.5693961663584757 Energy: 1.508554172921623 Energy: 1.5307596871309592 Energy: 1.42560661468161 Energy: 1.444108980127921 Energy: 1.5403413047649273 Energy: 1.4431974266829728 Energy: 1.4256066146694937 Energy: 1.444108980111564 Energy: 1.540341304778861 Energy: 1.587730343645746 Energy: 1.4470395691560982 Energy: 1.4965120089353723 Energy: 1.500070100699704 Energy: 1.5877303436505923 Energy: 1.4470395691657914 Energy: 1.4965120089305257 Energy: 1.4257171931297792 Energy: 1.5856211356604972 Energy: 1.5124402708982745 Energy: 1.516379573407235 Energy: 1.425717193126144 Energy: 1.5856211356556507 Energy: 1.5124402708922162 Energy: 1.5871837604706858 Energy: 1.4442729462054327 Energy: 1.548604453633724 Energy: 1.5000872041608369 Energy: 1.587183760467657 Energy: 1.4442729462199722 Energy: 1.5486044536397823 Energy: 1.425862081210229 Energy: 1.5118353521844416 Energy: 1.5142362313027686 Energy: 1.511167374147646 Energy: 1.4258620811999303 Energy: 1.511835352176566 Energy: 1.5142362313021631 Energy: 1.567453311343125 Energy: 1.4471442351363348 Energy: 1.598443626906264 Energy: 1.5001350303720018 Energy: 1.5674533113528177 Energy: 1.4471442351320942 Energy: 1.598443626897177 Energy: 1.4258740255182238 Energy: 1.5702474283288506 Energy: 1.5075478146291519 Energy: 1.5700491380090962 Energy: 1.4258740255164062 Energy: 1.5702474283385437 Energy: 1.5075478146364216 Energy: 1.5673729488344388 Energy: 1.5000216229173278 Energy: 1.5982299968792515 Energy: 1.4470870895999322 Energy: 1.5673729488392578 Energy: 1.5000216229149321 Energy: 1.5982299968768283 Energy: 1.4258449038519265 Energy: 1.511290674154459 Energy: 1.5142353361623517 Energy: 1.5118557866509827 Energy: 1.425844903841628 Energy: 1.5112906741484007 Energy: 1.514235336150263 Energy: 1.5875736627515415 Energy: 1.500022526703039 Energy: 1.54862834052332 Energy: 1.4444248853071668 Energy: 1.5875736627515415 Energy: 1.5000225267115204 Energy: 1.5486283405281394 Energy: 1.4257057007709526 Energy: 1.5164524972006488 Energy: 1.5124664885878698 Energy: 1.5851994052205076 Energy: 1.4257057007655003 Energy: 1.5164524971849254 Energy: 1.5124664885933223 Energy: 1.587704014236226 Energy: 1.5000927174488718 Energy: 1.4585345631007962 Energy: 1.445082072434583 Energy: 1.5877040142471308 Energy: 1.5000927174470544 Energy: 1.4585345631001905 minimum gb energy = 1.4087794609337412 eV minimum distance = 2.26507324379062 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 1.4754537349012649 Energy: 1.6169952463419253 Energy: 1.4825804152447337 Energy: 1.6170802332795282 Energy: 1.475453734908027 Energy: 1.6169952463554493 Energy: 1.5279753337141742 Energy: 1.5739761667304901 Energy: 1.5456379125070667 Energy: 1.4188524868398829 Energy: 1.5450626975957746 Energy: 1.5739761667338712 Energy: 1.5456379125408155 Energy: 1.4188524868466448 Energy: 1.4760228338993446 Energy: 1.5387434366948962 Energy: 1.5016603935168291 Energy: 1.5040120849043204 Energy: 1.4760228338925825 Energy: 1.538743436684753 Energy: 1.5016603935066857 Energy: 1.4324467257180147 Energy: 1.5456885743495323 Energy: 1.4270099200228399 Energy: 1.545982846203199 Energy: 1.432446725731539 Energy: 1.5456885743293076 Energy: 1.4270099200126969 Energy: 1.5286292355936502 Energy: 1.441763359207811 Energy: 1.4839437266038429 Energy: 1.4373063526671324 Energy: 1.5286292356206985 Energy: 1.4417633592111923 Energy: 1.483943726610605 Energy: 1.4329502396623996 Energy: 1.471840274084782 Energy: 1.5147170218823205 Energy: 1.4736897815961463 Energy: 1.432950239675924 Energy: 1.471840274098306 Energy: 1.5147170219127497 Energy: 1.433684751552336 Energy: 1.4311749595656185 Energy: 1.5294102575104638 Energy: 1.4495740128192627 Energy: 1.4336847515388118 Energy: 1.4311749595520942 Energy: 1.5294102575104638 Energy: 1.4348663637317751 Energy: 1.4807459441875848 Energy: 1.5264464495058376 Energy: 1.4603411631168752 Energy: 1.4348663637317751 Energy: 1.4807459441808226 Energy: 1.5264464494889327 Energy: 1.4331762966536452 Energy: 1.4341485047454388 Energy: 1.5469463609609815 Energy: 1.422038764607165 Energy: 1.4331762966265973 Energy: 1.4341485046981046 Energy: 1.556846299424078 Energy: 1.4216572984065377 Energy: 1.4806366513838227 Energy: 1.4619779041340208 Energy: 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1.4727973479328071 Energy: 1.4517014538748712 Energy: 1.4643907197237842 Energy: 1.4848641962144533 Energy: 1.4727973479395076 Energy: 1.451701453861347 Energy: 1.4643907197339272 Energy: 1.4224641074979973 Energy: 1.4451223911603481 Energy: 1.5140372274262375 Energy: 1.4627194282160014 Energy: 1.4224641075013786 Energy: 1.445122391140062 Energy: 1.514037227436381 Energy: 1.4732221429448646 Energy: 1.4497961063782228 Energy: 1.4797710908744497 Energy: 1.5453827158165985 Energy: 1.4732221429448646 Energy: 1.4497961063444127 Energy: 1.4797710908575445 Energy: 1.4316735975281676 Energy: 1.4588061717607241 Energy: 1.5615769929289542 Energy: 1.463106458988221 Energy: 1.4316735975349295 Energy: 1.4588061717708674 Energy: 1.5615769929221923 Energy: 1.4722230481356031 Energy: 1.5314312328504298 Energy: 1.5209668458451437 Energy: 1.6246768961638496 Energy: 1.4722230481186982 Energy: 1.5314312328233814 Energy: 1.520966845828239 Energy: 1.452621457001734 Energy: 1.52526917312922 Energy: 1.6715412072923295 Energy: 1.4536263886121605 Energy: 1.452621456998353 Energy: 1.5252691731190768 Energy: 1.6715412072754243 Energy: 1.6340798812472017 Energy: 1.5265677826668922 Energy: 1.5104198319938789 Energy: 1.6163639538006436 Energy: 1.6340798812336776 Energy: 1.5265677826567488 Energy: 1.5104198319871165 Energy: 1.4688176702396387 Energy: 1.609886923656606 Energy: 1.6721983438662065 Energy: 1.534048634800008 Energy: 1.4688176702396387 Energy: 1.609886923663368 Energy: 1.6721983438729686 Energy: 1.633659401153009 Energy: 1.5266345232438285 Energy: 1.4583554069307136 Energy: 1.6163948868783193 Energy: 1.633659401153009 Energy: 1.5266345232505907 Energy: 1.458355406978048 Energy: 1.4694353950154266 Energy: 1.5309119794887236 Energy: 1.5924869894879168 Energy: 1.4397781806571275 Energy: 1.469435395008664 Energy: 1.5309119794684987 Energy: 1.592486989477774 Energy: 1.451299095974884 Energy: 1.5267597708480922 Energy: 1.49908161483699 Energy: 1.6247848843263173 Energy: 1.4512990959545975 Energy: 1.526759770868378 Energy: 1.4990816147930368 Energy: 1.469371755161274 Energy: 1.4588657710398474 Energy: 1.5119198028011644 Energy: 1.4658052066614427 Energy: 1.4693717551477499 Energy: 1.4588657710364665 Energy: 1.5119198028248315 Energy: 1.4514379481003106 Energy: 1.4533055871378147 Energy: 1.5882489609918014 Energy: 1.5160275240605132 Energy: 1.4514379481070725 Energy: 1.4533055871141474 Energy: 1.5882489609648147 Energy: 1.4860700815204242 Energy: 1.4588181079497613 Energy: 1.5408560546284784 Energy: 1.4758972580982435 Energy: 1.486070081517043 Energy: 1.4588181079599043 Energy: 1.5408560546352403 Energy: 1.4916555184474385 Energy: 1.4505490911869672 Energy: 1.5833249692492586 Energy: 1.5155266200808855 Energy: 1.4916555184372953 Energy: 1.450549091173443 Energy: 1.5833249692864497 Energy: 1.4865899721312157 Energy: 1.4583197742919487 Energy: 1.575901475790581 Energy: 1.4510626089973864 Energy: 1.486589972148121 Energy: 1.4583197742851868 Energy: 1.5759014758040433 Energy: 1.491638502290696 Energy: 1.4335029240251067 Energy: 1.500880286111175 Energy: 1.531083378935246 Energy: 1.491638502314363 Energy: 1.4335029239879773 Energy: 1.500880286138223 Energy: 1.4888266758092266 Energy: 1.458151948759542 Energy: 1.5525768065115444 Energy: 1.4509832818590345 Energy: 1.488826675836275 Energy: 1.4581519487392556 Energy: 1.5525768065757224 Energy: 1.4915808254702834 Energy: 1.5172791911192922 Energy: 1.5166114972536973 Energy: 1.5154228234871072 Energy: 1.4915808254702834 Energy: 1.5172791911564831 Energy: 1.5166114972503162 Energy: 1.48873851090989 Energy: 1.5172372881845153 Energy: 1.5555939265174414 Energy: 1.4710580859026587 Energy: 1.4887385109707485 Energy: 1.5172372881574672 Energy: 1.5555939265208225 Energy: 1.5335998884776485 Energy: 1.515515902929785 Energy: 1.4836750665451235 Energy: 1.5152533719950474 Energy: 1.5335998884641246 Energy: 1.5155159029196419 Energy: 1.4836750665687908 Energy: 1.488802051230311 Energy: 1.4896601571930335 Energy: 1.646813059078129 Energy: 1.5165250793104879 Energy: 1.4888020512066436 Energy: 1.4896601571795711 Energy: 1.646813059078129 Energy: 1.464741713383446 Energy: 1.5135539086547782 Energy: 1.4699266138642149 Energy: 1.514547263813414 Energy: 1.4647417133868266 Energy: 1.5135539086614787 Energy: 1.4699266138506908 Energy: 1.4897322391274381 Energy: 1.4811713027870255 Energy: 1.6203846505064794 Energy: 1.4154952778308898 Energy: 1.4897322391003904 Energy: 1.4811713028039306 Energy: 1.6203846504997175 Energy: 1.3976104726283838 Energy: 1.5111074744682442 Energy: 1.4722831677594221 Energy: 1.5393483684479972 Energy: 1.3976104726114784 Energy: 1.5111074744750064 Energy: 1.4722831677796469 minimum gb energy = 1.3976104726114784 eV minimum distance = 2.2722343081552 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 1.413951431532397 Energy: 1.2647065172811456 Energy: 1.1908351659831735 Energy: 1.264706517284957 Energy: 1.4139514315339219 Energy: 1.2647065172834324 Energy: 1.3439750160367736 Energy: 1.413951431531635 Energy: 1.2647065172788587 Energy: 1.6412578075288202 Energy: 1.2647065172758094 Energy: 1.4139514315301103 Energy: 1.2647065172780962 Energy: 1.343975016045159 Energy: 1.413951431529348 Energy: 1.264706517281908 Energy: 1.2270114368745921 Energy: 1.2647065172773342 Energy: 1.413951431529348 Energy: 1.2647065172780962 Energy: 1.4312276838341211 Energy: 1.413951431529348 Energy: 1.2647065172826701 Energy: 1.343975016060405 Energy: 1.264706517284195 Energy: 1.4139514315392578 Energy: 1.2647065172864818 Energy: 1.3439750160474455 Energy: 1.4139514315301103 Energy: 1.2647065172788587 Energy: 1.3752206062834582 Energy: 1.2647065172750473 Energy: 1.4139514315270612 Energy: 1.2647065172788587 Energy: 1.3439750160466837 Energy: 1.4139514315308725 Energy: 1.264706517284195 Energy: 1.4463732019728424 Energy: 1.2647065172811456 Energy: 1.4139514315308725 Energy: 1.2647065172773342 Energy: 1.4312276838348834 Energy: 1.413951431531635 Energy: 1.2647065172826701 Energy: 1.343975016060405 Energy: 1.2647065172826701 Energy: 1.4139514315354464 Energy: 1.2647065172864818 Energy: 1.4341740531231548 Energy: 1.4139514315339219 Energy: 1.264706517279621 Energy: 1.4438116269464287 Energy: 1.2647065172773342 Energy: 1.4139514315331594 Energy: 1.264706517281908 Energy: 1.3439750160474455 Energy: 1.4139514315285855 Energy: 1.2647065172803833 Energy: 1.433539720215174 Energy: 1.264706517279621 Energy: 1.4139514315262989 Energy: 1.264706517276572 Energy: 1.4312276838402198 Energy: 1.4139514315331594 Energy: 1.2647065172826701 Energy: 1.3439750160573556 Energy: 1.2647065172864818 Energy: 1.4139514315339219 Energy: 1.264706517284957 Energy: 1.3439750160474455 Energy: 1.4139514315308725 Energy: 1.2647065172788587 Energy: 1.4438116269540517 Energy: 1.2647065172773342 Energy: 1.4139514315285855 Energy: 1.2647065172803833 Energy: 1.3439750160421098 Energy: 1.4139514315278234 Energy: 1.264706517284957 Energy: 1.4312276838447933 Energy: 1.2647065172811456 Energy: 1.4139514315270612 Energy: 1.2647065172773342 Energy: 1.4312276838348834 Energy: 1.4139514315278234 Energy: 1.2647065172803833 Energy: 1.3439750160596424 Energy: 1.264706517284957 Energy: 1.4139514315331594 Energy: 1.2647065172864818 Energy: 1.3439750160390607 Energy: 1.413951431531635 Energy: 1.2647065172803833 Energy: 1.3439750160390607 Energy: 1.264706517276572 Energy: 1.413951431529348 Energy: 1.2647065172803833 Energy: 1.3439750160436341 Energy: 1.4139514315278234 Energy: 1.2647065172834324 Energy: 1.343975016040585 Energy: 1.2647065172773342 Energy: 1.4139514315301103 Energy: 1.264706517279621 Energy: 1.3439750160520196 Energy: 1.413951431529348 Energy: 1.264706517284957 Energy: 1.3439750160543065 Energy: 1.264706517284957 Energy: 1.4139514315362087 Energy: 1.2647065172864818 Energy: 1.343975016048208 Energy: 1.4139514315308725 Energy: 1.2647065172788587 Energy: 1.343975016037536 Energy: 1.2647065172742848 Energy: 1.413951431529348 Energy: 1.2647065172780962 Energy: 1.3439750160459212 Energy: 1.4139514315301103 Energy: 1.2647065172826701 Energy: 1.343975016040585 Energy: 1.2647065172811456 Energy: 1.4139514315346842 Energy: 1.2647065172780962 Energy: 1.3439750160543065 Energy: 1.413951431532397 Energy: 1.264706517281908 Energy: 1.3439750160581179 Energy: 1.264706517284195 Energy: 1.4139514315362087 Energy: 1.264706517284957 Energy: 1.3439750160421098 Energy: 1.4139514315354464 Energy: 1.2647065172780962 Energy: 1.3439750160390607 Energy: 1.2647065172780962 Energy: 1.4139514315308725 Energy: 1.2647065172826701 Energy: 1.3439750160489705 minimum gb energy = 1.1908351659831735 eV minimum distance = 2.36152206516991 Angstroms sigma value = 23