Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_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=3.523954182863236 cohesive_energy=4.432448362714347 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: 0.02209769237411409 Energy: 0.6284844668452515 Energy: 0.38511775819835303 Energy: 0.6286012640549027 Energy: 0.02209769237411409 Energy: 0.6284844668452515 Energy: 0.38511775819835303 Energy: 0.6860115935529809 Energy: 0.022337905654810933 Energy: 0.3589541743194794 Energy: 0.022325030853912194 Energy: 0.6860115935529809 Energy: 0.022337905654810933 Energy: 0.3589541743194794 Energy: 0.02209769237411409 Energy: 0.6284844668452515 Energy: 0.38511775819835303 Energy: 0.6286012640549027 Energy: 0.02209769237411409 Energy: 0.6284844668452515 Energy: 0.38511775819835303 Energy: 0.6860115935529809 Energy: 0.02233790565744568 Energy: 0.3589541743194794 Energy: 0.022325030853912194 Energy: 0.6860115935529809 Energy: 0.022337905654810933 Energy: 0.3589541743194794 Energy: 0.02209769237411409 Energy: 0.6284844668452515 Energy: 0.38511775819835303 Energy: 0.6286012640549027 Energy: 0.02209769237147935 Energy: 0.6284844668452515 Energy: 0.38511775819835303 Energy: 0.6860115935529809 Energy: 0.02233790565744568 Energy: 0.3589541743194794 Energy: 0.022325030853912194 Energy: 0.6860115935529809 Energy: 0.022337905654810933 Energy: 0.3589541743194794 minimum gb energy = 0.02209769237147935 eV minimum distance = 2.4718722476749 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 1.341497718778697 Energy: 1.251882163580457 Energy: 1.3494824796661924 Energy: 1.252178069296624 Energy: 1.3414977187883537 Energy: 1.251882163577238 Energy: 1.349482479675849 Energy: 1.255836436459133 Energy: 1.2676133129510767 Energy: 1.3053783868169695 Energy: 1.2690519659800608 Energy: 1.2558364364301635 Energy: 1.2676133129607332 Energy: 1.3053783868201885 Energy: 1.2351101644528868 Energy: 1.2343451344015033 Energy: 1.3437879052824357 Energy: 1.246138890073524 Energy: 1.23511016444323 Energy: 1.2343451344079412 Energy: 1.3437879052920925 Energy: 1.3369174710014264 Energy: 1.261662883878211 Energy: 1.2643820174689635 Energy: 1.2580959214619054 Energy: 1.3369174710046454 Energy: 1.261662883878211 Energy: 1.2643820174689635 Energy: 1.2483013929731317 Energy: 1.2270221952574787 Energy: 1.3225086117023126 Energy: 1.2731890939723627 Energy: 1.2483013929860072 Energy: 1.2270221952510407 Energy: 1.3225086117055314 Energy: 1.2877615853447635 Energy: 1.2588891051672657 Energy: 1.2924833017559259 Energy: 1.2606420893145986 Energy: 1.2877615853415445 Energy: 1.258889105160828 Energy: 1.2924833017655826 Energy: 1.2314190531569031 Energy: 1.3003394906677426 Energy: 1.2868546148120654 Energy: 1.254076260475983 Energy: 1.2314190531762161 Energy: 1.300339490658086 Energy: 1.2992815068037082 Energy: 1.2299511281469857 Energy: 1.2329258622153032 Energy: 1.2872182395217293 Energy: 1.2329171881438905 Energy: 1.2299511281469857 Energy: 1.2329258622185222 Energy: 1.2872182395217293 Energy: 1.2159622127397667 Energy: 1.2644154763738376 Energy: 1.3315874020626006 Energy: 1.2370539934725995 Energy: 1.2159622127397667 Energy: 1.2644154763706186 Energy: 1.3315874020497251 Energy: 1.2459661605685661 Energy: 1.302580891285921 Energy: 1.2940158637042882 Energy: 1.2552485999176488 Energy: 1.245966160571785 Energy: 1.3025808912923589 Energy: 1.2940158636978507 Energy: 1.2508116808208904 Energy: 1.2514363145710259 Energy: 1.2867958000076791 Energy: 1.3139541751572732 Energy: 1.250811680814453 Energy: 1.251436314551713 Energy: 1.2867958000012412 Energy: 1.2835493084106477 Energy: 1.34475042972064 Energy: 1.2675779418597848 Energy: 1.2353529782427592 Energy: 1.283549308413867 Energy: 1.3447504297109836 Energy: 1.267577941869441 Energy: 1.3370064072045411 Energy: 1.2981481729843538 Energy: 1.2785440998142075 Energy: 1.274900218273301 Energy: 1.3370064072141976 Energy: 1.298148172981135 Energy: 1.2785440998077697 Energy: 1.2255551055789693 Energy: 1.316745244383401 Energy: 1.2950040161933087 Energy: 1.233361486306257 Energy: 1.2255551055757503 Energy: 1.3167452443898386 Energy: 1.2950040161836518 Energy: 1.2506001353481597 Energy: 1.25692468069934 Energy: 1.2942164973743155 Energy: 1.2495142402042874 Energy: 1.2506001353481597 Energy: 1.2569246806961212 Energy: 1.2942164973710968 Energy: 1.2958895053413937 Energy: 1.3036829811435853 Energy: 1.3110415636324482 Energy: 1.28027736711397 Energy: 1.295889505334956 Energy: 1.3036829811435853 Energy: 1.3110415636421047 Energy: 1.25453220514544 Energy: 1.2453980300838403 Energy: 1.2873572430831541 Energy: 1.267127847577572 Energy: 1.2545322051550967 Energy: 1.2453980300870593 Energy: 1.2873572430895917 Energy: 1.2299040284556573 Energy: 1.2255803870057225 Energy: 1.2927566030561466 Energy: 1.287975320591969 Energy: 1.2299040284428406 Energy: 1.225580386996066 Energy: 1.2927566030658029 Energy: 1.2677809676219542 Energy: 1.243098288045845 Energy: 1.321075278017167 Energy: 1.2649754626755167 Energy: 1.2677809676122977 Energy: 1.2430982880329697 Energy: 1.321075278013948 Energy: 1.2459288754983664 Energy: 1.2271598011899405 Energy: 1.2906230955730678 Energy: 1.2750022069460694 Energy: 1.2459288754822722 Energy: 1.2271598011739049 Energy: 1.2906230955634115 Energy: 1.2308206235202253 Energy: 1.2532362682415894 Energy: 1.3203002015663239 Energy: 1.2480281489718805 Energy: 1.2308206235137875 Energy: 1.2532362682480271 Energy: 1.3203002015598864 Energy: 1.2299835746645476 Energy: 1.243268936619491 Energy: 1.3436762696231055 Energy: 1.2424255882449746 Energy: 1.22998357465811 Energy: 1.2432689366033964 Energy: 1.3436762696166678 Energy: 1.2398709767276768 Energy: 1.233499837753582 Energy: 1.2754084697256494 Energy: 1.2392423782706625 Energy: 1.2398709767180205 Energy: 1.2334998377471442 Energy: 1.2754084697353056 Energy: 1.2792699073637137 Energy: 1.2683032462466788 Energy: 1.2675022846313022 Energy: 1.2634934410669172 Energy: 1.2792699073669327 Energy: 1.268303246262773 Energy: 1.2675022846313022 Energy: 1.2490663137981333 Energy: 1.3008334909271024 Energy: 1.345727854836718 Energy: 1.2453023524993911 Energy: 1.2490663137884768 Energy: 1.3008334909238837 Energy: 1.3457278548270615 Energy: 1.2568333644776943 Energy: 1.244184428758828 Energy: 1.2719884983617558 Energy: 1.2983800795342713 Energy: 1.2568333644648189 Energy: 1.2441844287717032 Energy: 1.271988498348939 Energy: 1.300921527836529 Energy: 1.2272417303359806 Energy: 1.3051135910215335 Energy: 1.2485495804793512 Energy: 1.3009215278525645 Energy: 1.2272417303359806 Energy: 1.3051135910279712 Energy: 1.3018923344785238 Energy: 1.281883953044312 Energy: 1.267043532304093 Energy: 1.2810199374202345 Energy: 1.3018923344849613 Energy: 1.2818839530539687 Energy: 1.2670435323137494 Energy: 1.292752330549267 Energy: 1.2476046007830908 Energy: 1.3365193997297609 Energy: 1.2275601000989955 Energy: 1.2927523305621422 Energy: 1.2476046007830908 Energy: 1.3365193997329794 Energy: 1.2282787686960366 Energy: 1.2417734885644474 Energy: 1.3629423922253987 Energy: 1.2681779048062998 Energy: 1.228278768683161 Energy: 1.2417734885644474 Energy: 1.362942392241493 Energy: 1.2462530016152709 Energy: 1.2514421824977215 Energy: 1.3198277159913916 Energy: 1.2574326282723634 Energy: 1.2462530016152709 Energy: 1.2514421825105966 Energy: 1.3198277159881726 Energy: 1.281178203947258 Energy: 1.2457726757394847 Energy: 1.2809924762520424 Energy: 1.257744785599228 Energy: 1.2811782039343824 Energy: 1.2457726757266092 Energy: 1.2809924762423859 Energy: 1.2499834965759382 Energy: 1.3023436257408005 Energy: 1.2626292079603545 Energy: 1.2333099083650578 Energy: 1.2499834965695005 Energy: 1.302343625750457 Energy: 1.2626292079475376 Energy: 1.256675151642949 Energy: 1.2343830737630326 Energy: 1.3405273283802603 Energy: 1.2336712127177367 Energy: 1.2566751516332926 Energy: 1.234383073756595 Energy: 1.3405273283931354 Energy: 1.2315690792449387 Energy: 1.2349397800174828 Energy: 1.2788606123177155 Energy: 1.2832751268499705 Energy: 1.2315690792513765 Energy: 1.2349397800046074 Energy: 1.2788606123273722 Energy: 1.2461816072165783 Energy: 1.3031286054752136 Energy: 1.3247779804230848 Energy: 1.2558023035212007 Energy: 1.2461816072391103 Energy: 1.303128605488089 Energy: 1.3247779804359598 Energy: 1.216042773536316 Energy: 1.2651058475911279 Energy: 1.339260886331342 Energy: 1.2416426095955675 Energy: 1.2160427735459725 Energy: 1.26510584758469 Energy: 1.339260886331342 Energy: 1.2262522821256527 Energy: 1.254857289497025 Energy: 1.3096089366903654 Energy: 1.22632783702604 Energy: 1.2262522821385282 Energy: 1.2548572895066814 Energy: 1.3096089366935844 Energy: 1.2837286092300944 Energy: 1.2721898843395882 Energy: 1.3411797019832774 Energy: 1.2544298724114566 Energy: 1.283728609239751 Energy: 1.2721898843170565 Energy: 1.341179701973621 Energy: 1.2978161930588408 Energy: 1.2572062943516198 Energy: 1.2704113304055953 Energy: 1.251639232104657 Energy: 1.2978161930652785 Energy: 1.2572062943548388 Energy: 1.2704113303927784 Energy: 1.3053727751909106 Energy: 1.2450026852513376 Energy: 1.2914263329626121 Energy: 1.3138475326513244 Energy: 1.3053727751715973 Energy: 1.2450026852513376 Energy: 1.2914263329561746 Energy: 1.299866462062175 Energy: 1.2341105862324953 Energy: 1.2958697051654249 Energy: 1.2619973868738266 Energy: 1.299866462062175 Energy: 1.2341105862260575 Energy: 1.295869705162206 Energy: 1.3364105368614903 Energy: 1.2740705747347791 Energy: 1.3115121438484343 Energy: 1.2980071461588225 Energy: 1.3364105368679282 Energy: 1.274070574747596 Energy: 1.3115121438452155 Energy: 1.2932006318804838 Energy: 1.2415385013117461 Energy: 1.2720555267052651 Energy: 1.3005869397089058 Energy: 1.293200631874046 Energy: 1.241538501337497 Energy: 1.2720555267213594 Energy: 1.215953951991011 Energy: 1.2530510772667185 Energy: 1.3137496958161619 Energy: 1.2549706438529469 Energy: 1.2159539519845732 Energy: 1.2530510772634995 Energy: 1.3137496958322563 Energy: 1.2461511321668641 Energy: 1.3076399413370143 Energy: 1.3583183403648238 Energy: 1.2621581337150949 Energy: 1.2461511321636454 Energy: 1.3076399413305766 Energy: 1.3583183403841368 Energy: 1.216176566130976 Energy: 1.2491672778438274 Energy: 1.2803562435258073 Energy: 1.2431042522837872 Energy: 1.216176566114882 Energy: 1.2491672778502652 Energy: 1.280356243516151 minimum gb energy = 1.2159539519845732 eV minimum distance = 2.19557098845708 Angstroms sigma value = 401 ======================================== theta = 27.79577249602797 ======================================== Energy: 1.2582066949831865 Energy: 1.2834424661037465 Energy: 1.3009451441396598 Energy: 1.2785625848799012 Energy: 1.2582066949831865 Energy: 1.283442466111054 Energy: 1.3009451441396598 Energy: 1.2362281826235078 Energy: 1.257414193680263 Energy: 1.3153458893547514 Energy: 1.2569658167225577 Energy: 1.2362281826235078 Energy: 1.2574141936875707 Energy: 1.3153458893547514 Energy: 1.224064884635976 Energy: 1.2586164983928718 Energy: 1.3122184323946289 Energy: 1.2540605964798246 Energy: 1.2240648846432836 Energy: 1.2586164984001793 Energy: 1.3122184323946289 Energy: 1.257884687445526 Energy: 1.2688805905148168 Energy: 1.3334946681614055 Energy: 1.2475466758260958 Energy: 1.2578846874528335 Energy: 1.2688805905221245 Energy: 1.314991678176115 Energy: 1.2580029988652488 Energy: 1.2642947636779487 Energy: 1.268410034290779 Energy: 1.2439651732927743 Energy: 1.258002998854354 Energy: 1.2642947636742952 Energy: 1.2684100342834712 Energy: 1.2237561452076446 Energy: 1.2564168582498143 Energy: 1.2777568794609238 Energy: 1.25259037179563 Energy: 1.2237561452185393 Energy: 1.2564168582425732 Energy: 1.2777568794536163 Energy: 1.2185332857673528 Energy: 1.273962859489294 Energy: 1.3167303433673465 Energy: 1.2433949363401955 Energy: 1.218533285778314 Energy: 1.273962859500255 Energy: 1.3260507175412897 Energy: 1.2185619651217752 Energy: 1.237066824796934 Energy: 1.2947736861244394 Energy: 1.2687773494838497 Energy: 1.2185619651327362 Energy: 1.237066824811549 Energy: 1.301975653793909 Energy: 1.2238606054012469 Energy: 1.24467781437422 Energy: 1.359534288179979 Energy: 1.257242013643994 Energy: 1.2238606053866319 Energy: 1.244677814377874 Energy: 1.341135734976256 Energy: 1.2582437163340705 Energy: 1.252865616606036 Energy: 1.3352030220969013 Energy: 1.2574494850467994 Energy: 1.258243716326763 Energy: 1.252865616602382 Energy: 1.3332073815931846 Energy: 1.257657604249429 Energy: 1.2882033325089146 Energy: 1.3634552439367609 Energy: 1.2572086409521435 Energy: 1.2576576042457752 Energy: 1.2882033325016071 Energy: 1.3634552439440684 Energy: 1.223990363203997 Energy: 1.2564656469449103 Energy: 1.3800399732251092 Energy: 1.2686328819316335 Energy: 1.223990363203997 Energy: 1.2564656469412565 Energy: 1.3634030973727809 Energy: 1.2452141859662254 Energy: 1.2482201945203573 Energy: 1.3940617088882863 Energy: 1.264512665717808 Energy: 1.2452141859516768 Energy: 1.2482201945276648 Energy: 1.3659525569417073 Energy: 1.2560403611033946 Energy: 1.2834424661074002 Energy: 1.310559587086309 Energy: 1.2785625848799012 Energy: 1.2560403610851258 Energy: 1.283442466111054 Energy: 1.3009451441433135 Energy: 1.2362281826271615 Energy: 1.2574141936729555 Energy: 1.3153458893547514 Energy: 1.2569952537942009 Energy: 1.2362281826235078 Energy: 1.257414193680263 Energy: 1.3153458893547514 Energy: 1.224064884635976 Energy: 1.2586164983928718 Energy: 1.3122184323946289 Energy: 1.2540605964798246 Energy: 1.2240648846396298 Energy: 1.2586164983965256 Energy: 1.3122184323946289 Energy: 1.25788468744918 Energy: 1.2651935239166263 Energy: 1.3334946681614055 Energy: 1.2475466758260958 Energy: 1.2578846874528335 Energy: 1.2651935239056653 Energy: 1.3149916781797686 Energy: 1.2580029988652488 Energy: 1.264410574342923 Energy: 1.2684100342725102 Energy: 1.2439651733000818 Energy: 1.258002998854354 Energy: 1.2644105743465768 Energy: 1.2684100342871252 Energy: 1.223752332060841 Energy: 1.2564168582498143 Energy: 1.2777568794645775 Energy: 1.2525903718029372 Energy: 1.2237523320571873 Energy: 1.2564168582425732 Energy: 1.27775687945727 Energy: 1.2185332857673528 Energy: 1.2739628594929475 Energy: 1.3034436320921348 Energy: 1.2433949363401955 Energy: 1.218533285781968 Energy: 1.273962859500255 Energy: 1.3034436320957885 Energy: 1.2185619651217752 Energy: 1.2370668248005878 Energy: 1.2874313926958627 Energy: 1.268777349480196 Energy: 1.2185619651327362 Energy: 1.237066824811549 Energy: 1.2947736861207855 Energy: 1.2238606053939391 Energy: 1.24467781437422 Energy: 1.3474140215232973 Energy: 1.257242013643994 Energy: 1.2238606053866319 Energy: 1.24467781437422 Energy: 1.3408296205509922 Energy: 1.2582437163340705 Energy: 1.252865616602382 Energy: 1.3332073816004923 Energy: 1.2574494850504532 Energy: 1.258243716330417 Energy: 1.2528656165987282 Energy: 1.3332073815968384 Energy: 1.2576576042457752 Energy: 1.2672490297586017 Energy: 1.3634552439404146 Energy: 1.2572086409521435 Energy: 1.2576576042457752 Energy: 1.2672490297586017 Energy: 1.3634552439477219 Energy: 1.2241269606766212 Energy: 1.2564656469412565 Energy: 1.3709074789481115 Energy: 1.2686328819316335 Energy: 1.2241269606693137 Energy: 1.2564656469412565 Energy: 1.3634030973654734 Energy: 1.2373499554462637 Energy: 1.248220194524011 Energy: 1.3659525569453612 Energy: 1.2645126657141543 Energy: 1.237349955453571 Energy: 1.2482201945276648 Energy: 1.3659525569417073 Energy: 1.2582066949831865 Energy: 1.2834424661037465 Energy: 1.3009451441433135 Energy: 1.2785625848872086 Energy: 1.2582066949795327 Energy: 1.2834424661147077 Energy: 1.3009451441396598 Energy: 1.2362281826271615 Energy: 1.257414193680263 Energy: 1.3153458893510976 Energy: 1.256965816718904 Energy: 1.2362281826235078 Energy: 1.2574141936875707 Energy: 1.3153458893547514 Energy: 1.2240648846323223 Energy: 1.2586164983928718 Energy: 1.3122184323982162 Energy: 1.2540605964834786 Energy: 1.2240648846396298 Energy: 1.2586164984001793 Energy: 1.3122184323946289 Energy: 1.257884687445526 Energy: 1.2688805905184706 Energy: 1.3149916781797686 Energy: 1.2475466758260958 Energy: 1.25788468744918 Energy: 1.268880590525778 Energy: 1.314991678172461 Energy: 1.2580029988615953 Energy: 1.2642947636779487 Energy: 1.2684100342761642 Energy: 1.2439651733000818 Energy: 1.258002998854354 Energy: 1.2642947636706414 Energy: 1.2684100342652027 Energy: 1.2237561452112318 Energy: 1.2564168582498143 Energy: 1.2496768524525455 Energy: 1.25259037179563 Energy: 1.223756145222193 Energy: 1.2564168582425732 Energy: 1.2496768524525455 Energy: 1.2185332857636992 Energy: 1.2739628594929475 Energy: 1.3252555168804456 Energy: 1.2433949363401955 Energy: 1.218533285778314 Energy: 1.2739628595039088 Energy: 1.3252555168731386 Energy: 1.2185619651217752 Energy: 1.237066824796934 Energy: 1.2874313926922087 Energy: 1.268777349487437 Energy: 1.2185619651327362 Energy: 1.2370668248078953 Energy: 1.2874313926812475 Energy: 1.2238606054012469 Energy: 1.24467781437422 Energy: 1.3411357349616408 Energy: 1.2572420136366864 Energy: 1.2238606053902856 Energy: 1.24467781437422 Energy: 1.3411357349726023 Energy: 1.258243716330417 Energy: 1.2528656166096894 Energy: 1.3332073815858771 Energy: 1.2574494850467994 Energy: 1.258243716330417 Energy: 1.252865616602382 Energy: 1.3332073815931846 Energy: 1.2576576042457752 Energy: 1.2882033325052606 Energy: 1.3634552439404146 Energy: 1.2572086409521435 Energy: 1.2576576042421215 Energy: 1.2882033325016071 Energy: 1.3634552439440684 Energy: 1.2239903631966895 Energy: 1.2564656469449103 Energy: 1.3634030973654734 Energy: 1.268632881924326 Energy: 1.2239903632003433 Energy: 1.2564656469376025 Energy: 1.363403097369127 Energy: 1.2452141859662254 Energy: 1.2482201945203573 Energy: 1.3659525569453612 Energy: 1.2645126657141543 Energy: 1.2452141859553307 Energy: 1.248220194524011 Energy: 1.3659525569380535 Energy: 1.2560403611033946 Energy: 1.2834424661000927 Energy: 1.3009451441433135 Energy: 1.278562584883555 Energy: 1.2560403610851258 Energy: 1.283442466111054 Energy: 1.3009451441433135 Energy: 1.2362281826308152 Energy: 1.257414193680263 Energy: 1.3153458893474437 Energy: 1.2569952537942009 Energy: 1.2362281826271615 Energy: 1.2574141936912242 Energy: 1.3153458893547514 minimum gb energy = 1.2185332857636992 eV minimum distance = 2.1572359181476 Angstroms sigma value = 311 ======================================== theta = 32.20422750397202 ======================================== Energy: 1.3272324069882295 Energy: 1.263379016056933 Energy: 1.2981022749317577 Energy: 1.2633836080146832 Energy: 1.3272324069856984 Energy: 1.2633790160577767 Energy: 1.2942985395898754 Energy: 1.3024757725517953 Energy: 1.2410142939074604 Energy: 1.350276725477549 Energy: 1.2739830453642977 Energy: 1.3024757725522171 Energy: 1.2410142939061948 Energy: 1.3502767254771268 Energy: 1.264425580345482 Energy: 1.2865690948533486 Energy: 1.4139593876548913 Energy: 1.26163003005856 Energy: 1.2644255803463258 Energy: 1.2865690948529265 Energy: 1.4139593876532037 Energy: 1.2569232501731022 Energy: 1.2624711193707294 Energy: 1.3352022907796965 Energy: 1.2409957124471878 Energy: 1.2569232501701488 Energy: 1.2624711193741047 Energy: 1.3352022907754777 Energy: 1.3191542788297688 Energy: 1.2718801660902803 Energy: 1.3880185823169837 Energy: 1.256941189351156 Energy: 1.3191542788377464 Energy: 1.2718801660822643 Energy: 1.3880185823195152 Energy: 1.2571374829174848 Energy: 1.241376269300649 Energy: 1.3354457823937136 Energy: 1.2474873315059756 Energy: 1.2571374829187507 Energy: 1.2413762693023367 Energy: 1.3354457823941355 Energy: 1.2905001805890088 Energy: 1.26164944302201 Energy: 1.3336631698059251 Energy: 1.2964979105300871 Energy: 1.2905001805873213 Energy: 1.26164944302201 Energy: 1.3073995820616113 Energy: 1.2566801762117383 Energy: 1.259956975546724 Energy: 1.3578472398059602 Energy: 1.2591699929851226 Energy: 1.256680176209207 Energy: 1.2599569755492555 Energy: 1.3578472397987882 Energy: 1.2904804685353206 Energy: 1.2595151090553098 Energy: 1.3509747348094827 Energy: 1.2587601386007141 Energy: 1.29048046853743 Energy: 1.2595151090574193 Energy: 1.3064227412592284 Energy: 1.256587371068464 Energy: 1.297908601651956 Energy: 1.2957760613420073 Energy: 1.2681862993958073 Energy: 1.2565873710642452 Energy: 1.2979086016490027 Energy: 1.2957760613424294 Energy: 1.3186289032641607 Energy: 1.2655602641570767 Energy: 1.3475086801502465 Energy: 1.2377235848260377 Energy: 1.3186289032662701 Energy: 1.2655602641537018 Energy: 1.3475086801540055 Energy: 1.3057554106062526 Energy: 1.3037425290757412 Energy: 1.3714586695951048 Energy: 1.3054861550833834 Energy: 1.30575541060794 Energy: 1.3037425290782725 Energy: 1.3714586695938393 Energy: 1.3098816291343969 Energy: 1.244173694752006 Energy: 1.3929986261767138 Energy: 1.2654839809291754 Energy: 1.3098816291305997 Energy: 1.244173694752428 Energy: 1.392998626180511 Energy: 1.2613389563352024 Energy: 1.2904149399733986 Energy: 1.3736675651297536 Energy: 1.290539754610146 Energy: 1.261338956333093 Energy: 1.290414939968758 Energy: 1.373667565131863 Energy: 1.3099923351235678 Energy: 1.2655495268764856 Energy: 1.3930385537063852 Energy: 1.2442010029930715 Energy: 1.3099923351218803 Energy: 1.265549526879017 Energy: 1.3930385537063852 Energy: 1.3057283158157273 Energy: 1.3055423935106567 Energy: 1.3714391172270244 Energy: 1.3037721092411674 Energy: 1.3057283158145 Energy: 1.3055423935106567 Energy: 1.371439117233353 Energy: 1.3185167259318362 Energy: 1.23784522190653 Energy: 1.3473386612478144 Energy: 1.265596856294057 Energy: 1.318516725936055 Energy: 1.237845221909905 Energy: 1.3473386612524554 Energy: 1.2566045369772672 Energy: 1.2669065220754614 Energy: 1.2957237289150987 Energy: 1.2977102540262613 Energy: 1.256604536978111 Energy: 1.2669065220784148 Energy: 1.2957237289201613 Energy: 1.290476400965581 Energy: 1.2587682235214528 Energy: 1.3027735436926258 Energy: 1.25943490604768 Energy: 1.2904764009693783 Energy: 1.2587682235256719 Energy: 1.3027735436955792 Energy: 1.256688891391303 Energy: 1.2592136389799065 Energy: 1.3579088529284316 Energy: 1.2602657203960037 Energy: 1.256688891392569 Energy: 1.2592136389828599 Energy: 1.3579088529221033 Energy: 1.2905375737728164 Energy: 1.2965165837534225 Energy: 1.3393157133488098 Energy: 1.262970939029158 Energy: 1.2905375737728164 Energy: 1.2965165837580632 Energy: 1.3393157133458564 Energy: 1.257211736393769 Energy: 1.247486432133527 Energy: 1.3352987493761617 Energy: 1.2412146322467834 Energy: 1.2572117363954565 Energy: 1.2474864321431922 Energy: 1.335298749371099 Energy: 1.3192077832112736 Energy: 1.2566712048979227 Energy: 1.3147616909890625 Energy: 1.2718481232496623 Energy: 1.3192077832112736 Energy: 1.2566712048996103 Energy: 1.2948482186785961 Energy: 1.2571472825846384 Energy: 1.241007814662775 Energy: 1.334801274380701 Energy: 1.2623923959333845 Energy: 1.2571472825846384 Energy: 1.2410078146593997 Energy: 1.334801274380701 Energy: 1.2642530082931902 Energy: 1.2616023098862537 Energy: 1.324648882760346 Energy: 1.2867084279448184 Energy: 1.2642530082952996 Energy: 1.261602309884566 Energy: 1.4125922082603388 Energy: 1.3022792185497902 Energy: 1.2741369851475353 Energy: 1.3504559713961792 Energy: 1.2411844074156542 Energy: 1.3022792185476808 Energy: 1.2741369851462696 Energy: 1.3504559713974449 Energy: 1.3272324069878076 Energy: 1.2633790160560892 Energy: 1.2909119822830812 Energy: 1.26338360801173 Energy: 1.327232406991605 Energy: 1.2633790160607299 Energy: 1.3006749861552966 Energy: 1.3024757725513731 Energy: 1.2410142939066167 Energy: 1.350276725480502 Energy: 1.2739830453626104 Energy: 1.3024757725547484 Energy: 1.2410142939057727 Energy: 1.3502767254788146 Energy: 1.264425580344638 Energy: 1.286569094851699 Energy: 1.4185554987827225 Energy: 1.2616300300539574 Energy: 1.264425580349279 Energy: 1.2865690948495898 Energy: 1.4182158739825947 Energy: 1.256923250169305 Energy: 1.262471119372417 Energy: 1.3352022907763212 Energy: 1.240995712442547 Energy: 1.2569232501731022 Energy: 1.2624711193728388 Energy: 1.3352022907729464 Energy: 1.3191542788301904 Energy: 1.2718801660852177 Energy: 1.3611997724840699 Energy: 1.2569411893490463 Energy: 1.3191542788318782 Energy: 1.271880166088171 Energy: 1.3730337357393612 Energy: 1.2571374829153754 Energy: 1.2413762693031805 Energy: 1.33544578239287 Energy: 1.2474873315059756 Energy: 1.2571374829153754 Energy: 1.2413762693002273 Energy: 1.3354457823941355 Energy: 1.2905001805847898 Energy: 1.261649443024541 Energy: 1.3346285985357018 Energy: 1.2964979105305092 Energy: 1.2905001805915404 Energy: 1.2616494430228538 Energy: 1.3255976356756418 Energy: 1.2566801762104727 Energy: 1.2599569755560058 Energy: 1.3578472397975228 Energy: 1.2591699929796378 Energy: 1.2566801762104727 Energy: 1.259956975550521 Energy: 1.3578472398008976 Energy: 1.290480468534055 Energy: 1.2595151090561536 Energy: 1.356717731362808 Energy: 1.2587601385956513 Energy: 1.2904804685348987 Energy: 1.259515109058685 Energy: 1.350974734809061 Energy: 1.2565873710625575 Energy: 1.2979086016447838 Energy: 1.2957760613432732 Energy: 1.2681862993974948 Energy: 1.256587371064667 Energy: 1.2979086016498467 Energy: 1.2957760613432732 minimum gb energy = 1.2377235848260377 eV minimum distance = 2.2426681791382 Angstroms sigma value = 39 ======================================== theta = 38.21321070173819 ======================================== Energy: 1.2635683498107524 Energy: 1.2978722310693953 Energy: 1.3751689376836986 Energy: 1.2979409412704788 Energy: 1.2635683498207109 Energy: 1.2978722310728807 Energy: 1.3786198455079195 Energy: 1.2445285448842425 Energy: 1.309623798039442 Energy: 1.260531817965461 Energy: 1.3060551633212276 Energy: 1.244528544888226 Energy: 1.3096237980289855 Energy: 1.2605318179679508 Energy: 1.263573864022304 Energy: 1.1791325586519905 Energy: 1.3234923724702006 Energy: 1.2650165679101983 Energy: 1.263573864029773 Energy: 1.1791325586499988 Energy: 1.3234923724642258 Energy: 1.2600673297088665 Energy: 1.3605972272927433 Energy: 1.2608372135777393 Energy: 1.3256114060009974 Energy: 1.2600673297088665 Energy: 1.3605972272887599 Energy: 1.2608372135742538 Energy: 1.338599835685445 Energy: 1.2679926571546525 Energy: 1.2656246147730665 Energy: 1.2661021839902513 Energy: 1.3385998356884325 Energy: 1.26799265715764 Energy: 1.2656246147646018 Energy: 1.2602290110391126 Energy: 1.3068956837955097 Energy: 1.3980935760712225 Energy: 1.3267263732051298 Energy: 1.2602290110440917 Energy: 1.3068956837955097 Energy: 1.3980935760732143 Energy: 1.3975285000120883 Energy: 1.268079332552052 Energy: 1.2734959107722865 Energy: 1.2672962052743577 Energy: 1.397528500012586 Energy: 1.268079332559521 Energy: 1.2734959107897137 Energy: 1.275640981882752 Energy: 1.2297094159934812 Energy: 1.4467824573518413 Energy: 1.2296591728198747 Energy: 1.2756409818892254 Energy: 1.229709415998958 Energy: 1.4467824573419283 Energy: 1.3975404961562898 Energy: 1.267312787008222 Energy: 1.2969733668493093 Energy: 1.2680510069213882 Energy: 1.397540496149364 Energy: 1.2673127870077239 Energy: 1.2969733668433345 Energy: 1.2601023463432728 Energy: 1.3267513238818107 Energy: 1.398188529757704 Energy: 1.3068461283762471 Energy: 1.2601023463472563 Energy: 1.326751323865877 Energy: 1.3981885297596954 Energy: 1.3383962680074508 Energy: 1.2663282608853808 Energy: 1.2954610135339824 Energy: 1.2679816731948887 Energy: 1.3383962680109363 Energy: 1.2663282608848827 Energy: 1.2854710217498264 Energy: 1.2601045527115458 Energy: 1.325704991751239 Energy: 1.2608443470199147 Energy: 1.3605826280858242 Energy: 1.2601045527185166 Energy: 1.3257049917467574 Energy: 1.2608443470084623 Energy: 1.263856521673786 Energy: 1.283273115824492 Energy: 1.3114185711122353 Energy: 1.1791100062331528 Energy: 1.2638565216658197 Energy: 1.283273115832957 Energy: 1.3114185711132311 Energy: 1.2445491681941474 Energy: 1.3072823826804956 Energy: 1.2996672067192356 Energy: 1.3096782649879712 Energy: 1.2445491681861807 Energy: 1.3072823826770104 Energy: 1.2996672067157504 Energy: 1.2635683498112504 Energy: 1.2978722310703912 Energy: 1.3751689376846947 Energy: 1.2979409412689848 Energy: 1.2635683498207109 Energy: 1.2978722310748723 Energy: 1.3786198455089151 Energy: 1.2445285448847405 Energy: 1.3096237980384462 Energy: 1.2605318179664573 Energy: 1.3060551633232196 Energy: 1.2445285448887238 Energy: 1.3096237980299816 Energy: 1.2605318179664573 Energy: 1.2635738640218062 Energy: 1.1791325586509946 Energy: 1.3234923724721923 Energy: 1.265016567911692 Energy: 1.263573864030271 Energy: 1.1791325586499988 Energy: 1.3234923724652217 Energy: 1.2600673297083684 Energy: 1.360597227293694 Energy: 1.2608372135782373 Energy: 1.3256114059995039 Energy: 1.2600673297078706 Energy: 1.3605972272877642 Energy: 1.260837213572262 Energy: 1.3385998356819593 Energy: 1.2679926571551503 Energy: 1.2656246147740622 Energy: 1.2661021839882596 Energy: 1.3385998356849471 Energy: 1.267992657158636 Energy: 1.2656246147650998 Energy: 1.2602290110376189 Energy: 1.3068956837945138 Energy: 1.3980935760712225 Energy: 1.3267263732051298 Energy: 1.2602290110435939 Energy: 1.3068956837950116 Energy: 1.3980935760732143 Energy: 1.3975285000086028 Energy: 1.2680793325500606 Energy: 1.2734959107707928 Energy: 1.2672962052693786 Energy: 1.3975285000095987 Energy: 1.2680793325570312 Energy: 1.2734959107867263 Energy: 1.2756409818817565 Energy: 1.2297094159904935 Energy: 1.4467824573498493 Energy: 1.2296591728188786 Energy: 1.2756409818872334 Energy: 1.2297094159969666 Energy: 1.4467824573379449 Energy: 1.3975404961567874 Energy: 1.267312787007226 Energy: 1.2969733668493093 Energy: 1.2680510069243758 Energy: 1.3975404961483684 Energy: 1.267312787006728 Energy: 1.296973366845326 Energy: 1.2601023463447665 Energy: 1.3267513238818107 Energy: 1.3981885297611891 Energy: 1.3068461283747534 Energy: 1.2601023463477543 Energy: 1.3267513238673712 Energy: 1.3981885297651724 Energy: 1.3383962680069528 Energy: 1.2663282608828912 Energy: 1.26053637475927 Energy: 1.2679816731934404 Energy: 1.3383962680089443 Energy: 1.2663282608858788 Energy: 1.2605363747632532 Energy: 1.2601045527115458 Energy: 1.3257049917492472 Energy: 1.260844347018421 Energy: 1.3605826280878164 Energy: 1.2601045527185166 Energy: 1.3257049917457617 Energy: 1.2608443470079644 Energy: 1.2638565216782676 Energy: 1.283273115819513 Energy: 1.311418571113729 Energy: 1.1791100062341486 Energy: 1.2638565216712967 Energy: 1.2832731158314632 Energy: 1.3114185711147248 Energy: 1.2445491681946452 Energy: 1.307282382683981 Energy: 1.2996672067187378 Energy: 1.3096782649879712 Energy: 1.2445491681876744 Energy: 1.3072823826804956 Energy: 1.2996672067147546 Energy: 1.2635683498112504 Energy: 1.2978722310698931 Energy: 1.3786198455049319 Energy: 1.2979409412704788 Energy: 1.2635683498207109 Energy: 1.2978722310728807 Energy: 1.3786198455084175 Energy: 1.2445285448837446 Energy: 1.3096237980384462 Energy: 1.260531817967453 Energy: 1.3060551633212276 Energy: 1.244528544887728 Energy: 1.3096237980299816 Energy: 1.2605318179669551 minimum gb energy = 1.1791100062331528 eV minimum distance = 2.2435921970705 Angstroms sigma value = 21 ======================================== theta = 46.82644889274107 ======================================== Energy: 1.313968188872971 Energy: 1.3616990116710779 Energy: 1.3380484135522006 Energy: 1.3617132125522446 Energy: 1.313968188873576 Energy: 1.3616990116716827 Energy: 1.3380484135461561 Energy: 1.3524862901690282 Energy: 1.2556312465487762 Energy: 1.2325067712718945 Energy: 1.2564012632288075 Energy: 1.352486290163588 Energy: 1.255631246546963 Energy: 1.232506771273708 Energy: 1.307399799488748 Energy: 1.250504142879425 Energy: 1.338810284665964 Energy: 1.2682112069197036 Energy: 1.3073997994917703 Energy: 1.250504142879425 Energy: 1.3388102846635463 Energy: 1.3463939321688285 Energy: 1.2549082285888453 Energy: 1.3078387260399085 Energy: 1.2762212105497523 Energy: 1.3463939321724556 Energy: 1.2549082285858233 Energy: 1.307838726038095 Energy: 1.2580110863564382 Energy: 1.2657254191873757 Energy: 1.3193436449855935 Energy: 1.3059627089184824 Energy: 1.2580110863564382 Energy: 1.2657254191873757 Energy: 1.3193436449861984 Energy: 1.3464753428807785 Energy: 1.2970970493253664 Energy: 1.3532257534355077 Energy: 1.276541411652126 Energy: 1.3464753428819873 Energy: 1.2970970493302016 Energy: 1.3532257534324852 Energy: 1.3075065476685723 Energy: 1.265052354130284 Energy: 1.3190877678177908 Energy: 1.2813088306954068 Energy: 1.3075065476685723 Energy: 1.2650523541284708 Energy: 1.319087767816005 Energy: 1.329554824858296 Energy: 1.2648114916605746 Energy: 1.3482286393809928 Energy: 1.2770754556504664 Energy: 1.3295548248595048 Energy: 1.264811491655739 Energy: 1.348228639382806 Energy: 1.307473342777206 Energy: 1.278629197199299 Energy: 1.264999612106313 Energy: 1.2679443969162103 Energy: 1.3074733427778105 Energy: 1.2786291972041346 Energy: 1.2649996121123575 Energy: 1.310987664745564 Energy: 1.2968371517637252 Energy: 1.2620449971788623 Energy: 1.2769743342174484 Energy: 1.3109876647431464 Energy: 1.2968371517667474 Energy: 1.2620449971776535 Energy: 1.3071798917989066 Energy: 1.2876926216365676 Energy: 1.3094791276550994 Energy: 1.2910438512763336 Energy: 1.3071798918001154 Energy: 1.2876926216341498 Energy: 1.309479127655704 Energy: 1.206920231031548 Energy: 1.2958887603395044 Energy: 1.259313125927931 Energy: 1.2596130817548865 Energy: 1.2069202310333615 Energy: 1.2958887603364821 Energy: 1.259313125927931 Energy: 1.30723682203583 Energy: 1.290683723201818 Energy: 1.29348953943018 Energy: 1.2760283358418099 Energy: 1.3072368220352253 Energy: 1.290683723201818 Energy: 1.2778098629237526 Energy: 1.2068307721058549 Energy: 1.2958206211432288 Energy: 1.3348735947273123 Energy: 1.2599055200544826 Energy: 1.2068307721010467 Energy: 1.2958206211389975 Energy: 1.3348735947267074 Energy: 1.3387047017321152 Energy: 1.2273290928806802 Energy: 1.2980381934833998 Energy: 1.2776018114603689 Energy: 1.3387047017333242 Energy: 1.227329092877658 Energy: 1.2980381934833998 Energy: 1.2063791299167599 Energy: 1.3258234161901203 Energy: 1.304483075647729 Energy: 1.33486733811033 Energy: 1.2063791299149464 Energy: 1.3258234161883071 Energy: 1.304483075648938 Energy: 1.3385321028217108 Energy: 1.2269950808162111 Energy: 1.3436283014063797 Energy: 1.2775866764581627 Energy: 1.3385321028211066 Energy: 1.22699508082286 Energy: 1.3436283014057753 Energy: 1.2063713611986089 Energy: 1.2685354314259725 Energy: 1.3048117727907704 Energy: 1.348283621049164 Energy: 1.2063713611967954 Energy: 1.268535431426577 Energy: 1.304811772791375 Energy: 1.3018759436626564 Energy: 1.2271219260980475 Energy: 1.4266753290478367 Energy: 1.276875889743352 Energy: 1.3018759436656786 Energy: 1.2271219260938162 Energy: 1.4266753290496499 Energy: 1.2065601804205301 Energy: 1.3187418093865693 Energy: 1.3044722482775064 Energy: 1.3186565906334966 Energy: 1.2065601804199255 Energy: 1.3187418093853605 Energy: 1.3044722482805289 Energy: 1.3019838086442481 Energy: 1.2771032986041033 Energy: 1.425203332610414 Energy: 1.2273384184746667 Energy: 1.3019838086442481 Energy: 1.2771032986010813 Energy: 1.4252033326098095 Energy: 1.2063930369499976 Energy: 1.34827453343132 Energy: 1.3046610664590848 Energy: 1.2685651031286616 Energy: 1.2063930369463707 Energy: 1.3482745334319246 Energy: 1.3046610664596892 Energy: 1.3386951650940506 Energy: 1.2776161727931588 Energy: 1.3436102332958997 Energy: 1.2271374265420467 Energy: 1.3386951650922367 Energy: 1.2776161727937632 Energy: 1.3436102332958997 Energy: 1.2063555383765572 Energy: 1.3351057227043708 Energy: 1.304542110941009 Energy: 1.326032271493387 Energy: 1.2063555383759526 Energy: 1.3351057227049752 Energy: 1.3045421109452402 Energy: 1.3389857192235368 Energy: 1.277601766127931 Energy: 1.2608734568993782 Energy: 1.2274805060881673 Energy: 1.3389857192199104 Energy: 1.277601766127931 Energy: 1.2608734568993782 minimum gb energy = 1.2063555383759526 eV minimum distance = 2.21513603005755 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 1.2668282266696187 Energy: 1.3514353512462303 Energy: 1.3113267628153424 Energy: 1.3506850627254976 Energy: 1.2668282266763655 Energy: 1.3514353512428572 Energy: 1.3113267628153424 Energy: 1.3400035199972269 Energy: 1.299716587809569 Energy: 1.3075942183789648 Energy: 1.3247804465409918 Energy: 1.3400035199972269 Energy: 1.299716587802822 Energy: 1.3075942183957707 Energy: 1.2731403508841024 Energy: 1.3206809011100937 Energy: 1.3464295619595523 Energy: 1.2880242416800214 Energy: 1.273140350887476 Energy: 1.3206809010999734 Energy: 1.2969057571605698 Energy: 1.2476698404011128 Energy: 1.2993895201994736 Energy: 1.3027949428164605 Energy: 1.2991804510022245 Energy: 1.2476698404078597 Energy: 1.2993895202062204 Energy: 1.3027949428232073 Energy: 1.2665648696657619 Energy: 1.235229544526815 Energy: 1.3773313850967608 Energy: 1.2744861513679635 Energy: 1.2665648696893759 Energy: 1.235229544526815 Energy: 1.3773313851035078 Energy: 1.2171652037718803 Energy: 1.281872960263813 Energy: 1.2915494623993533 Energy: 1.247691496278097 Energy: 1.2171652037718803 Energy: 1.2818729602536927 Energy: 1.2915494623892327 Energy: 1.2613777300946598 Energy: 1.236419997655752 Energy: 1.352420416621327 Energy: 1.2440439487099524 Energy: 1.2613777300946598 Energy: 1.236419997679366 Energy: 1.352420416628074 Energy: 1.2174533414711874 Energy: 1.2645563741737904 Energy: 1.302402172893875 Energy: 1.2772655642890407 Energy: 1.2174533414745612 Energy: 1.264556374170417 Energy: 1.302402172893875 Energy: 1.2517565270100552 Energy: 1.2356084122326298 Energy: 1.4048834096065883 Energy: 1.2341417457173083 Energy: 1.2517565270033084 Energy: 1.235608412225883 Energy: 1.4048834096032152 Energy: 1.2165208110490737 Energy: 1.2586124006906043 Energy: 1.3734229128171886 Energy: 1.2736849111729065 Energy: 1.2165208110558206 Energy: 1.258612400687231 Energy: 1.373422912813815 Energy: 1.2512131579845358 Energy: 1.2524321235443265 Energy: 1.4096885551755969 Energy: 1.2492236329298743 Energy: 1.2512131579811623 Energy: 1.2524321235443265 Energy: 1.40968855517897 Energy: 1.2310695238513911 Energy: 1.2593361160115715 Energy: 1.420403541862879 Energy: 1.2512589343960325 Energy: 1.2310695238547646 Energy: 1.2593361160115715 Energy: 1.420403541856132 Energy: 1.2521667336387379 Energy: 1.2555560432065482 Energy: 1.4016589044378687 Energy: 1.2730456224527276 Energy: 1.2521667336487967 Energy: 1.2555560432065482 Energy: 1.4016589044311831 Energy: 1.2663307484626583 Energy: 1.3017490919019683 Energy: 1.3826567163816743 Energy: 1.2701787671003009 Energy: 1.2663307484660318 Energy: 1.3017490919053416 Energy: 1.3826567163783012 Energy: 1.251823786420909 Energy: 1.2626892812857273 Energy: 1.403563164826075 Energy: 1.2907317783183252 Energy: 1.2518237864242825 Energy: 1.2626892812857273 Energy: 1.4035631648092077 Energy: 1.2576212435564726 Energy: 1.259540090755055 Energy: 1.3875970089794203 Energy: 1.2979397131630277 Energy: 1.257621243559846 Energy: 1.2595400907516816 Energy: 1.3875970089996612 Energy: 1.2499416801201866 Energy: 1.2555783878877442 Energy: 1.337095199990732 Energy: 1.2516460553589215 Energy: 1.2499416801201866 Energy: 1.2555783878944913 Energy: 1.3370951999941054 Energy: 1.2275594695732028 Energy: 1.2700159317186788 Energy: 1.386357763247774 Energy: 1.255797717707526 Energy: 1.22755946957995 Energy: 1.2700159317254258 Energy: 1.3863577632511477 Energy: 1.2546852409948728 Energy: 1.290721752313156 Energy: 1.3376874478111764 Energy: 1.2692729418587407 Energy: 1.2546852409948728 Energy: 1.2907217523333967 Energy: 1.3376874478179233 Energy: 1.2280256399910277 Energy: 1.2724033013410299 Energy: 1.3285037471662016 Energy: 1.248822893295537 Energy: 1.2280256399944012 Energy: 1.2724033013376566 Energy: 1.3285037471662016 Energy: 1.2592647481223667 Energy: 1.2622519207306957 Energy: 1.406968241998041 Energy: 1.2680006463043698 Energy: 1.2592647481156198 Energy: 1.2622519207374425 Energy: 1.406968241998041 Energy: 1.2329926713518713 Energy: 1.2719558093372447 Energy: 1.3803442188268131 Energy: 1.2467513685845693 Energy: 1.2329926713619306 Energy: 1.2719558093473649 Energy: 1.3803442188301862 Energy: 1.2588205480129087 Energy: 1.2716637263367303 Energy: 1.4193013044043403 Energy: 1.2994939770075606 Energy: 1.2588205480230292 Energy: 1.2716637263266102 Energy: 1.4193013044043403 Energy: 1.2469326636938505 Energy: 1.264895282312678 Energy: 1.418423857011064 Energy: 1.25038244957796 Energy: 1.2469326637140912 Energy: 1.2648952823093045 Energy: 1.418423857011064 Energy: 1.291087696416337 Energy: 1.3105634485512971 Energy: 1.3267378976913793 Energy: 1.3588024028035308 Energy: 1.2910876964230835 Energy: 1.3105634485378648 Energy: 1.3421285816364545 Energy: 1.246763644688384 Energy: 1.333400833920754 Energy: 1.452825106481714 Energy: 1.315087381858816 Energy: 1.2467636447052515 Energy: 1.333400833927501 Energy: 1.4528251064884605 Energy: 1.3794158381777708 Energy: 1.3106389371796554 Energy: 1.3303490233413042 Energy: 1.403608280361219 Energy: 1.3794158382047583 Energy: 1.3106389371661615 Energy: 1.3303490233345572 Energy: 1.2842926871594824 Energy: 1.3686458893163402 Energy: 1.4395905456064693 Energy: 1.3175074401639675 Energy: 1.2842926871527356 Energy: 1.3686458893264606 Energy: 1.4395905455929754 Energy: 1.379504112611487 Energy: 1.3103741238830897 Energy: 1.326966636863949 Energy: 1.4013604493421823 Energy: 1.3795041126283545 Energy: 1.3103741238797162 Energy: 1.332435875095643 Energy: 1.246737779340996 Energy: 1.347194956779968 Energy: 1.4421872092870116 Energy: 1.315786868887751 Energy: 1.2467377793342491 Energy: 1.3471949567765944 Energy: 1.4421872092802648 Energy: 1.2907750162470517 Energy: 1.310157566093141 Energy: 1.3646315376602616 Energy: 1.355820486927734 Energy: 1.2907750162470517 Energy: 1.3101575661066347 Energy: 1.3646315376737552 Energy: 1.252846255450758 Energy: 1.2506324771137487 Energy: 1.3673070923278576 Energy: 1.2759345342872745 Energy: 1.2528462554338908 Energy: 1.250632477100255 Energy: 1.3673070923278576 Energy: 1.257984792784573 Energy: 1.2811864752464013 Energy: 1.4066924117044008 Energy: 1.2993287457263138 Energy: 1.2579847927913201 Energy: 1.281186475259895 Energy: 1.4066924117111481 Energy: 1.2542692906683712 Energy: 1.2528426752354815 Energy: 1.381906338561726 Energy: 1.2605393969390737 Energy: 1.2542692906717448 Energy: 1.2528426752153021 Energy: 1.3819063385549795 Energy: 1.2529385942206142 Energy: 1.2494032751072826 Energy: 1.3260963482701367 Energy: 1.3270883053466174 Energy: 1.2529385942341078 Energy: 1.2494032750971622 Energy: 1.3260963482701367 Energy: 1.256083997942925 Energy: 1.2605111899923165 Energy: 1.3807148416852961 Energy: 1.2536292104139306 Energy: 1.2560839979597924 Energy: 1.2605111900024368 Energy: 1.380714841681923 Energy: 1.2530986996109983 Energy: 1.2754908134403111 Energy: 1.341943361021625 Energy: 1.320147659136262 Energy: 1.2530986996042515 Energy: 1.2754908134301908 Energy: 1.3419433610283718 Energy: 1.2639371904626098 Energy: 1.2594930847716614 Energy: 1.3703440692118964 Energy: 1.2776779776663028 Energy: 1.2639371904524894 Energy: 1.259493084775035 Energy: 1.37034406922539 Energy: 1.2800865361905647 Energy: 1.3029180365386384 Energy: 1.3884926785265703 Energy: 1.3059583287134124 Energy: 1.2800865361939382 Energy: 1.302918036558879 Energy: 1.388492678523197 Energy: 1.263479885329314 Energy: 1.3092229769763333 Energy: 1.3629983769085312 Energy: 1.2989925499255701 Energy: 1.2634798853259406 Energy: 1.3092229769797066 Energy: 1.3629983769085312 Energy: 1.2881862086446982 Energy: 1.3113701778905098 Energy: 1.3768932048150078 Energy: 1.3115502696110721 Energy: 1.2881862086413247 Energy: 1.3113701778803897 Energy: 1.3768932048015141 Energy: 1.2636130968722183 Energy: 1.2607576897177013 Energy: 1.4118628692937218 Energy: 1.288571457212277 Energy: 1.2636130968789654 Energy: 1.2607576897177013 Energy: 1.411862869297095 Energy: 1.2635168759773028 Energy: 1.311451482008296 Energy: 1.3863828542621373 Energy: 1.3218552436094086 Energy: 1.2635168759907964 Energy: 1.3114514820049226 Energy: 1.3863828542756313 Energy: 1.2661522889525163 Energy: 1.2536909512898617 Energy: 1.4236552209632507 Energy: 1.2624612156862838 Energy: 1.2661522889322754 Energy: 1.2536909512898617 Energy: 1.4236552209699973 Energy: 1.230191724368029 Energy: 1.31006187092987 Energy: 1.3913871976899754 Energy: 1.3153067906480915 Energy: 1.230191724378149 Energy: 1.310061870946737 Energy: 1.3913871977000347 minimum gb energy = 1.2165208110490737 eV minimum distance = 2.17252310797343 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 1.191189563571706 Energy: 1.182901636030924 Energy: 1.3017288239182052 Energy: 1.1829016360225575 Energy: 1.1911895635701848 Energy: 1.1829016360225575 Energy: 1.216080241282823 Energy: 1.1911895635762695 Energy: 1.182901636023318 Energy: 1.351006002304393 Energy: 1.1829016360248392 Energy: 1.1911895635709455 Energy: 1.1829016360332056 Energy: 1.2160802412767382 Energy: 1.1911895635732273 Energy: 1.182901636027121 Energy: 1.2970798891414106 Energy: 1.182901636032445 Energy: 1.19118956357703 Energy: 1.1829016360255997 Energy: 1.216080241274491 Energy: 1.1911895635724665 Energy: 1.1829016360301632 Energy: 1.2704739655802215 Energy: 1.182901636023318 Energy: 1.1911895635671426 Energy: 1.182901636023318 Energy: 1.216080241284344 Energy: 1.1911895635747483 Energy: 1.182901636023318 Energy: 1.3510060023036325 Energy: 1.1829016360248392 Energy: 1.191189563567903 Energy: 1.1829016360332056 Energy: 1.2160802412782596 Energy: 1.1911895635732273 Energy: 1.1829016360278815 Energy: 1.253625004816847 Energy: 1.182901636032445 Energy: 1.19118956357703 Energy: 1.1829016360255997 Energy: 1.2160802412752516 Energy: 1.191189563571706 Energy: 1.182901636030924 Energy: 1.2704739655794608 Energy: 1.182901636021797 Energy: 1.1911895635701848 Energy: 1.182901636023318 Energy: 1.216080241284344 Energy: 1.1911895635747483 Energy: 1.1829016360240787 Energy: 1.28635995271354 Energy: 1.1829016360255997 Energy: 1.1911895635686638 Energy: 1.1829016360332056 Energy: 1.2160802412767382 Energy: 1.1911895635739878 Energy: 1.1829016360263604 Energy: 1.2536250048160864 Energy: 1.182901636032445 Energy: 1.19118956357703 Energy: 1.1829016360248392 Energy: 1.2160802412752516 Energy: 1.1911895635747483 Energy: 1.1829016360301632 Energy: 1.2160802412760123 Energy: 1.182901636023318 Energy: 1.1911895635694243 Energy: 1.182901636023318 Energy: 1.2160802412835836 Energy: 1.1911895635739878 Energy: 1.1829016360225575 Energy: 1.2160802412805414 Energy: 1.1829016360248392 Energy: 1.191189563567903 Energy: 1.1829016360332056 Energy: 1.2160802412782596 Energy: 1.1911895635732273 Energy: 1.1829016360278815 Energy: 1.2160802412782596 Energy: 1.1829016360332056 Energy: 1.191189563575509 Energy: 1.1829016360248392 Energy: 1.2160802412729699 Energy: 1.1911895635747483 Energy: 1.1829016360301632 Energy: 1.2160802412760123 Energy: 1.182901636021797 Energy: 1.1911895635709455 Energy: 1.182901636021797 Energy: 1.2160802412835836 Energy: 1.1911895635739878 Energy: 1.182901636023318 Energy: 1.2160802412805414 Energy: 1.1829016360255997 Energy: 1.1911895635709455 Energy: 1.1829016360332056 Energy: 1.2160802412782596 Energy: 1.1911895635732273 Energy: 1.182901636027121 Energy: 1.2160802412797806 Energy: 1.1829016360332056 Energy: 1.1911895635777907 Energy: 1.1829016360248392 Energy: 1.2160802412729699 Energy: 1.1911895635739878 Energy: 1.1829016360301632 Energy: 1.2160802412760123 Energy: 1.182901636023318 Energy: 1.1911895635694243 Energy: 1.1829016360225575 Energy: 1.2160802412820624 Energy: 1.1911895635747483 Energy: 1.1829016360225575 Energy: 1.2160802412805414 Energy: 1.1829016360255997 Energy: 1.191189563567903 Energy: 1.1829016360332056 Energy: 1.2160802412797806 Energy: 1.1911895635732273 Energy: 1.1829016360278815 Energy: 1.216080241277499 Energy: 1.1829016360332056 Energy: 1.1911895635762695 Energy: 1.1829016360248392 Energy: 1.2160802412737306 Energy: 1.1911895635724665 Energy: 1.1829016360301632 Energy: 1.216080241277499 Energy: 1.1829016360225575 Energy: 1.1911895635724665 Energy: 1.182901636021797 Energy: 1.216080241282823 Energy: 1.1911895635762695 Energy: 1.182901636023318 Energy: 1.2160802412813017 Energy: 1.1829016360255997 Energy: 1.1911895635694243 Energy: 1.1829016360332056 Energy: 1.2160802412782596 minimum gb energy = 1.182901636021797 eV minimum distance = 2.31931659234474 Angstroms sigma value = 23