Model name: model_name=EAM_Dynamo_Marinica_2011_Fe__MO_255315407910_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.814778730273247
cohesive_energy=4.122774919192733
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[4.6453028673205795e-20, 1.60445172482028e-19, 2.52264313199934e-19, 3.2364769095116995e-19, 3.8144941737598795e-19, 4.2795259417783796e-19, 4.65050994138108e-19, 4.947040792801799e-19, 5.1925743619623e-19, 5.4028600451748e-19, 5.586453465664859e-19, 5.7477285656433e-19, 5.889184740659159e-19, 6.0124401891127795e-19, 6.12153239612184e-19, 6.21977786731872e-19, 6.30943567175736e-19, 6.39081022299822e-19, 6.461273951361539e-19, 6.517910895373439e-19, 6.55905479133456e-19, 6.585763075823339e-19, 6.600390948491761e-19, 6.604893064833299e-19, 6.600455035557119e-19, 6.58683653416812e-19, 6.562916037022501e-19, 6.523967123049959e-19, 6.462956236827239e-19, 6.371455929259499e-19, 6.2397570099447e-19, 6.0583906149759e-19, 5.82360765102954e-19, 5.53500757394712e-19, 5.19166112128092e-19, 4.79223848642472e-19, 4.32826415498466e-19, 3.77695517522526e-19, 3.1111065879011996e-19, 2.29394843926218e-19, 1.255875767620704e-19, -1.4946241187362138e-20, -2.57242276001772e-19, -5.858278753389299e-19, -1.0446335849577058e-18]
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: 0.01605958815942336
Energy: 0.016216592715826397
Energy: 1.279824536130754
Energy: 0.016871856318060797
Energy: 0.016308121179706075
Energy: 1.4955177451608925
Energy: 0.01625894116528628
Energy: 0.016728881312984445
Energy: 0.20397517860264894
Energy: 0.47892321823095285
Energy: 0.16530773516752315
Energy: 0.20434770415994125
Energy: 0.20386757646286463
Energy: 0.16534295463106513
Energy: 0.16580577770933133
Energy: 0.20520785632336438
Energy: 0.20382629467784702
Energy: 0.1654601563510075
Energy: 0.16579604309320145
Energy: 0.2039988370633004
Energy: 0.16503342546992916
Energy: 0.1654662353842314
Energy: 0.1653912546386643
Energy: 0.2036747302745381
Energy: 0.16566010102463422
Energy: 0.16519114575426697
Energy: 0.20413146523554407
Energy: 0.1653970160577486
Energy: 0.16554942729987826
Energy: 0.2043997414921554
Energy: 0.20438540114616885
Energy: 0.16558511236896892
Energy: 0.1654167212358806
Energy: 0.2039528378551042
Energy: 0.16614400058104192
Energy: 0.016394489182219397
Energy: 0.20420519796901043
Energy: 0.475825605678183
Energy: 0.01687870920959517
Energy: 0.016899261248416196
Energy: 0.2037709028137376
Energy: 0.16575905208138123

minimum gb energy = 0.01605958815942336 eV
minimum distance =  2.40493506530018 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 2.6552284671205073
Energy: 1.4067267906332168
Energy: 1.315404729498912
Energy: 1.5078487663771893
Energy: 1.4844107255236558
Energy: 1.3423351250847353
Energy: 1.4067639153280564
Energy: 1.255774485537262
Energy: 1.2388349296716474
Energy: 1.2981654743527822
Energy: 1.2831415033426476
Energy: 1.2886848855756086
Energy: 1.2863772139411216
Energy: 1.243468233273026
Energy: 1.2680012188577978
Energy: 1.2576638868672225
Energy: 1.2805757279336134
Energy: 1.2469114364088532
Energy: 1.2786540881421566
Energy: 1.2505897727167279
Energy: 1.2540693967097853
Energy: 1.2773768426909087
Energy: 1.3054128095673365
Energy: 1.326612629415923
Energy: 1.2621129014009433
Energy: 1.3084701642187047
Energy: 1.3408910044920284
Energy: 1.2772277113840056
Energy: 1.2704273932674786
Energy: 1.265536273142301
Energy: 1.2883750784027816
Energy: 1.273118256553377
Energy: 1.266756374543957
Energy: 1.2868792346246916
Energy: 1.282640281889053
Energy: 1.257755050204594
Energy: 1.2834102048050078
Energy: 1.3008029613684984
Energy: 1.309925309326468
Energy: 1.3056627616524767
Energy: 1.2835797234067012
Energy: 1.329464766150542
Energy: 1.2579025547311957
Energy: 1.2885128400936794
Energy: 1.2805380704727267
Energy: 1.3380605811127149
Energy: 1.27978933126562
Energy: 1.2695855817363038
Energy: 1.320987605480878
Energy: 1.276497763825637
Energy: 1.2856978259096268
Energy: 1.2548069987318615
Energy: 1.2858939718477427
Energy: 1.2819763930715689
Energy: 1.2537300693998294
Energy: 1.3152583718738227
Energy: 1.305627770548656
Energy: 1.292066675296363
Energy: 1.2375267311434468
Energy: 1.2760726408828704
Energy: 1.292540376681788
Energy: 1.3103797453183301
Energy: 1.3226805013709457
Energy: 1.3045745300991147
Energy: 1.3070690698521148
Energy: 1.3253511117830645
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Energy: 1.2983725005266158
Energy: 1.2228510795341005
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Energy: 1.2895611716937379
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Energy: 1.322869932325991
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Energy: 1.2640379182404302
Energy: 1.2850915717450548
Energy: 1.2754882009055863
Energy: 1.2963351790752025
Energy: 1.2925544443558152
Energy: 1.2660842790366764
Energy: 1.3196800019810775
Energy: 1.3221349442280137
Energy: 1.2846660340751086
Energy: 1.315057870466822
Energy: 1.3375301148937448
Energy: 1.2931310259718998
Energy: 1.277871597984091
Energy: 1.3476579269881492
Energy: 1.3224884255556417
Energy: 1.3291105834775543
Energy: 1.266443295446794
Energy: 1.3009185648866373
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Energy: 1.278160599976236
Energy: 1.3154990271464528
Energy: 1.2636237059355822
Energy: 1.2572818352955242
Energy: 1.255698968860757
Energy: 1.2752686925049488
Energy: 1.2623551098725818
Energy: 1.2514939758165295
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Energy: 1.2397524499240584
Energy: 1.2524563880889485
Energy: 1.2628944374335889
Energy: 1.2475571758222985
Energy: 1.2462127272449828
Energy: 1.2595857553145648
Energy: 1.2346012012653647
Energy: 1.2863460598925334
Energy: 1.301823105823956
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Energy: 1.2839662912633762
Energy: 1.2791927125987494
Energy: 1.3053422484574206
Energy: 1.2838220870506705
Energy: 1.2940017874710081
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Energy: 1.3175911844602546
Energy: 1.3313485423975182
Energy: 1.353543907462428
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Energy: 1.221110499582651
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Energy: 1.19804694098313
Energy: 1.2204998983181525
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Energy: 1.2924709314518703
Energy: 1.2682937834975931
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Energy: 1.2438994417413287
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Energy: 1.2897041259351572
Energy: 1.259113329872909
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Energy: 1.2569363014259614
Energy: 1.2973025950947723
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Energy: 1.2877991230751544
Energy: 1.2185208013992181
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Energy: 1.2657534513082744
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Energy: 1.2605100159226164
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Energy: 1.2570320728595024
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Energy: 1.2148626606225539
Energy: 1.2435592300123541
Energy: 1.248313142885563
Energy: 1.251072115340493
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Energy: 1.2571376934093825
Energy: 1.2315922746965553
Energy: 1.2933871230008043
Energy: 1.2321937957040447
Energy: 1.245762325212327
Energy: 1.2429172220014424
Energy: 1.286624333417019
Energy: 1.250462145195579
Energy: 1.264375136704735
Energy: 1.2404275633067636
Energy: 1.2874716964226416
Energy: 1.3223672424444652
Energy: 1.3178902953761653
Energy: 1.2761639119084682
Energy: 1.281236093735536
Energy: 1.2676573720279263
Energy: 1.230456533788117
Energy: 1.2317602104611933
Energy: 1.230514390501321
Energy: 1.2547289418449161
Energy: 1.238485776576479
Energy: 1.2289129174521045
Energy: 1.2851081932014348
Energy: 1.2450640035337983
Energy: 1.2454476798384373
Energy: 1.291532699979473
Energy: 1.25226713836164
Energy: 1.2369932522030682
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Energy: 1.2225027614452761
Energy: 1.3613002215109622
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Energy: 1.3057209882557992
Energy: 1.4373390638858003
Energy: 1.3573523409454318
Energy: 1.3444022556890887
Energy: 1.2775002620319325
Energy: 1.2595654322818812
Energy: 1.2983477940864767
Energy: 1.2972572867536896
Energy: 1.2697273882495423
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Energy: 1.2630596495063893
Energy: 1.3077794635891882
Energy: 1.2356936655059525
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Energy: 1.2560076601830301
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Energy: 1.2567405774446547
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Energy: 1.2395511373155317
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Energy: 1.3431493752301193
Energy: 1.249362882548124
Energy: 1.2995819263513098
Energy: 1.2801537090718171
Energy: 1.3293094985983718
Energy: 1.2037196996795663
Energy: 1.3011034279522415
Energy: 1.2739835553450432
Energy: 1.2130188000916653
Energy: 1.3344983153263128
Energy: 1.2664251604986203
Energy: 1.3153234402640848
Energy: 1.2724428889464647
Energy: 1.2613898760310474
Energy: 1.3454503333330663
Energy: 1.274220114094827
Energy: 1.3682113541845582
Energy: 1.2789260341807465
Energy: 1.2762726294186182
Energy: 1.289967078473625
Energy: 1.3087911826834202
Energy: 1.2814061177476017
Energy: 1.2883328621443804
Energy: 1.2824155249814522
Energy: 1.2462869929347993
Energy: 1.2429855723201266
Energy: 1.2350096598561042
Energy: 1.2454932342868414
Energy: 1.2328436595741827
Energy: 1.2412634781140306
Energy: 1.2631107219479498
Energy: 1.2536215634048173
Energy: 1.2523823702275783
Energy: 1.2466193509482704
Energy: 1.2632004153848528
Energy: 1.268407901157508
Energy: 1.2334518321702614
Energy: 1.2425969273361392
Energy: 1.3238365634838027
Energy: 1.3234382311167272
Energy: 1.3050790485549337
Energy: 1.2672438133037334
Energy: 1.2892337175654762
Energy: 1.3173091139729243
Energy: 1.3198550096387411
Energy: 1.2897901116519312
Energy: 1.294997722805544
Energy: 1.3442440949948857
Energy: 1.2687757794073415
Energy: 1.282089336069677
Energy: 1.317044173129096
Energy: 1.278942548944626
Energy: 1.265250375134581
Energy: 1.2608744262439622
Energy: 1.3268082821530718
Energy: 1.2748023190246593
Energy: 1.2871878841978472
Energy: 1.3181898799325122
Energy: 1.277551888881372
Energy: 1.2537026294919897
Energy: 1.282173099248361
Energy: 1.3014753692295957
Energy: 1.2904570553169512
Energy: 1.2922482850505028
Energy: 1.295061964063997
Energy: 1.2949585195602975
Energy: 1.2223336854282896
Energy: 1.2817354971963615
Energy: 1.3268215068105975
Energy: 1.337007785476499
Energy: 1.3382067603517618
Energy: 1.332051204619686
Energy: 1.2398736291791483

minimum gb energy = 1.19804694098313 eV
minimum distance =  2.25413806822356 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 2.19510446230892
Energy: 1.3394710047218132
Energy: 1.3180715477124432
Energy: 1.2890543651376198
Energy: 1.2209733968214045
Energy: 1.3989373851546958
Energy: 1.333173898082957
Energy: 1.223986938369241
Energy: 1.2641964817753273
Energy: 1.3221402933060813
Energy: 1.2518864986302727
Energy: 1.2778716503751733
Energy: 1.3234158757336103
Energy: 1.2561092418728594
Energy: 1.2684003951878762
Energy: 1.2841775548996435
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Energy: 1.3220718433489262
Energy: 1.3582997222462152
Energy: 1.2650408104176225
Energy: 1.3373782536130732
Energy: 1.296017717784453
Energy: 1.3183027394052336
Energy: 1.302884148051207
Energy: 1.332324373901492
Energy: 1.2684784719888298
Energy: 1.2736315976405281
Energy: 1.3057944900019853
Energy: 1.3113457161253665
Energy: 1.270262119065253
Energy: 1.2964355373106102
Energy: 1.2945629739706983
Energy: 1.26287686286556
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Energy: 1.3604263758716264
Energy: 1.2753164798450587
Energy: 1.3208728044488882
Energy: 1.3357052637420765
Energy: 1.3629795413400985
Energy: 1.3453243269990212
Energy: 1.3237249032931244
Energy: 1.3207523612930092
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Energy: 1.259840858656128
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Energy: 1.2012897942965357
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Energy: 1.1979356542496926
Energy: 1.1690819901342584
Energy: 1.257829985036925
Energy: 1.2427503163148248
Energy: 1.2290319652828439
Energy: 1.2366891383508363
Energy: 1.2558824355425093
Energy: 1.2574277991416287
Energy: 1.1900084304977747
Energy: 1.2397428968332493
Energy: 1.2396935398841071
Energy: 1.223883868670633
Energy: 1.2465852795815422
Energy: 1.2541062087801818
Energy: 1.239232689661046
Energy: 1.1872644636967562
Energy: 1.2128101682735426
Energy: 1.2631184543758693
Energy: 1.1893641602279812
Energy: 1.2407625650934822
Energy: 1.259136990851639
Energy: 1.1868160325278159
Energy: 1.17760436529153
Energy: 1.2621872576636952
Energy: 1.284268242282752
Energy: 1.3241264746636627
Energy: 1.2405482319510912
Energy: 1.2533761969126573
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Energy: 1.1876450271511316
Energy: 1.3346757961075209
Energy: 1.2540046586232227
Energy: 1.2048626096236257
Energy: 1.3476442849200596
Energy: 1.2988173695625094
Energy: 1.3141077175813358
Energy: 1.2032841317471497
Energy: 1.254122027136372
Energy: 1.2621368928507204
Energy: 1.3335273767608449
Energy: 1.188057875053432
Energy: 1.3528281734120826
Energy: 1.3063649287085546
Energy: 1.3377591748911877
Energy: 1.2558247768443627
Energy: 1.3217861623570617
Energy: 1.4284754241487954
Energy: 1.3534223797946034
Energy: 1.3452554965193655
Energy: 1.3415106058080017
Energy: 1.2622289818819652
Energy: 1.3516080872212881
Energy: 1.3575548990425745
Energy: 1.398394153729255
Energy: 1.2577650177035247
Energy: 1.3330377426875963
Energy: 1.4115733986671632
Energy: 1.319817699304296
Energy: 1.299365096842545
Energy: 1.286088146033814
Energy: 1.3042528507765485
Energy: 1.2798472343154914
Energy: 1.3020623812412384
Energy: 1.3130435347151275
Energy: 1.29350033369241
Energy: 1.3074969258749782
Energy: 1.318038257616938
Energy: 1.3154939483518309
Energy: 1.3414925802006419
Energy: 1.3025307308569227
Energy: 1.3331494969397673
Energy: 1.3235726052734227
Energy: 1.292854578673847
Energy: 1.3121353396342936
Energy: 1.2590455053420837
Energy: 1.2985473838535275
Energy: 1.3323021583346017
Energy: 1.308156524326161
Energy: 1.2858495163672399
Energy: 1.333545267221239
Energy: 1.3391026536835955
Energy: 1.3979176543816063
Energy: 1.312118925564215
Energy: 1.3491782800366097
Energy: 1.4031144296162006
Energy: 1.27530167703165
Energy: 1.3686313460578596
Energy: 1.3526124011956193
Energy: 1.3763373018722431
Energy: 1.3205311970528388
Energy: 1.348639042100583
Energy: 1.2946439328681316
Energy: 1.334577032281489
Energy: 1.4172441995444038
Energy: 1.356750488308405
Energy: 1.315711841812244
Energy: 1.291963705254783
Energy: 1.3262232914889625
Energy: 1.3139451163779998
Energy: 1.3102958497123027
Energy: 1.2927262695433204
Energy: 1.3229355417188422
Energy: 1.2807241699939973
Energy: 1.2811116317374007
Energy: 1.3357001137060094
Energy: 1.2761893056862361
Energy: 1.2872499060912042
Energy: 1.3558881734712438
Energy: 1.3193818907548824
Energy: 1.255733551157218
Energy: 1.2946297315997464
Energy: 1.3385482877422328
Energy: 1.287844446266036
Energy: 1.2823347530103684
Energy: 1.2963652537633563
Energy: 1.2909162844963111
Energy: 1.2780600562515418
Energy: 1.3339264586293447
Energy: 1.3094321253528258
Energy: 1.233554568219207
Energy: 1.3178733113134804
Energy: 1.263885915041818
Energy: 1.2906891902073423
Energy: 1.2836503873594562
Energy: 1.2893117505012757
Energy: 1.2769551631271276
Energy: 1.3255973095372529
Energy: 1.295733666376478
Energy: 1.2178888536139376
Energy: 1.2907544823896375
Energy: 1.318698419507911
Energy: 1.2695325438747775
Energy: 1.2895785917923166
Energy: 1.3965766678279479
Energy: 1.2934362562457191
Energy: 1.2832482827741942
Energy: 1.29919957966462
Energy: 1.3388292544242821
Energy: 1.281611862998374
Energy: 1.2968435193260266
Energy: 1.2994623323768677
Energy: 1.2350475564551384
Energy: 1.2773842318089872
Energy: 1.3073039662506676
Energy: 1.2145037341020282
Energy: 1.2601879812376444
Energy: 1.3074407464402578
Energy: 1.2558162869698482

minimum gb energy = 1.1690819901342584 eV
minimum distance =  2.21606851079013 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.4885621955738066
Energy: 1.3991480532393126
Energy: 1.405858019057659
Energy: 1.4932081895522336
Energy: 1.4671798073942381
Energy: 1.7322355466562127
Energy: 1.46439751100839
Energy: 1.2159228539880147
Energy: 1.3845061783454657
Energy: 1.2238692757993215
Energy: 1.2122852209603736
Energy: 1.1981393725180178
Energy: 1.241004473485258
Energy: 1.2139701317314238
Energy: 1.251936297659376
Energy: 1.2281292231179257
Energy: 1.2188271691275303
Energy: 1.2681686876540563
Energy: 1.2448074837295038
Energy: 1.2333680935612197
Energy: 1.237095763214812
Energy: 1.1713179056724508
Energy: 1.3502237644272912
Energy: 1.2978232959105327
Energy: 1.1731376987461888
Energy: 1.1725302893685055
Energy: 1.2350965500065512
Energy: 1.2535176329546573
Energy: 1.2254938653595664
Energy: 1.2362032902595128
Energy: 1.3123489520097753
Energy: 1.2874030445054587
Energy: 1.2424180152087174
Energy: 1.2788247289518901
Energy: 1.2672856162758506
Energy: 1.3823084315790835
Energy: 1.36580627106786
Energy: 1.4161287448951922
Energy: 1.4148881522019252
Energy: 1.3844752831284413
Energy: 1.3724258187973735
Energy: 1.3650109454627433
Energy: 1.358711700009637
Energy: 1.339421932200532
Energy: 1.3514831142137391
Energy: 1.384956867991698
Energy: 1.3551472078695235
Energy: 1.3290334855717012
Energy: 1.4116239932728756
Energy: 1.2415595869760743
Energy: 1.2138334507935054
Energy: 1.2236331003958765
Energy: 1.2510642202574305
Energy: 1.2196716065013251
Energy: 1.2196856527736477
Energy: 1.2890874587853112
Energy: 1.315945993338637
Energy: 1.2263759013856306
Energy: 1.2635630443879131
Energy: 1.193749079166313
Energy: 1.2066933684295185
Energy: 1.2769224223598905
Energy: 1.3175368259843363
Energy: 1.3428380302258989
Energy: 1.3684410496477157
Energy: 1.3567733568911902
Energy: 1.3392194487642322
Energy: 1.2204450466697487
Energy: 1.3409992601971212
Energy: 1.3202165925868403
Energy: 1.2066936026360002
Energy: 1.2094368449380786
Energy: 1.2303373857370279
Energy: 1.227813264529511
Energy: 1.2348413111567849
Energy: 1.2222634618464785
Energy: 1.2861226417446832
Energy: 1.3886307073093258
Energy: 1.399241998726441
Energy: 1.3997336965692626
Energy: 1.3963095523927707
Energy: 1.3011292456717285
Energy: 1.3962090468315664
Energy: 1.3818632011451266
Energy: 1.4006540648390158
Energy: 1.3986925008974933
Energy: 1.4135386965620367
Energy: 1.4373504163770852
Energy: 1.4601013126039206
Energy: 1.4433741089328107
Energy: 1.4418818971580902
Energy: 1.2609022311288716
Energy: 1.2332106005091372
Energy: 1.2370437080615357
Energy: 1.2602173917340918
Energy: 1.2630981190882125
Energy: 1.2195360850307435
Energy: 1.2236203096893492
Energy: 1.2878070787250655
Energy: 1.238195110959436
Energy: 1.3285455447205294
Energy: 1.315516102157359
Energy: 1.2162040036014155
Energy: 1.2522217063748418
Energy: 1.2607382831283562
Energy: 1.324060434506785
Energy: 1.296191683083932
Energy: 1.3139359264493444
Energy: 1.3194125382964272
Energy: 1.2011221935959735
Energy: 1.2841835817891014
Energy: 1.3047489390993032
Energy: 1.3174015721100487
Energy: 1.3330988161749002
Energy: 1.2403428492655713
Energy: 1.2340980854212307
Energy: 1.2707939924579499
Energy: 1.2854686906683663
Energy: 1.2524547399915205
Energy: 1.3787126418529156
Energy: 1.3814234787614172
Energy: 1.36007232129513
Energy: 1.3811786468692597
Energy: 1.4253226588374364
Energy: 1.4146958981520097
Energy: 1.39885313383225
Energy: 1.3937078374489116
Energy: 1.4125651659498308
Energy: 1.3362076884066907
Energy: 1.3482530651986038
Energy: 1.2271564109221138
Energy: 1.3581486574097241
Energy: 1.350974107195486
Energy: 1.2392849835571382
Energy: 1.2204069324195046
Energy: 1.2436656766248866
Energy: 1.254544845673642
Energy: 1.219631566961866
Energy: 1.2293071816963907
Energy: 1.2665063859436116
Energy: 1.345221743531742
Energy: 1.3237746574675988
Energy: 1.2580229482689038
Energy: 1.3048227061709923
Energy: 1.2697794702352974
Energy: 1.336681899819904
Energy: 1.253056413394043
Energy: 1.3220886477254343
Energy: 1.2067405039227292
Energy: 1.232251669414016
Energy: 1.3139974640462175
Energy: 1.2537711855255644
Energy: 1.2755517592904069
Energy: 1.26632981131296
Energy: 1.2904291277240538
Energy: 1.2225787079602954
Energy: 1.238349604130078
Energy: 1.229783663878304
Energy: 1.2094727110645158
Energy: 1.2409173550809622
Energy: 1.23244383875077
Energy: 1.3814767074699008
Energy: 1.3740529956205498
Energy: 1.3723905059575088
Energy: 1.3518768968392867
Energy: 1.468428528326496
Energy: 1.37337741565413
Energy: 1.344233420194095
Energy: 1.3822404452397206
Energy: 1.3738993623846059
Energy: 1.3738491149633583
Energy: 1.3712974068439783
Energy: 1.3981302125931614
Energy: 1.3732500024915213
Energy: 1.3511582902869756
Energy: 1.231683232522597
Energy: 1.1984361910474568
Energy: 1.2387455203928457
Energy: 1.2304623238480186
Energy: 1.2124852730164177
Energy: 1.2663519293942493
Energy: 1.258488712625198
Energy: 1.3199000635944718
Energy: 1.219654882454429
Energy: 1.2199073846794461
Energy: 1.2749743062375978
Energy: 1.2445960149245547
Energy: 1.2644340894709247
Energy: 1.2750157582661836
Energy: 1.1873013020830827
Energy: 1.311672111045662
Energy: 1.2326570196425588
Energy: 1.2185418145133415
Energy: 1.1909409678793665
Energy: 1.2914930822066817
Energy: 1.2185352633565596
Energy: 1.2875877750857905
Energy: 1.2365572630629424
Energy: 1.239370566266627
Energy: 1.2466107020890682
Energy: 1.2347309760036076
Energy: 1.2594531723179172
Energy: 1.2285630882721965
Energy: 1.4209340660825232
Energy: 1.3959561748428868
Energy: 1.382165715450053
Energy: 1.419646770352664
Energy: 1.3890565891672881
Energy: 1.4288142869799312
Energy: 1.4406736541307035
Energy: 1.3740878399478402
Energy: 1.3646179066001551
Energy: 1.367818708522244
Energy: 1.3583733337735397
Energy: 1.2781791702122978
Energy: 1.3579360882179758
Energy: 1.356932818608353
Energy: 1.238653586239617
Energy: 1.244437697274721
Energy: 1.2472240932359195
Energy: 1.2533514018847989
Energy: 1.271398587942612
Energy: 1.2451933601567984
Energy: 1.2086057962632697
Energy: 1.249417185597279
Energy: 1.2573800051173705
Energy: 1.3692649889398862
Energy: 1.2632536926213669
Energy: 1.3327597857464117
Energy: 1.2817566378852985
Energy: 1.3379852367298097
Energy: 1.2144918154242093
Energy: 1.208735328747511
Energy: 1.2195368672778057
Energy: 1.2416640631784412
Energy: 1.2250307610148266
Energy: 1.2436425621876508
Energy: 1.208073905532895
Energy: 1.2377482996756641
Energy: 1.1984602032748084
Energy: 1.2256141095577888
Energy: 1.2100470705599227
Energy: 1.213755455138066
Energy: 1.2339328151401003
Energy: 1.2126807691976824
Energy: 1.4232692629356634
Energy: 1.3932600263362422
Energy: 1.4099133436012576
Energy: 1.4007821873513988
Energy: 1.466076976087397
Energy: 1.3446786487242604
Energy: 1.374591564713249

minimum gb energy = 1.1713179056724508 eV
minimum distance =  2.2609672409948 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.5268801346463035
Energy: 1.4722899522178874
Energy: 1.4305920117956548
Energy: 1.5221473200063391
Energy: 1.5248251994376374
Energy: 1.1533098106207813
Energy: 1.5202221442002828
Energy: 1.195883689599466
Energy: 1.2740646664481554
Energy: 1.1556935874949334
Energy: 1.2649450924093468
Energy: 1.2731380035397346
Energy: 1.1710183547871766
Energy: 1.1985162283543485
Energy: 1.2622684405317226
Energy: 1.166700931847677
Energy: 1.2125364755633323
Energy: 1.2673038796612843
Energy: 1.2631235222230586
Energy: 1.2142956940536096
Energy: 1.302862567326288
Energy: 1.3411916123389798
Energy: 1.0693879773630774
Energy: 1.3226893739498762
Energy: 1.227782923322848
Energy: 1.0694840403153192
Energy: 1.0698882565068875
Energy: 1.2270052283763366
Energy: 1.1668127962982264
Energy: 1.1681885911136582
Energy: 1.2113542503774921
Energy: 1.2123750818603498
Energy: 1.165512585600267
Energy: 1.2137537382140537
Energy: 1.2100451985273757
Energy: 1.2346962157559913
Energy: 1.1569422780818002
Energy: 1.1808045672809548
Energy: 1.1546310270089675
Energy: 1.1494354160628655
Energy: 1.1790976940138742
Energy: 1.1553273319998358
Energy: 1.2207595482141986
Energy: 1.147673563242233
Energy: 1.158052914902681
Energy: 1.2572980817080164
Energy: 1.1460904070846345
Energy: 1.1477694286303162
Energy: 1.1531014599444367
Energy: 1.220725832892984
Energy: 1.2524086179669036
Energy: 1.1857986513137073
Energy: 1.2244010103155938
Energy: 1.2595317518378735
Energy: 1.14544717976988
Energy: 1.2887234848293547
Energy: 1.36243978231984
Energy: 1.242858524816724
Energy: 1.1813715282693813
Energy: 1.3629923473283825
Energy: 1.2640528439656802
Energy: 1.1816083193391003
Energy: 1.414505340948566
Energy: 1.3627668583999815
Energy: 1.4124948115595424
Energy: 1.425470645727978
Energy: 1.4004639840368343
Energy: 1.3636570001948647
Energy: 1.1576358406367129
Energy: 1.403478786012208
Energy: 1.255164973552695
Energy: 1.2491246289483915
Energy: 1.1786166180187498
Energy: 1.2677112435995037
Energy: 1.2695408495937548
Energy: 1.1790773817850924
Energy: 1.2656768124642581
Energy: 1.251582562241674
Energy: 1.135120356457511
Energy: 1.2177113248307676
Energy: 1.2086541917187505
Energy: 1.2081158780768628
Energy: 1.2055667984224947
Energy: 1.302685855449784
Energy: 1.2082921123138326
Energy: 1.1344804811536893
Energy: 1.5252588926932764
Energy: 1.5034350530072793
Energy: 1.2242290198155914
Energy: 1.1370233692875105
Energy: 1.435988630981054
Energy: 1.263669995383988
Energy: 1.1497463917195476
Energy: 1.177719872790054
Energy: 1.2669717326553978
Energy: 1.219987447991789
Energy: 1.2148625548573917
Energy: 1.3037669131830922
Energy: 1.3776458736302417
Energy: 1.265625576741594
Energy: 1.2151547725021845
Energy: 1.4002124832452205
Energy: 1.2324990183046696
Energy: 1.1757056279984963
Energy: 1.410779797107618
Energy: 1.5229469101475626
Energy: 1.380363866822056
Energy: 1.4665872277305585
Energy: 1.5047881854306453
Energy: 1.5187199012215882
Energy: 1.152199566758069
Energy: 1.5148197323389296
Energy: 1.2568438218375304
Energy: 1.2604115249790282
Energy: 1.1558147181872416
Energy: 1.2650255793199243
Energy: 1.270966050769667
Energy: 1.1739787236607782
Energy: 1.1991906846501603
Energy: 1.263302388347193
Energy: 1.1676326628470215
Energy: 1.1920578513147762
Energy: 1.2619270335574855
Energy: 1.262817325571247
Energy: 1.214746429423837
Energy: 1.3026419976475594
Energy: 1.3176378495209893
Energy: 1.0687524615161788
Energy: 1.2490351199363503
Energy: 1.228115820483139
Energy: 1.0707907093151277
Energy: 1.0699912351247596
Energy: 1.227024209923535
Energy: 1.1539948048597641
Energy: 1.1684510946362272
Energy: 1.2112897744606559
Energy: 1.2119847610880932
Energy: 1.1653271742213143
Energy: 1.2137350532635383
Energy: 1.2101144022954362
Energy: 1.2401111703124024
Energy: 1.1563631316523026
Energy: 1.180247226912054
Energy: 1.15525083686721
Energy: 1.149571379383849
Energy: 1.1791004637985718
Energy: 1.1553853018654598
Energy: 1.221081489094909
Energy: 1.1478483371322188
Energy: 1.1608767181522839
Energy: 1.265432072265723
Energy: 1.1455411397795048
Energy: 1.14807302402007
Energy: 1.15294766310412
Energy: 1.2268893768017204
Energy: 1.2516563635637334
Energy: 1.1859337868141233
Energy: 1.2241251315197175
Energy: 1.2597975727662796
Energy: 1.1453430365810906
Energy: 1.2887922519306745
Energy: 1.3646495366503677
Energy: 1.2655019658538376
Energy: 1.1812278313247815
Energy: 1.3627841823589912
Energy: 1.3627120544045623
Energy: 1.1812708960971687
Energy: 1.4141276141341665
Energy: 1.362650211567628
Energy: 1.151681613337712
Energy: 1.4298089770796454
Energy: 1.4027785010475238
Energy: 1.3623384613541158
Energy: 1.144783139004255
Energy: 1.4031841151782445
Energy: 1.2543323390612457
Energy: 1.249229918608808
Energy: 1.1778253586393432
Energy: 1.2669446157840618
Energy: 1.2463470746895917
Energy: 1.1793972560147077
Energy: 1.266170487640658
Energy: 1.207245173909728
Energy: 1.134309851924549
Energy: 1.2164640121467842
Energy: 1.2073020595423114
Energy: 1.2079442001269498
Energy: 1.2055200125202494
Energy: 1.451742186557204
Energy: 1.2114646117959418
Energy: 1.134141511405887
Energy: 1.5253021713256218
Energy: 1.5229154088713959
Energy: 1.2238056518809188
Energy: 1.1366440694071884
Energy: 1.4362277760249056
Energy: 1.2587061805068955
Energy: 1.149690966203829
Energy: 1.1777663862882144
Energy: 1.2666362267325648
Energy: 1.2204854125741196
Energy: 1.1693665257055128
Energy: 1.3033224452568513
Energy: 1.3775812798958451
Energy: 1.2651995418193753
Energy: 1.2000551543729638
Energy: 1.3988050480877228
Energy: 1.2311006579007688
Energy: 1.1763932141292615
Energy: 1.410851228370282

minimum gb energy = 1.0687524615161788 eV
minimum distance =  2.25925859726589 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.7043144036898141
Energy: 1.31793996939354
Energy: 1.3182526813340778
Energy: 1.2637443917169895
Energy: 1.5101329328352284
Energy: 1.2834715887740438
Energy: 1.282444838450068
Energy: 1.3080414405557117
Energy: 1.2600244821860476
Energy: 1.2996832700046395
Energy: 1.3054151179475115
Energy: 1.3065143883959718
Energy: 1.3272490752759702
Energy: 1.3067285759735554
Energy: 1.3055990248496627
Energy: 1.273192585925683
Energy: 1.2197044317893933
Energy: 1.3323019577228525
Energy: 1.248498760188805
Energy: 1.1524784870772409
Energy: 1.3076110921448945
Energy: 1.308979328088831
Energy: 1.303385798524269
Energy: 1.2781385378613859
Energy: 1.309520921397133
Energy: 1.3229181281032925
Energy: 1.2750521346030734
Energy: 1.2963531789489373
Energy: 1.2778890677669763
Energy: 1.1175380299189868
Energy: 1.1511138464187467
Energy: 1.2546885587839052
Energy: 1.301200690345519
Energy: 1.108643446324179
Energy: 1.2186801595822256
Energy: 1.1818189200907967
Energy: 1.1264189949577346
Energy: 1.1508600403464067
Energy: 1.2409493436873709
Energy: 1.126760232599453
Energy: 1.150622281442697
Energy: 1.1978377513987304
Energy: 1.2379531930489862
Energy: 1.197444181636917
Energy: 1.1088001267391463
Energy: 1.2043690344391023
Energy: 1.2028750846459157
Energy: 1.206594053080985
Energy: 1.1145262816031538
Energy: 1.1756486159312556
Energy: 1.2675368862013594
Energy: 1.1108548567798082
Energy: 1.187241261070307
Energy: 1.1827036018942831
Energy: 1.194078132189777
Energy: 1.2167982929905625
Energy: 1.10103764309122
Energy: 1.0923794007450407
Energy: 1.1396774638221692
Energy: 1.1334516157532952
Energy: 1.0945938118135978
Energy: 1.1376793143762804
Energy: 1.125171775848937
Energy: 1.0895887618534488
Energy: 1.116051877231612
Energy: 1.1391500290720336
Energy: 1.0882079243468032
Energy: 1.1020771106366485
Energy: 1.129373378063136
Energy: 1.1510223328328102
Energy: 1.1325230219941576
Energy: 1.1263704487840542
Energy: 1.131796060435025
Energy: 1.13324991067567
Energy: 1.1192487011041048
Energy: 1.235486690312319
Energy: 1.1350206460954229
Energy: 1.1497617541860494
Energy: 1.1907253013899983
Energy: 1.1184314439445153
Energy: 1.1307683099852233
Energy: 1.2387965375244783
Energy: 1.1304233225631675
Energy: 1.131392876776332
Energy: 1.1405653541591967
Energy: 1.1268909826271536
Energy: 1.0890703275262958
Energy: 1.0825481341834955
Energy: 1.131885168251036
Energy: 1.1068889820066616
Energy: 1.0829424867503794
Energy: 1.1476794561207584
Energy: 1.137809087512722
Energy: 1.1008595342310958
Energy: 1.1279037414395465
Energy: 1.21555191546351
Energy: 1.1023487577276847
Energy: 1.136784882354492
Energy: 1.1272261250724027
Energy: 1.1293141880278597
Energy: 1.173966192384077
Energy: 1.0899829654889348
Energy: 1.1302474900654318
Energy: 1.0997819476545558
Energy: 1.0910846774775784
Energy: 1.3203230377253459
Energy: 1.1924092587117834
Energy: 1.2028435281330985
Energy: 1.2063265249557615
Energy: 1.1944000909605357
Energy: 1.199805532794284
Energy: 1.265483619796336
Energy: 1.2079229206898383
Energy: 1.1903242358591974
Energy: 1.1276621075809663
Energy: 1.2404115875655728
Energy: 1.1518933099367819
Energy: 1.1273993245167102
Energy: 1.1698974528424597
Energy: 1.2108629343098014
Energy: 1.1507760371508056
Energy: 1.120611985730288
Energy: 1.2339703704216782
Energy: 1.150914515087065
Energy: 1.212837168350417
Energy: 1.2109204032040393
Energy: 1.309520212769881
Energy: 1.2792407758571052
Energy: 1.393277035226889
Energy: 1.2944502485535407
Energy: 1.2748001008796495
Energy: 1.2786247329388567
Energy: 1.2210721701568779
Energy: 1.2975020904142822
Energy: 1.151245004154075
Energy: 1.2991564996246698
Energy: 1.3055377278447517
Energy: 1.220128198307249
Energy: 1.2479360699745825
Energy: 1.3074592435512358
Energy: 1.1969229932220036
Energy: 1.219798036492535
Energy: 1.2524766705735568
Energy: 1.3013627164050534
Energy: 1.2249354849218281
Energy: 1.151429951680114
Energy: 1.3023982834887269
Energy: 1.284344320770856
Energy: 1.2103911286463855
Energy: 1.3161282560172625
Energy: 1.282616095349224
Energy: 1.2255505973985528
Energy: 1.3997632975350196
Energy: 1.3108326271515756
Energy: 1.3093918790652554
Energy: 1.3053466134439449
Energy: 1.3174767958645606
Energy: 1.3194618162548835
Energy: 1.2980400182900775
Energy: 1.2021362887953218
Energy: 1.3001417721466255
Energy: 1.3027057446374042
Energy: 1.316157870862802
Energy: 1.3205650225703494
Energy: 1.3054582102719794
Energy: 1.3069055333062403
Energy: 1.3145233372735572
Energy: 1.3063627858056792
Energy: 1.3418154078513056
Energy: 1.261345539932848
Energy: 1.300017343413786
Energy: 1.2485472655594676
Energy: 1.3155122634347451
Energy: 1.2993895068991546
Energy: 1.3148111952943116

minimum gb energy = 1.0825481341834955 eV
minimum distance =  2.26406046576404 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.7193320280993842
Energy: 1.1457862072175509
Energy: 1.1365135708365126
Energy: 1.2330114798438623
Energy: 1.2364435791083614
Energy: 1.1593024529705707
Energy: 1.145262394983698
Energy: 1.1750287285050844
Energy: 1.0795050197216924
Energy: 1.1204396295645596
Energy: 1.1495590409785277
Energy: 1.1136976167279846
Energy: 1.1041097636871637
Energy: 1.1864180402214402
Energy: 1.130005288737585
Energy: 1.081730484188083
Energy: 1.1098658329552054
Energy: 1.188253426767744
Energy: 1.1048391642259494
Energy: 1.1110405251574482
Energy: 1.1818384117387233
Energy: 1.0544421933973362
Energy: 1.1433013147989257
Energy: 1.0591450551586206
Energy: 1.0658933674052709
Energy: 1.0888268956828793
Energy: 1.058745896443673
Energy: 1.1845055066331787
Energy: 1.0275410652848305
Energy: 1.0867254959056847
Energy: 1.104220019221302
Energy: 1.11504377991749
Energy: 1.0891077090461925
Energy: 1.0590418664809131
Energy: 1.123392970008915
Energy: 1.046835210791251
Energy: 1.0759727965604458
Energy: 1.1084075748697446
Energy: 1.1010971933958227
Energy: 1.0734270977196816
Energy: 1.10632567932877
Energy: 1.1445632535163726
Energy: 1.0491678608409576
Energy: 1.072913206153235
Energy: 1.0672373408132962
Energy: 1.0959067155655886
Energy: 1.0885655533203102
Energy: 1.1246419675203736
Energy: 1.0819577029954892
Energy: 1.046236102661943
Energy: 1.0329942685511917
Energy: 1.0651244111096903
Energy: 1.0237328015197864
Energy: 1.0455125923841464
Energy: 1.0827419042530129
Energy: 1.0571166500107314
Energy: 1.055467931313012
Energy: 1.0485248209834104
Energy: 1.0804994409523347
Energy: 1.0579962546798163
Energy: 1.0451437260025238
Energy: 1.1072835200998803
Energy: 1.0197278474165816
Energy: 1.016302419257693
Energy: 1.0549598405165987
Energy: 1.0720015638226883
Energy: 1.0605091112188254
Energy: 1.0408490252915583
Energy: 1.1044404150677978
Energy: 1.0591600054322523
Energy: 1.0288627511119424
Energy: 1.0706546008138296
Energy: 1.0300622252530673
Energy: 1.054456052756837
Energy: 1.065956127135006
Energy: 1.0471200405039969
Energy: 1.084300875179619
Energy: 1.0554998265317228
Energy: 1.0813043050216506
Energy: 1.029599016217029
Energy: 1.0342237785070407
Energy: 1.0902593359247987
Energy: 1.0258216695274271
Energy: 1.0351172748974735
Energy: 1.0412247475404477
Energy: 1.0788594570029078
Energy: 1.0146587640378975
Energy: 1.0364182078114272
Energy: 1.068997920807578
Energy: 1.0187137835079232
Energy: 1.0206122035332592
Energy: 1.054611735360224
Energy: 1.0564578203280501
Energy: 1.0188523450621747
Energy: 1.0318250817718564
Energy: 1.065593702758392
Energy: 1.0096250565542586
Energy: 1.0208427889432645
Energy: 1.048251985490993
Energy: 1.0284726177415076
Energy: 1.049380100130357
Energy: 1.0623600505452888
Energy: 1.039909158986232
Energy: 1.0545072521455803
Energy: 1.0705536436848835
Energy: 1.014439144939751
Energy: 1.0151067234616928
Energy: 1.0188589054301342
Energy: 1.033031797686488
Energy: 1.011172543862681
Energy: 1.0346654732271523
Energy: 1.0428245010732913
Energy: 1.027122089911533
Energy: 1.0407096489410508
Energy: 1.0235760547032415
Energy: 1.019233723943147
Energy: 1.0222928386487498
Energy: 1.023316609952343
Energy: 1.0406145164988923
Energy: 1.0457584379549252
Energy: 1.0420564423820367
Energy: 1.0455269005440795
Energy: 1.046902894000589
Energy: 1.035744019201604
Energy: 1.028904846657075
Energy: 1.0607140385177631
Energy: 1.0349033037908262
Energy: 1.0324092199065504
Energy: 1.054525781984872
Energy: 1.0619268606083234
Energy: 1.0277024777291262
Energy: 1.0535352734165657
Energy: 1.0540021976820886
Energy: 1.0039904278474756
Energy: 1.014817093883536
Energy: 1.0461403125708786
Energy: 1.0079906005099644
Energy: 1.009348903054671
Energy: 1.0233066618533835
Energy: 1.0088066995945872
Energy: 1.0508394484777677
Energy: 1.0387530219225067
Energy: 1.0521526255555802
Energy: 1.0331304928542553
Energy: 1.0415320613062315
Energy: 1.0624953795197387
Energy: 1.032986686400545
Energy: 1.0373463179214497
Energy: 1.0698610133201714
Energy: 1.0440746914551116
Energy: 1.0373005371495696
Energy: 1.0618832693708555
Energy: 1.0462607629932628
Energy: 1.038147692205766
Energy: 1.0233742324671131
Energy: 1.0291319991924341
Energy: 1.0087938068014186
Energy: 1.008905341859156
Energy: 1.031905032755088
Energy: 1.010458122678905
Energy: 1.0062426060611016
Energy: 1.0484042939282965
Energy: 1.059080304142455
Energy: 1.02682357664965
Energy: 1.049251807031762
Energy: 1.053636163829272
Energy: 1.0293813885243277
Energy: 1.0441739416924065
Energy: 1.050803722212714
Energy: 1.0591071347873968
Energy: 1.0449469763920638
Energy: 1.0632014050447756
Energy: 1.043060264241502
Energy: 1.0375302540066322
Energy: 1.0487131311387239
Energy: 1.0272446562254045
Energy: 1.0346157512978391
Energy: 1.0191350737710738
Energy: 1.05211977964938
Energy: 1.0218154488651756
Energy: 1.0129483447021426
Energy: 1.0440531386822223
Energy: 1.040118743852225
Energy: 1.0135844972694323
Energy: 1.0135055328715814
Energy: 1.0489315906430337
Energy: 1.0362393738833953
Energy: 1.0110239385773978
Energy: 1.0297911282809247
Energy: 1.0411480666818012
Energy: 1.0589983495970494
Energy: 1.0616494174892586
Energy: 1.0784643836786625
Energy: 1.0530330326923036
Energy: 1.0415027402949504
Energy: 1.090036207586725
Energy: 1.0227477283744582
Energy: 1.0538760706435657
Energy: 1.0506302980186053
Energy: 1.0212959674102846
Energy: 1.0188159388541262
Energy: 1.068191588169703
Energy: 1.0541353800380795
Energy: 1.0306991095096112
Energy: 1.0214553091574021
Energy: 1.0698676696933038
Energy: 1.0236410618107827
Energy: 1.0138287166328113
Energy: 1.0696459965657068
Energy: 1.037965602253683
Energy: 1.0362143957512289
Energy: 1.022107487694158
Energy: 1.0997212947257804
Energy: 1.0384002551924505
Energy: 1.0309158387362785
Energy: 1.097048155777383
Energy: 1.0444431292461789
Energy: 1.0662954252496613
Energy: 1.0578212317651392
Energy: 1.0541100578442477
Energy: 1.0800886096637934
Energy: 1.0288036539140786
Energy: 1.0580755604945573
Energy: 1.057874647662533
Energy: 1.0161615753214168
Energy: 1.0816833461981574
Energy: 1.0445878182113257
Energy: 1.06140027078467
Energy: 1.0950643750724327
Energy: 1.0523634215957396
Energy: 1.0614211958291464
Energy: 1.0865490137101181
Energy: 1.096380728863529
Energy: 1.0470651315607256
Energy: 1.0605651919020864
Energy: 1.1016851784215742
Energy: 1.0460114001222454
Energy: 1.0646163698888034
Energy: 1.082624552572933
Energy: 1.0768545235919746
Energy: 1.0485059539766448
Energy: 1.0656143650662913
Energy: 1.0530790317953367
Energy: 1.0505343281526096
Energy: 1.0483426735941046
Energy: 1.0383235904637993
Energy: 1.0996343593820839
Energy: 1.0848360985289907
Energy: 1.0524139288732721
Energy: 1.1196249411233867
Energy: 1.0754380574044484
Energy: 1.147242163279076
Energy: 1.1179136247232007
Energy: 1.081300986628353
Energy: 1.0776383468892652
Energy: 1.136992880546034
Energy: 1.1056974286122203
Energy: 1.073288638181841
Energy: 1.100905262735196
Energy: 1.1058718184834102
Energy: 1.0594702173990054
Energy: 1.0591425016597693
Energy: 1.136240155439674
Energy: 1.0647503246073111
Energy: 1.0983237010126605
Energy: 1.1137518642067437
Energy: 1.1485634971327883
Energy: 1.0402809393149515
Energy: 1.1142407702296733
Energy: 1.1473129701824645
Energy: 1.061834765501825
Energy: 1.1036635198000249
Energy: 1.0844756346850613
Energy: 1.1232309264707052
Energy: 1.1108728310454519
Energy: 1.1041454291118569
Energy: 1.181318302362957
Energy: 1.105328384027477
Energy: 1.1052734423382988
Energy: 1.1507878939954772
Energy: 1.1354246174163494
Energy: 1.1221026106995917
Energy: 1.1638963747499982
Energy: 1.1352008878154494
Energy: 1.1177770321629255
Energy: 1.076110183205755
Energy: 1.2683781299021624
Energy: 1.0863358465044848
Energy: 1.1964571117317813
Energy: 1.130055441399394
Energy: 1.0811600027264416
Energy: 1.0758518931078727
Energy: 1.208261637896055
Energy: 1.2796881965974636
Energy: 1.144658753339855
Energy: 1.115080435804168
Energy: 1.1097212580760987
Energy: 1.1856499597477286
Energy: 1.1203826020714704
Energy: 1.1102172295774095
Energy: 1.1804879968326103
Energy: 1.186722238111128
Energy: 1.0756287250790848
Energy: 1.1080646618617647
Energy: 1.17830735984078
Energy: 1.108223193796515
Energy: 1.1066375946280083
Energy: 1.188168844023989
Energy: 1.209542472864738
Energy: 1.0772410422042986
Energy: 1.0745087320863784
Energy: 1.1211144091497809
Energy: 1.1229236212186062
Energy: 1.0964552078251137
Energy: 1.0748574992402389

minimum gb energy = 1.0039904278474756 eV
minimum distance =  2.2716793694434 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.265389328887459
Energy: 1.230082661624004
Energy: 1.2204007363004266
Energy: 1.2230240948132944
Energy: 1.222382012913576
Energy: 1.2246632367902324
Energy: 1.223344714212279
Energy: 1.283038328230942
Energy: 0.43519480782365194
Energy: 0.43439841841509447
Energy: 0.43285459730021486
Energy: 0.4329902869899689
Energy: 0.4331600880080508
Energy: 0.43523693184311923
Energy: 0.459913193632404
Energy: 0.44761151622634343
Energy: 0.45563205730551043
Energy: 0.4358457483045702
Energy: 0.4335745582234329
Energy: 0.4507412744942829
Energy: 0.45058289241188887
Energy: 1.2869325264292724
Energy: 1.2795305348892967
Energy: 1.2278056403297661
Energy: 1.2295482708034078
Energy: 1.2331688710393154
Energy: 1.2609722684684133
Energy: 1.259276714825961
Energy: 1.2832907336706414
Energy: 1.2767239142414089
Energy: 1.2770466218801142
Energy: 1.2771279113330667
Energy: 1.2380552016051745
Energy: 1.2756697543225768
Energy: 1.2758269415639663
Energy: 0.45979237627409614
Energy: 0.4354651681275266
Energy: 0.44772694870746177
Energy: 0.4348238579760139
Energy: 0.43406322550662196
Energy: 0.45042031882765443
Energy: 0.4348567560795165
Energy: 1.2837406128132547
Energy: 1.277360852795502
Energy: 1.2556780479070313
Energy: 1.3051770082037302
Energy: 1.227065783005152
Energy: 1.2599336201400362
Energy: 1.2758181846694383
Energy: 1.283580268709008
Energy: 1.2760982312835432
Energy: 1.2623128637292496
Energy: 1.2668905840414069
Energy: 1.3047276228223164
Energy: 1.2159098286833432
Energy: 1.2764077732574746
Energy: 0.45991708955815386
Energy: 0.4353940982448156
Energy: 0.44941874115476027
Energy: 0.4357078667580588
Energy: 0.4340789287796679
Energy: 0.4368823365314207
Energy: 0.44742392655885493
Energy: 1.2855825745697131
Energy: 1.279413642288448
Energy: 1.275678507612572
Energy: 1.2754958793183562
Energy: 1.2767009043212265
Energy: 1.278921251909966
Energy: 1.2767812442587372
Energy: 1.282136738157463
Energy: 1.2756896052719928
Energy: 1.2498090085945375
Energy: 1.2528262072527798
Energy: 1.2322394672850674
Energy: 1.2463340116887967
Energy: 1.2288027326084885
Energy: 0.46000184847423675
Energy: 0.44921366385475703
Energy: 0.4573047866261506
Energy: 0.4336917606458081
Energy: 0.43316974735383573
Energy: 0.4602682133772861
Energy: 0.4476509177505646
Energy: 0.460327362563995
Energy: 0.4353594565413215
Energy: 0.4348535873937165
Energy: 0.43366601510862346
Energy: 0.4331968011689476
Energy: 0.43348404238148824
Energy: 0.4354381813154849
Energy: 1.280095421586345
Energy: 1.278562258423777
Energy: 1.2289779102210294
Energy: 1.2304290444828607
Energy: 1.2308207701759437
Energy: 1.247160620635933
Energy: 1.2277697622023886
Energy: 1.2835058063564873
Energy: 1.2784567727998257
Energy: 1.275942271664952
Energy: 0.4330787063642727
Energy: 0.4330432394686033
Energy: 0.43374867162887754
Energy: 1.2812362661711487
Energy: 0.4593965314408423
Energy: 0.4362909473890139
Energy: 0.4562935443918721
Energy: 0.4379753343992976
Energy: 0.4335387198319904
Energy: 0.4569218652111599
Energy: 0.44920431471896644
Energy: 1.2858150106589301
Energy: 1.2750573309874902
Energy: 1.255773501346503
Energy: 1.2240430428377407
Energy: 1.2251833043159979
Energy: 1.2638000741677469
Energy: 1.2625100088740844
Energy: 1.2839993529517975
Energy: 1.2766366216528868
Energy: 1.2770641612776619
Energy: 1.2298925823025884
Energy: 1.3056491180517844
Energy: 1.2777200265881938
Energy: 1.2755502649582093
Energy: 0.4583231887800315
Energy: 0.43532616708777416
Energy: 0.44789778792619744
Energy: 0.43428439911699696
Energy: 0.4340910956734839
Energy: 0.4506982334433271
Energy: 0.4346507152664877
Energy: 1.283091255971006
Energy: 1.276409024796661
Energy: 1.2787987918935897
Energy: 1.3036467601662998
Energy: 1.3047564065376762
Energy: 1.265443596080837
Energy: 1.275171639823869

minimum gb energy = 0.43285459730021486 eV
minimum distance =  2.28978813554662 Angstroms
sigma value = 23