Model name: model_name=EAM_Dynamo_MendelevKramerHao_2012_NiZr__MO_149104665840_005
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=3.518121123313904
cohesive_energy=4.385853675361089
mass=58.6934
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=[2.5086881735172e-19, 3.3309732873850196e-19, 3.959667398566619e-19, 4.4820090247833e-19, 4.8908043929484e-19, 5.20600060215522e-19, 5.45991355511154e-19, 5.67596707420644e-19, 5.8677315955299e-19, 6.040045692516599e-19, 6.19380658408158e-19, 6.330199880933999e-19, 6.451340456230739e-19, 6.5584940295126595e-19, 6.65294234208696e-19, 6.737425115997779e-19, 6.81434561619612e-19, 6.88258231903818e-19, 6.9372485857902595e-19, 6.973217451223559e-19, 6.994686618119159e-19, 7.010580210328439e-19, 7.022163947392259e-19, 7.02636165017334e-19, 7.02184351206546e-19, 7.00753607472384e-19, 6.982285770971999e-19, 6.944923011867119e-19, 6.89439036083076e-19, 6.82958231598546e-19, 6.748816591865519e-19, 6.64938550995948e-19, 6.527315672215019e-19, 6.3768232209834e-19, 6.189624903066839e-19, 5.95452150379368e-19, 5.656821063430139e-19, 5.2724428671672e-19, 4.75924966953066e-19, 4.04539987025196e-19, 3.00110114021076e-19, 1.389683151385848e-19, -1.217865729155688e-19, -5.61101483346408e-19, -1.3278359289601798e-18, -2.68361381841732e-18, -4.94042380330338e-18, -8.80423297385778e-18, -1.579680471882006e-17, -2.9492867478672e-17, -5.933837403448739e-17, -1.346488469333208e-16, -3.67960692294342e-16, -1.3472254705848479e-15]
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: 0.02187237076324878
Energy: 0.9917594596887483
Energy: 0.5732257033551974
Energy: 1.4005176846854743
Energy: 1.379738035160755
Energy: 0.5090742715765434
Energy: 0.02231219297877024
Energy: 0.14196219135126892
Energy: 0.99005013305346
Energy: 0.4084947287818593
Energy: 0.8525809518812629
Energy: 0.8463065392837705
Energy: 0.02330485775097189
Energy: 0.14285261780801842
Energy: 0.0223141182914832
Energy: 0.993177930883453
Energy: 0.3323937454756799
Energy: 0.8541385313924823
Energy: 0.9898515015708758
Energy: 0.14181450254637265
Energy: 0.14340621391517638
Energy: 0.02519597327488346
Energy: 0.9914493936801939
Energy: 0.5734314992687786
Energy: 1.4033349405340911
Energy: 1.3839511997654224
Energy: 0.14220100119983262
Energy: 0.02270735075307717
Energy: 0.14207354037994147
Energy: 1.3715791861331585
Energy: 0.40818402522306607
Energy: 0.8507615013676153
Energy: 0.8469682266153138
Energy: 0.023055272043773604
Energy: 0.14275933835207108
Energy: 0.022432093882194193
Energy: 0.9933131233647957
Energy: 0.5775944457784983
Energy: 0.5740435889624742
Energy: 1.0683821677595546
Energy: 0.14182645247146083
Energy: 0.14374691330195175

minimum gb energy = 0.02187237076324878 eV
minimum distance =  2.46660247163619 Angstroms
sigma value = 5


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

Energy: 1.5637293549115954
Energy: 1.6077111827896302
Energy: 1.5548214222344885
Energy: 1.6813006117492184
Energy: 1.6454506892815415
Energy: 1.4667159998425805
Energy: 1.658050601681917
Energy: 1.3872725758965718
Energy: 1.459153224602018
Energy: 1.406334042056601
Energy: 1.5195864710745073
Energy: 1.4733081772357075
Energy: 1.3980619878820661
Energy: 1.4505981650743944
Energy: 1.518485292538797
Energy: 1.5242046077626084
Energy: 1.5305364336263911
Energy: 1.4817172647993293
Energy: 1.4972342188833565
Energy: 1.5954127267704643
Energy: 1.4476439263114254
Energy: 1.4040568143168772
Energy: 1.5538251085622212
Energy: 1.4150538948444602
Energy: 1.514220226086645
Energy: 1.4969940475441075
Energy: 1.400464305309748
Energy: 1.5666879049726503
Energy: 1.6701235315184724
Energy: 1.411651954739317
Energy: 1.465600066014565
Energy: 1.3948337297126356
Energy: 1.4981874895973595
Energy: 1.5221268893726785
Energy: 1.4583505093254723
Energy: 1.529601316067637
Energy: 1.484077078129401
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Energy: 1.488628923681266
Energy: 1.5339052748911015
Energy: 1.4859358827455733
Energy: 1.4069607106916069
Energy: 1.5758695374415501
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Energy: 1.5064494362157372
Energy: 1.52185019540848
Energy: 1.5469753221746108
Energy: 1.5499955479523282
Energy: 1.4373671587477912
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Energy: 1.4673909182760632
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Energy: 1.4365434403043136
Energy: 1.436280283055904
Energy: 1.548843918828963
Energy: 1.4727292606881623
Energy: 1.42840732536153
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Energy: 1.4808004181790215
Energy: 1.4051823841820061
Energy: 1.650220084161151
Energy: 1.4074915570574875
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Energy: 1.5223354098620903
Energy: 1.4980580611695733
Energy: 1.4838014048786978
Energy: 1.5137462775877284
Energy: 1.4147423212355266
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Energy: 1.5264478155091745
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Energy: 1.455941401869855
Energy: 1.4473297792994453
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Energy: 1.4075709081148227
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Energy: 1.4691858326893046
Energy: 1.4592262840745398
Energy: 1.6236786270540755
Energy: 1.476525350377448
Energy: 1.5570661596747537
Energy: 1.4846586763914438
Energy: 1.5396299012134549
Energy: 1.4978494905394488
Energy: 1.484742603086158
Energy: 1.456603972705568
Energy: 1.5170956438355478
Energy: 1.4579499670692349
Energy: 1.5244628876889215
Energy: 1.4857229241199754
Energy: 1.519701523310636
Energy: 1.39789560301601
Energy: 1.5780091835725853
Energy: 1.5214043892245712
Energy: 1.4728885819238118
Energy: 1.5427889449100896
Energy: 1.5044345862847872
Energy: 1.6188950648252982
Energy: 1.5360691600251084
Energy: 1.3850405180686787
Energy: 1.422275200733521
Energy: 1.3918338763052922
Energy: 1.4432150649644666
Energy: 1.468359267217644
Energy: 1.4078598766365247
Energy: 1.4817306780023194
Energy: 1.5682856800110523
Energy: 1.6055841081768343
Energy: 1.6007833002850835
Energy: 1.4628180130143296
Energy: 1.5814384838547972
Energy: 1.5524776738639456
Energy: 1.4897398582984296
Energy: 1.4222651323597468
Energy: 1.46477548180313
Energy: 1.3835536304285856
Energy: 1.4721531127816039
Energy: 1.3950608397201265
Energy: 1.4012108006812625
Energy: 1.6426597506065923
Energy: 1.6683542626923846
Energy: 1.527907669064603
Energy: 1.4434632052663694
Energy: 1.4573855800526336
Energy: 1.544861509811262
Energy: 1.4809844283044613
Energy: 1.5098189305860246
Energy: 1.4215608877872616
Energy: 1.3864820115714276
Energy: 1.4101820579480264
Energy: 1.438180197970576
Energy: 1.5456125186943561
Energy: 1.3955170634048204
Energy: 1.442368944695969
Energy: 1.5222426003803922
Energy: 1.4736337631987122
Energy: 1.6080070523705716
Energy: 1.4532011893122403
Energy: 1.5423647163420922
Energy: 1.5196518941240413
Energy: 1.4898788005077581

minimum gb energy = 1.3835536304285856 eV
minimum distance =  2.16361908661443 Angstroms
sigma value = 401


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

Energy: 1.5509222674767427
Energy: 1.452546584653739
Energy: 1.4995967799642267
Energy: 1.4143383519532062
Energy: 1.8295218564720037
Energy: 1.4348577218335803
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Energy: 1.5029123864100353
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Energy: 1.4109940660191156
Energy: 1.4131857102965393
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Energy: 1.4046182232893052
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Energy: 1.4959649772712604
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Energy: 1.4125330372036673
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Energy: 1.4706743424954583
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Energy: 1.4281142747893063
Energy: 1.416367527808479
Energy: 1.4936383459410068
Energy: 1.6837816305662738
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Energy: 1.4194227757494642
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Energy: 1.4295658444758272
Energy: 1.4529001603499183
Energy: 1.5547220445033636
Energy: 1.4493957548743497
Energy: 1.4865307620395118
Energy: 1.4218962356923357
Energy: 1.4417526711801463
Energy: 1.429608553235782
Energy: 1.4316135297692227
Energy: 1.5874092545126293
Energy: 1.538696983456553
Energy: 1.5375230912143303
Energy: 1.6053610323231247
Energy: 1.4395023791615986
Energy: 1.4172686464340627
Energy: 1.4964580109406993
Energy: 1.5399833452903768
Energy: 1.4723214574322636
Energy: 1.487149359364328
Energy: 1.5137376324790999
Energy: 1.4810424642108966
Energy: 1.5340497186744384
Energy: 1.6196556148423222
Energy: 1.4850867076873833
Energy: 1.4172944372692333
Energy: 1.5354103668672503
Energy: 1.4627994409121232
Energy: 1.4593058519691957
Energy: 1.5773140645395574
Energy: 1.4438761681405239
Energy: 1.458307814488529
Energy: 1.409379180329548
Energy: 1.4342483921387676
Energy: 1.5298385194157442
Energy: 1.411520219228033
Energy: 1.4129481321430786
Energy: 1.4672808355404277
Energy: 1.4158143788691304
Energy: 1.4335702409783513
Energy: 1.43359127611287
Energy: 1.4840799818038846
Energy: 1.485699097860269
Energy: 1.4560975330742525
Energy: 1.4715038806003038
Energy: 1.4182283500536614
Energy: 1.42757779583923
Energy: 1.518971793931173
Energy: 1.457029917358393
Energy: 1.4963400682528623
Energy: 1.4821047675575494
Energy: 1.4385900053793428
Energy: 1.5274707530323495
Energy: 1.681222784292322
Energy: 1.5200097554366112
Energy: 1.4083309555447896
Energy: 1.4868885482455703
Energy: 1.4651749371232925
Energy: 1.475651059002439
Energy: 1.5568333710978781
Energy: 1.4301273268645875
Energy: 1.5006737699486916
Energy: 1.4480590167720666
Energy: 1.4613188789287035
Energy: 1.4425696255726348
Energy: 1.4288932897886
Energy: 1.5100748859379347
Energy: 1.62577503459713
Energy: 1.5624159660935641
Energy: 1.428518956376221
Energy: 1.4900213764906645
Energy: 1.4270863832077931
Energy: 1.4441643268358877
Energy: 1.5028770969687952
Energy: 1.4310783440280566
Energy: 1.5080366763078217
Energy: 1.420348329043779
Energy: 1.4686847479550929
Energy: 1.4347930304112035
Energy: 1.4363250805803265
Energy: 1.4621846665187217
Energy: 1.4751890154016996
Energy: 1.4883080327426286
Energy: 1.408270876385819
Energy: 1.4594461365636582
Energy: 1.4177248323569716
Energy: 1.4128443634175503
Energy: 1.5959194147397053
Energy: 1.4681803844959709
Energy: 1.4941142261380735
Energy: 1.4823387198369709
Energy: 1.536820522933432
Energy: 1.4740985783059497
Energy: 1.4503423384144654
Energy: 1.451952380454651
Energy: 1.4529739613824806
Energy: 1.5068805991593022
Energy: 1.47442940518965
Energy: 1.4771533892071533
Energy: 1.6136348329633081
Energy: 1.4181753929568786
Energy: 1.4509141249681607
Energy: 1.413785639452639
Energy: 1.4399468097038413
Energy: 1.4852080658432387
Energy: 1.4065513506700773
Energy: 1.431781086854048
Energy: 1.4620724141385009
Energy: 1.453808646796284

minimum gb energy = 1.4021090995900594 eV
minimum distance =  2.17116662111766 Angstroms
sigma value = 311


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

Energy: 1.520164240355488
Energy: 1.4958400732492152
Energy: 1.5272110989359515
Energy: 1.4455092428307121
Energy: 1.511154438393087
Energy: 1.522636714495743
Energy: 1.5275045824311781
Energy: 1.4732832880738407
Energy: 1.4746550485147296
Energy: 1.4360010828460943
Energy: 1.4691627937915424
Energy: 1.4700489386765392
Energy: 1.4902244570790002
Energy: 1.5287075012338671
Energy: 1.4580158020451905
Energy: 1.488044695222519
Energy: 1.4799308349858424
Energy: 1.524735682634358
Energy: 1.4889178984247415
Energy: 1.4942227620908208
Energy: 1.4789409342963618
Energy: 1.4766910976927847
Energy: 1.5435753479024268
Energy: 1.4526983075926003
Energy: 1.6063906340068574
Energy: 1.505623527121979
Energy: 1.4878372994176963
Energy: 1.5455968351574765
Energy: 1.5215121869247044
Energy: 1.5410125804518777
Energy: 1.4618371021497296
Energy: 1.455463033701208
Energy: 1.48686145656702
Energy: 1.4651820375767968
Energy: 1.4998663800205554
Energy: 1.4605867462584738
Energy: 1.5226535802228147
Energy: 1.470217151708256
Energy: 1.4540761321676274
Energy: 1.4974821278144732
Energy: 1.4977655447596887
Energy: 1.4789432628869779
Energy: 1.6005397969682988
Energy: 1.534727987283643
Energy: 1.5494499211532216
Energy: 1.4449664880989048
Energy: 1.4370152596513228
Energy: 1.5152832862712668
Energy: 1.4945475089218176
Energy: 1.4795817305429797
Energy: 1.5011089524194905
Energy: 1.4153744645389585
Energy: 1.5215426265123095
Energy: 1.4986118329124178
Energy: 1.5445980414998788
Energy: 1.573830287748991
Energy: 1.4976109144214322
Energy: 1.492426827501766
Energy: 1.4608595346772948
Energy: 1.4169757505436733
Energy: 1.5315674743533834
Energy: 1.4855618022972403
Energy: 1.4730208905665858
Energy: 1.4959574066807626
Energy: 1.601771746200235
Energy: 1.4553035285514109
Energy: 1.4599987137380581
Energy: 1.5655628569822835
Energy: 1.4737331744865352
Energy: 1.528987006408689
Energy: 1.5508955821109907
Energy: 1.5495016874096486
Energy: 1.5106684038108833
Energy: 1.5149321380119243
Energy: 1.4773873014134247
Energy: 1.4563647860681983
Energy: 1.5321339236631775
Energy: 1.4663486927804485
Energy: 1.510178705193287
Energy: 1.4839639157060807
Energy: 1.469584864362615
Energy: 1.486428110313063
Energy: 1.48138455620203
Energy: 1.5139115250017943
Energy: 1.5415495393764205
Energy: 1.5487380219549054
Energy: 1.5260681188256031
Energy: 1.4617314074545376
Energy: 1.5092903675075315
Energy: 1.4567295594963798
Energy: 1.571684842888184
Energy: 1.440520151910899
Energy: 1.6235350405502809
Energy: 1.4324056341276128
Energy: 1.5382620698413527
Energy: 1.4510110607802582
Energy: 1.5280755402219193
Energy: 1.4983000585031014
Energy: 1.4507307128458322
Energy: 1.4895786677583442
Energy: 1.5682668050686113
Energy: 1.4489672403342615
Energy: 1.4614747469357297
Energy: 1.4866068639364087
Energy: 1.545406270789208
Energy: 1.466179719852032
Energy: 1.6216596047932328
Energy: 1.4792713389191106
Energy: 1.4951218624891502
Energy: 1.4847099954640701
Energy: 1.47502277507444
Energy: 1.549766018318226
Energy: 1.5005033630834173
Energy: 1.5653581532722043
Energy: 1.4910646447931444
Energy: 1.639766416778616
Energy: 1.4908374166757035
Energy: 1.4796849168797328
Energy: 1.5093038429201915
Energy: 1.4345997874678837
Energy: 1.4567333358936314
Energy: 1.4969088042743801
Energy: 1.4554639452937077
Energy: 1.4839952490508954
Energy: 1.4578091227719192
Energy: 1.4594636204579996
Energy: 1.45479304808794
Energy: 1.4541974001247173
Energy: 1.5092908269431884
Energy: 1.43491787758941
Energy: 1.4730160079797427
Energy: 1.5296907325582358
Energy: 1.5220764707311298
Energy: 1.5143609337774675
Energy: 1.5270919591689527
Energy: 1.5510710503591254
Energy: 1.521435862207923
Energy: 1.6409845200651958
Energy: 1.5349839059394137
Energy: 1.5884541134778147
Energy: 1.509798350613231
Energy: 1.5700962978274657
Energy: 1.4873895473788386
Energy: 1.4731979969344566
Energy: 1.4528306787269412
Energy: 1.454898762572897
Energy: 1.522420447337784
Energy: 1.4640639580970949
Energy: 1.4823274481117241
Energy: 1.4754827202136642
Energy: 1.4679568374550451
Energy: 1.475019839805869
Energy: 1.424906156348527
Energy: 1.5062975611605234
Energy: 1.5515960362442172
Energy: 1.5547701865032
Energy: 1.5136878683757422
Energy: 1.5439173469876037
Energy: 1.5134064673737024
Energy: 1.5132862582389808
Energy: 1.507182893125356
Energy: 1.5328746582955193
Energy: 1.5636992732862425
Energy: 1.4752426549501338
Energy: 1.4432387768842871
Energy: 1.4723135848609283
Energy: 1.437909101966692
Energy: 1.4849702833537908
Energy: 1.542876991285611
Energy: 1.4624157644219622
Energy: 1.4547798654850843
Energy: 1.5168121303385553
Energy: 1.4572766984424457
Energy: 1.5220938565487439
Energy: 1.4508216284690758
Energy: 1.517977423980538
Energy: 1.5809381436063472
Energy: 1.4854772847724402
Energy: 1.5644244227671738
Energy: 1.4965592058874229
Energy: 1.521358416279604
Energy: 1.4626498710316826
Energy: 1.4642126796792312
Energy: 1.5361782727937197
Energy: 1.4670970746926875
Energy: 1.531260566595375
Energy: 1.4552046935435896
Energy: 1.505251035565997
Energy: 1.5312951956721956
Energy: 1.4517758992009222
Energy: 1.5092698861091152
Energy: 1.4904537890773462
Energy: 1.4802530096663495
Energy: 1.4548808964516868
Energy: 1.430489554421427
Energy: 1.4901559354930722
Energy: 1.501824746117164
Energy: 1.5465676869379619
Energy: 1.4811548531419825
Energy: 1.48629543942674
Energy: 1.5649609083150975
Energy: 1.647020612166416
Energy: 1.5593737607075728
Energy: 1.501301357533559
Energy: 1.5997954567232922
Energy: 1.5275583119633853
Energy: 1.4525001538066786
Energy: 1.4892535411189167
Energy: 1.5190675955535944
Energy: 1.517934856839758
Energy: 1.4551104879327428
Energy: 1.45461469665779
Energy: 1.4946603213032057
Energy: 1.4537279450685554
Energy: 1.4857914659447673
Energy: 1.4558748578139122
Energy: 1.5265962121535346
Energy: 1.5431906508045472
Energy: 1.5036143766614074
Energy: 1.579225265504979
Energy: 1.5473483213410493
Energy: 1.5206141202052395
Energy: 1.5468839739011462
Energy: 1.5221618125166687
Energy: 1.4832607572887877
Energy: 1.5191748254891204
Energy: 1.4959145124199584
Energy: 1.4427257364477586
Energy: 1.4186883566987902
Energy: 1.4720195139382706
Energy: 1.5170817737173805
Energy: 1.4569944699753514
Energy: 1.495477109374501
Energy: 1.4666218612484017
Energy: 1.4471003541422063
Energy: 1.5017525153747084
Energy: 1.4615846363481189
Energy: 1.48110359239869
Energy: 1.5253794113160775
Energy: 1.5571857549205939
Energy: 1.5021082882726724
Energy: 1.4590731980996419
Energy: 1.4890518286626404
Energy: 1.5068573489961061
Energy: 1.5278868980189533
Energy: 1.4709548064853368
Energy: 1.5956266577764124
Energy: 1.5149398239120464
Energy: 1.4755424705533438
Energy: 1.5573684582314622
Energy: 1.4782404355892453
Energy: 1.4911480956245322

minimum gb energy = 1.4153744645389585 eV
minimum distance =  2.15982558265698 Angstroms
sigma value = 39


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

Energy: 1.3992916651128395
Energy: 1.5424525637144222
Energy: 1.7980535600019663
Energy: 1.7002473375366105
Energy: 1.5087817998223996
Energy: 1.5092541463052858
Energy: 1.381949386719198
Energy: 1.4566554062544288
Energy: 1.4807561596130832
Energy: 1.5064953274276551
Energy: 1.494113697540875
Energy: 1.4525838113994383
Energy: 1.4565550040662862
Energy: 1.5330506467004628
Energy: 1.4606496723898852
Energy: 1.4439577479678094
Energy: 1.574541770169845
Energy: 1.4862732845970403
Energy: 1.4532566218496739
Energy: 1.4763075041946818
Energy: 1.4589462340926296
Energy: 1.440100048811009
Energy: 1.437995200636829
Energy: 1.4995603890184637
Energy: 1.4415791271418448
Energy: 1.5118590157498268
Energy: 1.5178985194914731
Energy: 1.548535256665603
Energy: 1.4838157568599426
Energy: 1.4512746524371747
Energy: 1.5431861369207152
Energy: 1.4637720867847748
Energy: 1.5113467090755788
Energy: 1.5437661671271319
Energy: 1.4596159061757727
Energy: 1.3808304161594627
Energy: 1.453063396968457
Energy: 1.454696638448536
Energy: 1.4475997483364782
Energy: 1.4798934626414113
Energy: 1.457874829624421
Energy: 1.4766279186660458
Energy: 1.466457245982562
Energy: 1.4785947217330309
Energy: 1.454060589747783
Energy: 1.490894857518701
Energy: 1.3808207312243541
Energy: 1.3845754655201592
Energy: 1.4724284086118338
Energy: 1.3828930942980382
Energy: 1.4801589789761957
Energy: 1.5565480260392903
Energy: 1.444641008492258
Energy: 1.5200165747912184
Energy: 1.5321938178766084
Energy: 1.4585051689340218
Energy: 1.3838095091431029
Energy: 1.4805246979407893
Energy: 1.5242168226311137
Energy: 1.4448030344160132
Energy: 1.4497540061620782
Energy: 1.5524780872957082
Energy: 1.458359001346077
Energy: 1.466531816712911
Energy: 1.4796821313460005
Energy: 1.5286289513631177
Energy: 1.4867097734636507
Energy: 1.465383048653464
Energy: 1.4596663460348023
Energy: 1.4589794651476262
Energy: 1.4414877158312864
Energy: 1.437805297750691
Energy: 1.514011915973227
Energy: 1.4413030578473431
Energy: 1.4810313851263806
Energy: 1.4612936880219283
Energy: 1.5321426405167418
Energy: 1.4956528531445314
Energy: 1.4493518845456017
Energy: 1.5162566026622055
Energy: 1.44513167442503
Energy: 1.485648344667603
Energy: 1.5566076711098467
Energy: 1.4669416306240541
Energy: 1.3819165627238779
Energy: 1.4505658291237622
Energy: 1.517411848456889
Energy: 1.4565210928313719
Energy: 1.5184710870691618
Energy: 1.5190485094978372
Energy: 1.459260051962177
Energy: 1.4396010784992008
Energy: 1.4413155820268613
Energy: 1.5066944268650606
Energy: 1.4918385020006635
Energy: 1.3809185154240518
Energy: 1.3816061419501808
Energy: 1.4685866045449345
Energy: 1.3845927228245796
Energy: 1.4794096551316995
Energy: 1.4645695226492297
Energy: 1.5031080219814026
Energy: 1.3810594371020748
Energy: 1.3809981433674088
Energy: 1.4758331066918868
Energy: 1.3993569287277712
Energy: 1.591609088468441
Energy: 1.493680414798695
Energy: 1.455844379749826
Energy: 1.5091221964925055
Energy: 1.5164104014216568
Energy: 1.3812264744614344
Energy: 1.4555390803913395
Energy: 1.4788088456311432
Energy: 1.5086816098960205
Energy: 1.4941360183201635
Energy: 1.452480800901783
Energy: 1.4561732142249944
Energy: 1.5328741521121123
Energy: 1.4590355754720326
Energy: 1.4417908637022885
Energy: 1.510512702456132
Energy: 1.4862938577885014
Energy: 1.45329816598039
Energy: 1.5081111523391284
Energy: 1.4588385077061632
Energy: 1.4392379615203126
Energy: 1.436581505464789
Energy: 1.4982991314193832
Energy: 1.4407367759731529
Energy: 1.4932152393474944
Energy: 1.5158357307468284
Energy: 1.5588097633743956
Energy: 1.5082612942330913
Energy: 1.451005572925743
Energy: 1.5433894127206942
Energy: 1.4636246553573624
Energy: 1.5106911785154067
Energy: 1.5072406305579982
Energy: 1.4590129672158973
Energy: 1.3892507029367331
Energy: 1.4499837941742757
Energy: 1.4549348643794566
Energy: 1.4474949422984114
Energy: 1.4826451281413624
Energy: 1.3979602290848683
Energy: 1.4755312744833473
Energy: 1.4667168254307597
Energy: 1.4822321699073224
Energy: 1.4544098930380043
Energy: 1.4910559737709959
Energy: 1.3807532592233387
Energy: 1.3849373436795007
Energy: 1.469622269482208
Energy: 1.382498868408514
Energy: 1.4801055698888863
Energy: 1.5573417805164091
Energy: 1.4478667183925837
Energy: 1.5208603381028656
Energy: 1.5323480772937543
Energy: 1.4594595612386498
Energy: 1.3850069935892657
Energy: 1.480628068301571
Energy: 1.5359204693145376
Energy: 1.444516343933497
Energy: 1.4499964912233183
Energy: 1.554355795892905
Energy: 1.4658640137548873
Energy: 1.466454124432102
Energy: 1.448062729144226
Energy: 1.5288702719864715
Energy: 1.4861943405739866
Energy: 1.465220379957867
Energy: 1.4600877037865678
Energy: 1.4592169324844246
Energy: 1.4399652055198915
Energy: 1.4386134438212315
Energy: 1.5141673982806179
Energy: 1.441107683032946
Energy: 1.4810388583696927
Energy: 1.5362533435133852
Energy: 1.5315866511598433
Energy: 1.5037237828180645
Energy: 1.4494291558943055
Energy: 1.519008995475497
Energy: 1.4451966544590944
Energy: 1.4857074723840102
Energy: 1.5333510295352737
Energy: 1.4669597663211515
Energy: 1.382482019265326
Energy: 1.4507022771955997
Energy: 1.5173842666852866
Energy: 1.456912737751815
Energy: 1.519157065178878
Energy: 1.5528067479478964
Energy: 1.459136762213958
Energy: 1.439272673016866
Energy: 1.4438699837506153
Energy: 1.4615510464637214
Energy: 1.505806083179171
Energy: 1.38088590799735
Energy: 1.3839315306335502
Energy: 1.4685812564544953
Energy: 1.3872309110749108
Energy: 1.4787357888417765
Energy: 1.464555611254755
Energy: 1.4470318556499193
Energy: 1.3809355135872956
Energy: 1.3808600348223556
Energy: 1.4759884724739636

minimum gb energy = 1.3807532592233387 eV
minimum distance =  2.17143781007063 Angstroms
sigma value = 21


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

Energy: 1.8069422131990067
Energy: 1.8635854324721395
Energy: 1.5319209924405637
Energy: 1.9007205561397307
Energy: 1.5585597502636843
Energy: 1.5882358808367318
Energy: 1.6149467486162956
Energy: 1.572263351245394
Energy: 1.5385424925783886
Energy: 1.4593677068458368
Energy: 1.5223779919663458
Energy: 1.419443018926956
Energy: 1.5862369452494258
Energy: 1.5226980691880385
Energy: 1.4499883333380614
Energy: 1.5067839235200395
Energy: 1.487868495000817
Energy: 1.5522763646211681
Energy: 1.7839023274323118
Energy: 1.467307611903587
Energy: 1.482919239944037
Energy: 1.6127360693975619
Energy: 1.5256561701012683
Energy: 1.5525903518329276
Energy: 1.601469323252533
Energy: 1.5349636809160134
Energy: 1.5485350547357049
Energy: 1.6071155787346352
Energy: 1.4589925262907908
Energy: 1.4426785860199667
Energy: 1.4619278727051865
Energy: 1.4398526500428268
Energy: 1.429911990180849
Energy: 1.4600259109570595
Energy: 1.4822965850877268
Energy: 1.4467109771136548
Energy: 1.432486579855369
Energy: 1.593745668996536
Energy: 1.4608432488917824
Energy: 1.5042393655890616
Energy: 1.4422098599535287
Energy: 1.4686695983304194
Energy: 1.6794508730111641
Energy: 1.4555506947077541
Energy: 1.4412124458541482
Energy: 1.528386767201795
Energy: 1.4556807304964385
Energy: 1.4128387056256415
Energy: 1.462130422308396
Energy: 1.5830387916176987
Energy: 1.4913731067794
Energy: 1.489281371321945
Energy: 1.4846738023383068
Energy: 1.4258611162566228
Energy: 1.452516782647936
Energy: 1.4897700057493437
Energy: 1.45013217174925
Energy: 1.508300456861756
Energy: 1.4821252112641974
Energy: 1.4801061644082747
Energy: 1.4404358711687308
Energy: 1.635471175932512
Energy: 1.4875367182375574
Energy: 1.6726189941545924
Energy: 1.6699720689000426
Energy: 1.4352147101313202
Energy: 1.5993245106981648
Energy: 1.487085940780111
Energy: 1.6009074963468044
Energy: 1.6359985482198314
Energy: 1.4685891902213946
Energy: 1.565735419797618
Energy: 1.449290436817428
Energy: 1.496220724428444
Energy: 1.4370213640397431
Energy: 1.6149251035631822
Energy: 1.4845742990861552
Energy: 1.4547008444875131
Energy: 1.5452466392483502
Energy: 1.5030147824746067
Energy: 1.5485674989244302
Energy: 1.5501859206678075
Energy: 1.6686177980359473
Energy: 1.5101713912709995
Energy: 1.663532010752219
Energy: 1.3741730365457805
Energy: 1.610934428023957
Energy: 1.647750066494576
Energy: 1.7433429391789332
Energy: 1.6082724895994174
Energy: 1.5710116750087837
Energy: 1.657940841322389
Energy: 1.4413390973295876
Energy: 1.541538229949178
Energy: 1.5495725131199045
Energy: 1.4511067628395653
Energy: 1.442894088321968
Energy: 1.422582167903558
Energy: 1.6496626135743044
Energy: 1.4874616265106282
Energy: 1.5948827849759735
Energy: 1.5429908776765864
Energy: 1.7088939646607213
Energy: 1.6553193867131162
Energy: 1.4612936974569222
Energy: 1.5290803201015404
Energy: 1.5010964892984524
Energy: 1.4519132236695866
Energy: 1.5270384958262022
Energy: 1.5340023367204423
Energy: 1.4466006624664134
Energy: 1.4593205250215577
Energy: 1.3781045891571613
Energy: 1.5843059554789911
Energy: 1.431183965994047
Energy: 1.4865422622203892
Energy: 1.4244600404946952
Energy: 1.4346765385515368
Energy: 1.5167040269734724
Energy: 1.4382109822256648
Energy: 1.4340462572525086
Energy: 1.5872462449719287
Energy: 1.4141304369642285
Energy: 1.4868108344900137
Energy: 1.5204169938670211
Energy: 1.4273807891136951
Energy: 1.3872025632607297
Energy: 1.4731205851479956
Energy: 1.5334164230573095
Energy: 1.4858528998222766
Energy: 1.4021414266222678
Energy: 1.4267723251078048
Energy: 1.4735422695431615
Energy: 1.409054535840918
Energy: 1.4855638772772903
Energy: 1.414840689105133
Energy: 1.5008374826985773
Energy: 1.4885016004855933
Energy: 1.4515236428036669
Energy: 1.4618727611499824
Energy: 1.4395101593089625
Energy: 1.508248286454769
Energy: 1.5622170956387709
Energy: 1.5346057875857193
Energy: 1.6265541968314163
Energy: 1.6176369671479607
Energy: 1.4966595628585588
Energy: 1.6160772817030786
Energy: 1.5272435960543833
Energy: 1.459897403099402
Energy: 1.4877991945281381
Energy: 1.5119101317095183
Energy: 1.4508899479016053
Energy: 1.4642750695503284
Energy: 1.719064719781698
Energy: 1.5149897719198293
Energy: 1.5968869496579605
Energy: 1.6409151227528598
Energy: 1.7455368194835
Energy: 1.5026349024909673
Energy: 1.4856262983948945
Energy: 1.7163822401169637
Energy: 1.5579784137091222
Energy: 1.5968982841107664
Energy: 1.9442303650623751
Energy: 1.6290940333175854
Energy: 1.7114447188600772
Energy: 1.5040334618762987
Energy: 1.5614978668790749
Energy: 1.479154656270135
Energy: 1.6223414518109518
Energy: 1.482707753806928
Energy: 1.5287465334364352
Energy: 1.436833579216754
Energy: 1.458626217137131

minimum gb energy = 1.3741730365457805 eV
minimum distance =  2.13818418195278 Angstroms
sigma value = 113


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

Energy: 1.6637964710026296
Energy: 1.7157740820310565
Energy: 1.7976350873309914
Energy: 1.7960209200555872
Energy: 1.7442330962175765
Energy: 1.7447389074262314
Energy: 1.729391216170872
Energy: 1.715578306745067
Energy: 1.673465092363378
Energy: 1.8004722535780067
Energy: 1.7065745564424268
Energy: 1.719387948519248
Energy: 1.7623942729881632
Energy: 1.579533868887289
Energy: 1.7167258048325142
Energy: 1.5463633127057614
Energy: 1.6949511696832529
Energy: 1.7076267071746167
Energy: 1.7685700995607831
Energy: 1.6872366388267843
Energy: 1.4909253022058746
Energy: 1.6749921397065763
Energy: 1.717014175884297
Energy: 1.6779288984164922
Energy: 1.7284264988540265
Energy: 1.7018197964459252
Energy: 1.6592884102269267
Energy: 1.7410176730185567
Energy: 1.496840757767163
Energy: 1.5521628053753764
Energy: 1.6390519062717603
Energy: 1.5598110992536722
Energy: 1.5037161047506835
Energy: 1.4992628690808114
Energy: 1.674496021075897
Energy: 1.4836899515775308
Energy: 1.4799053901868198
Energy: 1.6017332423192194
Energy: 1.4880806114798535
Energy: 1.530641434416879
Energy: 1.5723440281505243
Energy: 1.4589571561505401
Energy: 1.7362546626808288
Energy: 1.560895920626905
Energy: 1.6372579396794933
Energy: 1.5032045743870979
Energy: 1.5742300471732964
Energy: 1.6281874336586848
Energy: 1.5806272760759779
Energy: 1.604987825082001
Energy: 1.4583565116206867
Energy: 1.434222617961528
Energy: 1.6142133986082996
Energy: 1.5877842239700581
Energy: 1.5781036111170208
Energy: 1.5114316491448396
Energy: 1.4367099455678005
Energy: 1.5415392054942634
Energy: 1.5109193491006667
Energy: 1.6138547249324433
Energy: 1.5765968137828967
Energy: 1.5550946392015648
Energy: 1.5985132690756878
Energy: 1.6145096198115954
Energy: 1.5244026372859836
Energy: 1.5504593948343703
Energy: 1.452326237149555
Energy: 1.4790750871092109
Energy: 1.4722418679828002
Energy: 1.4705030879180794
Energy: 1.537185736620879
Energy: 1.4612845343513727
Energy: 1.4993672113468322
Energy: 1.5185445627663308
Energy: 1.5089175433086814
Energy: 1.5116672117334253
Energy: 1.4394780400579799
Energy: 1.38177615239499
Energy: 1.4430897881913918
Energy: 1.694308347575116
Energy: 1.628645494165381
Energy: 1.6601223998672556
Energy: 1.6174735064652854
Energy: 1.6739012346480622
Energy: 1.5292830910656052
Energy: 1.4587613575921585
Energy: 1.4951357003722454
Energy: 1.5039168846065623
Energy: 1.490072522344162
Energy: 1.5544254128392443
Energy: 1.4401659932718092
Energy: 1.6656002971136132
Energy: 1.5324799352461678
Energy: 1.5449694695785092
Energy: 1.5251851165817285
Energy: 1.4953666523571079
Energy: 1.561432583084008
Energy: 1.50170937599806
Energy: 1.4939430549204806
Energy: 1.661384368240449
Energy: 1.6240390795034163
Energy: 1.4842654890674394
Energy: 1.4063937091095626
Energy: 1.5095138763752751
Energy: 1.4912873745619046
Energy: 1.636537722253265
Energy: 1.5062272717370018
Energy: 1.5974040860180219
Energy: 1.501036748336226
Energy: 1.5056085950136628
Energy: 1.6402512252799573
Energy: 1.5972464687583658
Energy: 1.6023129049981721
Energy: 1.6976141337739081
Energy: 1.6005542270844961
Energy: 1.7649258679623347
Energy: 1.6827509235060534
Energy: 1.6541749873786369
Energy: 1.4928912161986196
Energy: 1.5615257274341694
Energy: 1.641917841915135
Energy: 1.5982439849889987
Energy: 1.6243959760306355
Energy: 1.636141572946315
Energy: 1.6756395876726242
Energy: 1.5019718955036223
Energy: 1.7177574826250603
Energy: 1.542548228712235
Energy: 1.6131064379551128
Energy: 1.5851267363195791
Energy: 1.7713795288289378
Energy: 1.708379844787147
Energy: 1.650272085696584
Energy: 1.6694455490234814
Energy: 1.7411461368056567
Energy: 1.7014280531755057
Energy: 1.8111317051013078
Energy: 1.694879280103983
Energy: 1.7457824574138867
Energy: 1.7334260748627002
Energy: 1.7064942451046086
Energy: 1.7264502875258467
Energy: 1.5406490693189436
Energy: 1.7082592216119308
Energy: 1.7473699561496323
Energy: 1.643504756268934
Energy: 1.593631690859343
Energy: 1.7228713358974068
Energy: 1.7175688795366035
Energy: 1.5642012518344703
Energy: 1.7935452839479047
Energy: 1.6896314844278548
Energy: 1.641149764855126
Energy: 1.593775916000991
Energy: 1.6678823616236067
Energy: 1.724971333108233
Energy: 1.8045884362146276
Energy: 1.6310385479219063
Energy: 1.7448933475525814
Energy: 1.661620128456737
Energy: 1.875808256010092
Energy: 1.8130342995125397
Energy: 1.600382517736283
Energy: 1.7758009480427004
Energy: 1.6242585149721418
Energy: 1.7216091865483074
Energy: 1.8128115097980737
Energy: 1.6199838905132098
Energy: 1.5637093379261346
Energy: 1.6009195267724856
Energy: 1.6890013520611922
Energy: 1.7061052090728512
Energy: 1.6771111108640635
Energy: 1.6812757359840333
Energy: 1.545016298252093
Energy: 1.6784274056867252
Energy: 1.6199175368567664
Energy: 1.6839814175989474
Energy: 1.7271567131340797
Energy: 1.7028764553604565
Energy: 1.6604919072195143
Energy: 1.6758186450080894
Energy: 1.4512551391836723
Energy: 1.49053660785374
Energy: 1.6256277873745093
Energy: 1.5591369485700282
Energy: 1.5734287484390608
Energy: 1.5907514454112133
Energy: 1.6708044051916986
Energy: 1.4837365035919619
Energy: 1.5733410802316576
Energy: 1.626381093942747
Energy: 1.399194175026325
Energy: 1.5355949374046527
Energy: 1.571685227205674
Energy: 1.5332713746665496
Energy: 1.5606094226438079
Energy: 1.51224964444885
Energy: 1.697642969208282
Energy: 1.6329437427103295
Energy: 1.5808420153675813
Energy: 1.6239104380356317
Energy: 1.596022060496428
Energy: 1.6176653467874256
Energy: 1.4572137242732222
Energy: 1.496618096895229
Energy: 1.5587335245154244
Energy: 1.59498837020269
Energy: 1.4761849607048765
Energy: 1.5135246543872651
Energy: 1.4368418672087386
Energy: 1.4945499075372586
Energy: 1.6191970477756634
Energy: 1.5422779035013463
Energy: 1.565435600691941
Energy: 1.692969180273557
Energy: 1.5945371960482853
Energy: 1.6100882752215628
Energy: 1.5561273519910106
Energy: 1.7120461375923823
Energy: 1.4354203432810093
Energy: 1.4764520677441713
Energy: 1.4474522238323475
Energy: 1.44352221985142
Energy: 1.6176684072793215
Energy: 1.464075517321103
Energy: 1.6001840409285284
Energy: 1.5147265605456781
Energy: 1.5182032382674862
Energy: 1.5162289679668806
Energy: 1.5466142964823895
Energy: 1.3821655970077746
Energy: 1.4385114553492226
Energy: 1.6923636100115402
Energy: 1.6294860060458682
Energy: 1.6261258995318617
Energy: 1.6185137572647148
Energy: 1.5160288122060592
Energy: 1.5327285263674624
Energy: 1.4566076252307767
Energy: 1.4971004382286814
Energy: 1.5215329406336981
Energy: 1.581428091500963
Energy: 1.5432197661854379
Energy: 1.4681699402059383
Energy: 1.6440153442274628
Energy: 1.4711560975228688
Energy: 1.4334442172510267
Energy: 1.590653853511153
Energy: 1.499249859721084
Energy: 1.5607276921931053
Energy: 1.4992953460280225
Energy: 1.4911210444715337
Energy: 1.498658453101612
Energy: 1.623285400160469
Energy: 1.4182226383873857
Energy: 1.406348986274434
Energy: 1.5336156870471118
Energy: 1.4078212643561518
Energy: 1.6237073596161489
Energy: 1.5067669282480454
Energy: 1.5169252572532437
Energy: 1.5261987658936742
Energy: 1.5991740297610295
Energy: 1.472841243675824
Energy: 1.6257865234787297
Energy: 1.6041515876220795
Energy: 1.7981047537586938
Energy: 1.5959669562460133
Energy: 1.7239324198909265
Energy: 1.6817556168392656
Energy: 1.5799244954844196
Energy: 1.5106684317628563
Energy: 1.5623322951274008
Energy: 1.6494196210110041
Energy: 1.5996941899910555
Energy: 1.625513691324221
Energy: 1.577247783138751
Energy: 1.6474192131074281
Energy: 1.588919777314433
Energy: 1.6757056245290476
Energy: 1.5422094315091384
Energy: 1.7466826097583215
Energy: 1.524258681174579
Energy: 1.7698437034187993
Energy: 1.6693633353440551
Energy: 1.6370670801854816
Energy: 1.6869723897616835
Energy: 1.8022317026075403
Energy: 1.6911595515397342
Energy: 1.8059271836226574
Energy: 1.7002090625534358
Energy: 1.7125444026963565
Energy: 1.8081187542310722
Energy: 1.7017256964494547
Energy: 1.6035107813381093
Energy: 1.5408661720442816
Energy: 1.7147086553066957
Energy: 1.7418248121622073
Energy: 1.6420357367353715
Energy: 1.572136284623161
Energy: 1.7251482722740272
Energy: 1.7229370361503624
Energy: 1.561626743846197
Energy: 1.7081223158331704
Energy: 1.745030022780848
Energy: 1.6424952302935898
Energy: 1.6324384490222785
Energy: 1.641783257522214
Energy: 1.6408894521701909
Energy: 1.804929102534939
Energy: 1.654480132723575
Energy: 1.7477848656590091
Energy: 1.6642435572519787
Energy: 1.624144473254256

minimum gb energy = 1.38177615239499 eV
minimum distance =  2.14431245702249 Angstroms
sigma value = 365


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

Energy: 1.4064878972408401
Energy: 1.7462465037873736
Energy: 1.400315369735677
Energy: 1.4003511244188167
Energy: 1.400096335065514
Energy: 1.3995125129861523
Energy: 1.4054605395847142
Energy: 1.4164553905352837
Energy: 1.6943541845480012
Energy: 1.401123641909707
Energy: 1.4001828051216476
Energy: 1.4011049004651184
Energy: 1.4016488436031915
Energy: 1.6956903309000046
Energy: 1.4055954802174853
Energy: 1.6927446751906676
Energy: 1.400027798133027
Energy: 1.400617245269659
Energy: 1.400802594843374
Energy: 1.3999143739913373
Energy: 1.3961764473608087
Energy: 1.4094489191231256
Energy: 1.6930952374008421
Energy: 1.4003469238401998
Energy: 1.4029889063265368
Energy: 1.4023088758930375
Energy: 1.4042833844624076
Energy: 1.3972714883382615
Energy: 1.4455156545482555
Energy: 1.6922199968831226
Energy: 1.4595243255466332
Energy: 1.7058015961187303
Energy: 1.4002937166424336
Energy: 1.4566556155295216
Energy: 1.7062045111421
Energy: 1.4060436675343921
Energy: 1.6997600389997722
Energy: 1.4014005776760952
Energy: 1.4008395503633932
Energy: 1.400288303447489
Energy: 1.4004779298332943
Energy: 1.4016390516588264
Energy: 1.404922000351814
Energy: 1.693001932088257
Energy: 1.400318113410983
Energy: 1.4003912024307885
Energy: 1.4010161467547568
Energy: 1.4007821585296667
Energy: 1.7007248109746413
Energy: 1.4056340565119692
Energy: 1.6920185117084217
Energy: 1.400893064981053
Energy: 1.4008662919618464
Energy: 1.4009566774785867
Energy: 1.40015596379718
Energy: 1.6942675464238937
Energy: 1.407841887463308
Energy: 1.6943067686455444
Energy: 1.4029076933789768
Energy: 1.401867131893208
Energy: 1.4012425042796333
Energy: 1.401127650769152
Energy: 1.400948173546546
Energy: 1.5081680874922236
Energy: 1.701068594783701
Energy: 1.4547922888065035
Energy: 1.705572350924361
Energy: 1.7067466831576714
Energy: 1.4452200540894578
Energy: 1.7049255411695805
Energy: 1.4072407415859687
Energy: 1.6941972572360362
Energy: 1.4034392217116913
Energy: 1.402413565335074
Energy: 1.4016314067352396
Energy: 1.4020130354165372
Energy: 1.3965521982684863
Energy: 1.4041628171547693
Energy: 1.6922912703506128
Energy: 1.4000564235783373
Energy: 1.4004307103135742
Energy: 1.4009380824446374
Energy: 1.4000814676493836
Energy: 1.6943356822164846
Energy: 1.4300117140031834
Energy: 1.6929037025604243
Energy: 1.4007395401158926
Energy: 1.4013967865530732
Energy: 1.4008714454840128
Energy: 1.4003866442924355
Energy: 1.702775324384074
Energy: 1.4059999845739624
Energy: 1.701053066360476
Energy: 1.4009868846895683
Energy: 1.4002141430610573
Energy: 1.4002819621035725
Energy: 1.4001668073997124
Energy: 1.4058853899910144
Energy: 1.508506309255659
Energy: 1.692852763392272
Energy: 1.4443170252647441
Energy: 1.4004798230386033
Energy: 1.4008787002004823
Energy: 1.4004536983668665
Energy: 1.6960304607717396
Energy: 1.4055119441271173
Energy: 1.6926869649760679
Energy: 1.399958495777088
Energy: 1.403719505089392
Energy: 1.400858707435114
Energy: 1.4004209467480735
Energy: 1.3970880407371755
Energy: 1.4125531631366925
Energy: 1.6922438809025644
Energy: 1.4000226883839144
Energy: 1.4005112488017881
Energy: 1.4007561035819134
Energy: 1.3999014760987287
Energy: 1.396594192050819
Energy: 1.4708557248970302
Energy: 1.6924321555939394
Energy: 1.400618064058821
Energy: 1.40091922329249
Energy: 1.4006035934004706
Energy: 1.4006361617752445
Energy: 1.700977668361713
Energy: 1.4064924059059607
Energy: 1.702761643182552
Energy: 1.400488559102105
Energy: 1.4009716363362859
Energy: 1.3999530615441758
Energy: 1.3995946311126295
Energy: 1.4020545180973483
Energy: 1.4070734354843164
Energy: 1.6931794494692116
Energy: 1.4284044955189115
Energy: 1.4004990277330873
Energy: 1.4012898702748224
Energy: 1.4004567330197815
Energy: 1.6965059869404249

minimum gb energy = 1.3961764473608087 eV
minimum distance =  2.18093527800428 Angstroms
sigma value = 23