Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080053436756135
cohesive_energy=3.930314120603696
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.068807226011498e-19, 1.72237192508268e-19, 2.2702682686116596e-19, 2.7505046928868197e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57767499159944e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29041783511178e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06388753471942e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.8571615914122e-19, 1.9324813688654397e-19, 7.75272444896358e-20, -6.808321432052279e-20, -2.52634416002388e-19, -4.88748788731602e-19, -7.94386412139978e-19, -1.1952926625592618e-18, -1.72852428335724e-18, -2.4493275292274997e-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: 0.011899075643486995
Energy: 0.2549345147626596
Energy: 0.01273710836260729
Energy: 0.013761718107219972
Energy: 0.2548611028700238
Energy: 0.012271544490241138
Energy: 0.25493451475590306
Energy: 0.06435906062455928
Energy: 0.06438544326121805
Energy: 0.06446247567093644
Energy: 0.06431611739007241
Energy: 0.06436410517820634
Energy: 0.012737108363564701
Energy: 0.06438544325399645
Energy: 0.06431922527094286
Energy: 0.012376538922487927
Energy: 0.06434078963293327
Energy: 0.06534912479094342
Energy: 0.013761718107219972
Energy: 0.06446247567093644
Energy: 0.012376538922706765
Energy: 0.012194612583954155
Energy: 0.06439349143025833
Energy: 0.012297049101796555
Energy: 0.2548611028760418
Energy: 0.06431611739007241
Energy: 0.06434078963219468
Energy: 0.06439349142976593
Energy: 0.06438595400118444
Energy: 0.06424364120620353
Energy: 0.012271544491444736
Energy: 0.06436410518206334
Energy: 0.0653491247904784
Energy: 0.012297049101550364
Energy: 0.0642436412054923
Energy: 0.012534717655332058

minimum gb energy = 0.011899075643486995 eV
minimum distance =  2.87851477643812 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 0.795757097924177
Energy: 0.5228108468466598
Energy: 0.5157579026753715
Energy: 0.49800598934853174
Energy: 0.7430845758629477
Energy: 0.5162397966328688
Energy: 0.7080532731080896
Energy: 0.4809373089346426
Energy: 0.48437549881390174
Energy: 0.4671902366928828
Energy: 0.4898577211885387
Energy: 0.4783570596809147
Energy: 0.7208681061849319
Energy: 0.48048221971539284
Energy: 0.4822097986182186
Energy: 0.47891377078410347
Energy: 0.4779370080159684
Energy: 0.48318199094866243
Energy: 0.7765663196004706
Energy: 0.4801622114123397
Energy: 0.49795021958082747
Energy: 0.4716956828169751
Energy: 0.4803578676459321
Energy: 0.47974758385350486
Energy: 0.7086417973983874
Energy: 0.48649959881858834
Energy: 0.4850272907732355
Energy: 0.4759213078806246
Energy: 0.4876034094952388
Energy: 0.48252054090340407
Energy: 0.7050026468461202
Energy: 0.49747477849086497
Energy: 0.48569047353044487
Energy: 0.4791818137940179
Energy: 0.498113299779493
Energy: 0.4847668756978038
Energy: 0.7062207743772465
Energy: 0.4831893391419604
Energy: 0.48816551033050637
Energy: 0.4785737097341396
Energy: 0.4578186999245949
Energy: 0.47970442976559535
Energy: 0.6959156244423363
Energy: 0.4809889164589264
Energy: 0.49720920648766936
Energy: 0.4577968983908613
Energy: 0.48031109938267047
Energy: 0.48255293725780984
Energy: 0.5848749828765787
Energy: 0.47887172600464295
Energy: 0.4787015438660561
Energy: 0.49495292394497203
Energy: 0.4831383003783044
Energy: 0.48355341476058117
Energy: 0.5910920933160361
Energy: 0.47644022431420474
Energy: 0.4831435246972135
Energy: 0.4823659479942394
Energy: 0.47671378509838813
Energy: 0.4857544965131518
Energy: 0.5837671651285324
Energy: 0.47750061091518586
Energy: 0.47809801000052093
Energy: 0.5166466489833681
Energy: 0.4773360714010877
Energy: 0.4815387580718035
Energy: 0.5335506873521109
Energy: 0.48339444712499563
Energy: 0.48268943380040646
Energy: 0.4870995722566937
Energy: 0.47705308151089965
Energy: 0.48242814403762774
Energy: 0.5297123581092014
Energy: 0.47795817908603533
Energy: 0.4781926848297393
Energy: 0.4858185141658519
Energy: 0.4777394539096542
Energy: 0.4786216258123284
Energy: 0.5720268723170443
Energy: 0.4756251158743889
Energy: 0.4986428174181168
Energy: 0.49000005269902597
Energy: 0.48628379879498396
Energy: 0.48072467425487764
Energy: 0.5528619627643784
Energy: 0.47603670559073497
Energy: 0.4828662181724092
Energy: 0.4917199397075553
Energy: 0.476264411659918
Energy: 0.48526134853410136
Energy: 0.5482225590644613
Energy: 0.4818688437631343
Energy: 0.47960735982974295
Energy: 0.4856898562394671
Energy: 0.48319342515214025
Energy: 0.47883967399518945
Energy: 0.6643197125507952
Energy: 0.47869191759962904
Energy: 0.4818621125721042
Energy: 0.47696488315171603
Energy: 0.4779151519023391
Energy: 0.4751110940393542
Energy: 0.6428765053616523
Energy: 0.4813633825424626
Energy: 0.490223046828168
Energy: 0.4851486169932214
Energy: 0.4536031094530414
Energy: 0.49176858759259506
Energy: 0.6441988747087376
Energy: 0.4939350125740767
Energy: 0.4920475185402677
Energy: 0.48174971146455425
Energy: 0.4853308997918401
Energy: 0.49146104602183976
Energy: 0.6837964293030164
Energy: 0.4855123242750438
Energy: 0.49254573147034725
Energy: 0.4807769545935271
Energy: 0.48575847770065267
Energy: 0.49173806067738357
Energy: 0.7324822998402863
Energy: 0.4805370760094512
Energy: 0.48228713918161836
Energy: 0.4766800244927396
Energy: 0.4729768286355769
Energy: 0.48145626495804983
Energy: 0.7393915591268623
Energy: 0.4814890670180248
Energy: 0.48359721312960835
Energy: 0.47580979288431235
Energy: 0.4750471833725288
Energy: 0.47945934886301056
Energy: 0.7328186420146744
Energy: 0.48174384897193356
Energy: 0.48435007245633116
Energy: 0.4771520893899093
Energy: 0.4929374574669813
Energy: 0.4777251209093371

minimum gb energy = 0.4536031094530414 eV
minimum distance =  2.69217662245756 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 0.8750082431947234
Energy: 0.5196448971630682
Energy: 0.528026636077384
Energy: 0.5272400066686025
Energy: 0.5199359576079552
Energy: 0.5264659870024028
Energy: 0.6600555937919139
Energy: 0.47603018311408735
Energy: 0.47472907102717826
Energy: 0.49487080363934133
Energy: 0.5162497401155337
Energy: 0.48732677451310413
Energy: 0.6623540102832051
Energy: 0.49082441292831025
Energy: 0.47530741491183176
Energy: 0.4941015202554859
Energy: 0.51696548808621
Energy: 0.4862834480018455
Energy: 0.6977322877164227
Energy: 0.5032399770160957
Energy: 0.5030672844808399
Energy: 0.4905541105589341
Energy: 0.5165250276450393
Energy: 0.488471015334438
Energy: 0.6576695472867176
Energy: 0.4751308463145436
Energy: 0.4941041736100034
Energy: 0.472385525978658
Energy: 0.5049745507145097
Energy: 0.5067824797948247
Energy: 0.7010678759299569
Energy: 0.5085957479241012
Energy: 0.50940937981795
Energy: 0.4888990052565784
Energy: 0.5219141647191605
Energy: 0.49622057116424767
Energy: 0.6998477584774847
Energy: 0.4784586766509895
Energy: 0.4794359009631938
Energy: 0.487873668565681
Energy: 0.47755625554625886
Energy: 0.496702452423172
Energy: 0.6580370111128867
Energy: 0.5089649519572248
Energy: 0.5060569717413443
Energy: 0.5031649734282706
Energy: 0.5053036330744161
Energy: 0.5044060010314578
Energy: 0.5719696669122057
Energy: 0.4710320486316698
Energy: 0.4875909168944709
Energy: 0.5091042939277584
Energy: 0.4700093580254873
Energy: 0.4969877012645284
Energy: 0.570203843698022
Energy: 0.4746952527134829
Energy: 0.5064254865067306
Energy: 0.5044771721581394
Energy: 0.4722169523943968
Energy: 0.5078840894476542
Energy: 0.5755761607652324
Energy: 0.4980323830758095
Energy: 0.49794372489947125
Energy: 0.5005747566706987
Energy: 0.47062042144347177
Energy: 0.4983528353477991
Energy: 0.529265676633546
Energy: 0.47185204785544144
Energy: 0.48590186714648825
Energy: 0.5164447977183833
Energy: 0.5037462290631093
Energy: 0.4899068049434833
Energy: 0.5282496046603002
Energy: 0.4863260645925327
Energy: 0.4858819496996863
Energy: 0.5167763857976244
Energy: 0.4883687847630022
Energy: 0.49377059294469533
Energy: 0.5333003673608143
Energy: 0.4896443965123953
Energy: 0.48953266908773313
Energy: 0.5213133240999236
Energy: 0.4719015544288569
Energy: 0.489771683072564
Energy: 0.5795047322991034
Energy: 0.49597205198954347
Energy: 0.5069321828044996
Energy: 0.5042035769661266
Energy: 0.4727517573301773
Energy: 0.4757674809623242
Energy: 0.5721784144882075
Energy: 0.48703614765120234
Energy: 0.4881598064172871
Energy: 0.48986958857743407
Energy: 0.4933401491119927
Energy: 0.4907701708394588
Energy: 0.6575410827591158
Energy: 0.496653850034478
Energy: 0.4792802913921307
Energy: 0.4905094170370879
Energy: 0.49726998735284406
Energy: 0.47832999730712783
Energy: 0.6197846269137145
Energy: 0.47866963804340795
Energy: 0.4788348553756992
Energy: 0.47392617040634677
Energy: 0.47808237237917434
Energy: 0.5048512193875996
Energy: 0.6117932435014576
Energy: 0.5089633781000769
Energy: 0.4983288094439032
Energy: 0.4701317087973343
Energy: 0.5089647838907838
Energy: 0.49432925184934423
Energy: 0.6576059111582294
Energy: 0.47715243234317584
Energy: 0.49524063339791774
Energy: 0.47171361832936176
Energy: 0.5057254339385301
Energy: 0.5068944316637611
Energy: 0.7814397528999416
Energy: 0.49331280529192445
Energy: 0.4981159446554207
Energy: 0.4980955992903738
Energy: 0.49255552451194773
Energy: 0.4978979327670853
Energy: 0.6118254437304007
Energy: 0.49100524598519585
Energy: 0.4932212242559083
Energy: 0.4703821436648368
Energy: 0.5169233616089752
Energy: 0.4863073914494988
Energy: 0.6590154905795694
Energy: 0.4759384644498988
Energy: 0.47435550884483146
Energy: 0.5094683495422359
Energy: 0.516060259524033
Energy: 0.4875162043537594
Energy: 0.6977301247428424
Energy: 0.4947028645594845
Energy: 0.503760738334149
Energy: 0.4899881308864223
Energy: 0.5214861276037934
Energy: 0.4972619016386733
Energy: 0.6583970859854461
Energy: 0.47627161291934944
Energy: 0.47472181006808856
Energy: 0.47371736414590304
Energy: 0.5034503931945308
Energy: 0.48707368937118956
Energy: 0.7006807261642514
Energy: 0.5085496463905567
Energy: 0.4944158542086971
Energy: 0.49527320116259915
Energy: 0.5101863570920065
Energy: 0.48781994838531056
Energy: 0.6980835761919766
Energy: 0.49028807849708095
Energy: 0.49041757918564544
Energy: 0.5087286703553093
Energy: 0.5016133742846809
Energy: 0.4904817768828437
Energy: 0.6589948608550511
Energy: 0.5071969803950814
Energy: 0.5057199121611027
Energy: 0.4779980325614738
Energy: 0.4712324572736909
Energy: 0.48000683487545653
Energy: 0.5749692271971242
Energy: 0.5075833299049157
Energy: 0.5055755731423943
Energy: 0.5057960950586882
Energy: 0.47386187805720204
Energy: 0.5003268630287627
Energy: 0.574260761996079
Energy: 0.47312879163302374
Energy: 0.5058284584157606
Energy: 0.5054761722672163
Energy: 0.4719800004256483
Energy: 0.496025478165942
Energy: 0.624480789081919
Energy: 0.4863096809189605
Energy: 0.48547552125473226
Energy: 0.490719294128533
Energy: 0.49859992852294666
Energy: 0.4981505035459574
Energy: 0.5328320132649588
Energy: 0.47370418552638194
Energy: 0.47124257163786715
Energy: 0.5175134620573477
Energy: 0.4734651635954522
Energy: 0.48677812650502317
Energy: 0.5308419380991983
Energy: 0.4932962508996162
Energy: 0.48648757000944093
Energy: 0.5316487645528145
Energy: 0.49519061656458974
Energy: 0.4747677742537237
Energy: 0.5334977435741735
Energy: 0.48742827989682613
Energy: 0.4870677718685096
Energy: 0.5338984613990497
Energy: 0.4891358620100966
Energy: 0.48663261303776756
Energy: 0.570734297390187
Energy: 0.4860587443726642
Energy: 0.48584966570652427
Energy: 0.50318131218927
Energy: 0.48754223761897403
Energy: 0.47596776155059217
Energy: 0.5714613312659719
Energy: 0.4884236718895963
Energy: 0.48729552807652066
Energy: 0.5095130368352918
Energy: 0.4951384614037952
Energy: 0.4955085895841488
Energy: 0.5706940412474718
Energy: 0.49103962451788924
Energy: 0.4911486042985972
Energy: 0.48906549402327476
Energy: 0.4903362094784278
Energy: 0.49107134611886516
Energy: 0.6120863746318901
Energy: 0.4787778422861557
Energy: 0.4987667066514703
Energy: 0.4698472255327092
Energy: 0.47843008701098677
Energy: 0.49505114559118996
Energy: 0.6180572662911696
Energy: 0.4918411311872753
Energy: 0.49141584583514136
Energy: 0.5031377127632335
Energy: 0.5048087080937077
Energy: 0.5047638618389613
Energy: 0.6574956243239952
Energy: 0.4941909985820841
Energy: 0.49505765464601104
Energy: 0.4747817306989681
Energy: 0.521829563928665
Energy: 0.5048377863404039
Energy: 0.7786674384287205
Energy: 0.49414981132953467
Energy: 0.4852322719584613
Energy: 0.4705526981024196
Energy: 0.5164802650224087
Energy: 0.48531550801872214

minimum gb energy = 0.4698472255327092 eV
minimum distance =  2.69713764858886 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 0.8269713034908378
Energy: 0.5181603639098811
Energy: 0.4889947937210022
Energy: 0.49262590087743324
Energy: 0.5185041122691725
Energy: 0.5533631305692519
Energy: 0.6282981954692787
Energy: 0.4910155914586019
Energy: 0.4906120620652157
Energy: 0.4749100092153693
Energy: 0.5159311266860389
Energy: 0.49063296560610264
Energy: 0.7215556749521694
Energy: 0.5063743358726677
Energy: 0.49797587913122326
Energy: 0.4910981276783366
Energy: 0.5187398129011799
Energy: 0.506646181946416
Energy: 0.7198739457556855
Energy: 0.5072566901576571
Energy: 0.5116885316325067
Energy: 0.46680848604421776
Energy: 0.504352533341251
Energy: 0.5005144266320359
Energy: 0.628140984581692
Energy: 0.4743887334900779
Energy: 0.4740412425635814
Energy: 0.474657743218736
Energy: 0.52082779020351
Energy: 0.5193032453547641
Energy: 0.6281062071321525
Energy: 0.5173103616125632
Energy: 0.5169539394754248
Energy: 0.5192032501347673
Energy: 0.474215175153154
Energy: 0.5162910300044928
Energy: 0.6308193763916585
Energy: 0.47454541358072666
Energy: 0.47429056267471287
Energy: 0.5196296377786557
Energy: 0.4744349289839077
Energy: 0.4745566264812331
Energy: 0.6201066032854851
Energy: 0.48254259799863924
Energy: 0.48342227061236986
Energy: 0.5040415045368187
Energy: 0.46949229238936246
Energy: 0.4859348288512953
Energy: 0.5413239149853261
Energy: 0.5079128118169326
Energy: 0.5080592070445606
Energy: 0.5180224912930664
Energy: 0.49404950746729664
Energy: 0.517617807395673
Energy: 0.5415059088395668
Energy: 0.4749203857426143
Energy: 0.4907796999952979
Energy: 0.5162697787211278
Energy: 0.4743284969577121
Energy: 0.504026121705521
Energy: 0.5413904106348959
Energy: 0.4839525939804662
Energy: 0.4840176747183053
Energy: 0.5415735728754782
Energy: 0.48449165288141655
Energy: 0.49505995066576125
Energy: 0.5654961082669405
Energy: 0.4750595692070797
Energy: 0.4744759182142102
Energy: 0.5062467744791282
Energy: 0.5003645933884999
Energy: 0.5039756712014586
Energy: 0.5645233432109192
Energy: 0.5079999864118939
Energy: 0.5076345352218294
Energy: 0.5222870733458641
Energy: 0.49283745037040316
Energy: 0.5139033420559678
Energy: 0.5656321353983534
Energy: 0.48508037428123824
Energy: 0.48608626344654765
Energy: 0.5066414975585065
Energy: 0.4699167168564668
Energy: 0.48601815033785994
Energy: 0.6696794307265017
Energy: 0.4927293524760525
Energy: 0.5081844545406393
Energy: 0.5129450932836471
Energy: 0.49187837265333195
Energy: 0.5081876737474402
Energy: 0.6680784046494385
Energy: 0.5069339893977765
Energy: 0.5017699075494558
Energy: 0.4826169574444355
Energy: 0.5196331998012133
Energy: 0.48496614767165264
Energy: 0.6725812860999724
Energy: 0.5052869921372432
Energy: 0.4901087427338179
Energy: 0.507656081745666
Energy: 0.5264034774337107
Energy: 0.4908107310813009
Energy: 0.7729510706582552
Energy: 0.5097098959548341
Energy: 0.4946637945398829
Energy: 0.5062111252114178
Energy: 0.4913294690267947
Energy: 0.5043015674615084

minimum gb energy = 0.46680848604421776 eV
minimum distance =  2.64362442953152 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.6858256082123475
Energy: 0.5060991883538258
Energy: 0.5464596191521741
Energy: 0.5481432949423519
Energy: 0.506230104544804
Energy: 0.5072620438222806
Energy: 0.5972547623701223
Energy: 0.504804921665597
Energy: 0.5044428528466545
Energy: 0.5212412365387601
Energy: 0.504985711235085
Energy: 0.5048614993233258
Energy: 0.5964930925483785
Energy: 0.5047708290312307
Energy: 0.5045630943976359
Energy: 0.521649707423149
Energy: 0.5048852156157102
Energy: 0.5047862788704961
Energy: 0.5909735238964139
Energy: 0.5042587794350567
Energy: 0.5043919312450421
Energy: 0.5011631652603745
Energy: 0.5044077731099341
Energy: 0.5055899345733603
Energy: 0.5971591083283517
Energy: 0.5049589904520089
Energy: 0.5214609948858341
Energy: 0.5224307522238192
Energy: 0.5055726126189535
Energy: 0.5208476469849928
Energy: 0.5965954307864216
Energy: 0.4869161197077687
Energy: 0.5212750115159343
Energy: 0.5216490898333495
Energy: 0.4868092774863736
Energy: 0.5218650282277052
Energy: 0.5980623571155813
Energy: 0.5222361611247404
Energy: 0.5214895550438311
Energy: 0.5213879694647778
Energy: 0.49624140142433937
Energy: 0.5216177161498838
Energy: 0.5666487700611277
Energy: 0.47924791595847044
Energy: 0.47934721371212496
Energy: 0.5060284798064102
Energy: 0.4801961933250738
Energy: 0.4795368340281379
Energy: 0.5048613726544989
Energy: 0.4792617496105587
Energy: 0.4796050510243915
Energy: 0.5049484129190663
Energy: 0.4799323668351684
Energy: 0.47942053654164085
Energy: 0.5050208982587546
Energy: 0.5036766822561204
Energy: 0.5053326434923413
Energy: 0.5049751930882542
Energy: 0.5227476943788419
Energy: 0.5045375170683623
Energy: 0.5039167946281707
Energy: 0.5017776063660109
Energy: 0.5026569374772188
Energy: 0.5039998081881178
Energy: 0.502071019654224
Energy: 0.5061067581208689
Energy: 0.5970691002873368
Energy: 0.5220323896994935
Energy: 0.5212260372971818
Energy: 0.5047730942389008
Energy: 0.5185344143647415
Energy: 0.504857599081463
Energy: 0.4906515540381335
Energy: 0.5214902884983112
Energy: 0.5214499262772302
Energy: 0.4873048348612711
Energy: 0.5215153608124337
Energy: 0.5212351536496816
Energy: 0.5978348095367167
Energy: 0.5226068100638195
Energy: 0.5225017647357109
Energy: 0.5044327341626413
Energy: 0.5221270992455633
Energy: 0.5219245396473208
Energy: 0.6956462630978778
Energy: 0.5051006572151732
Energy: 0.5056718518806422
Energy: 0.48009096502834797
Energy: 0.5047546659505462
Energy: 0.4797142203785198
Energy: 0.6901219219263024
Energy: 0.5199658931690717
Energy: 0.47955393460164436
Energy: 0.4793256221163169
Energy: 0.505137974829239
Energy: 0.4795624650312196
Energy: 0.5969599007291595
Energy: 0.5049994688234795
Energy: 0.5046474133061507
Energy: 0.5219931796442303
Energy: 0.5046868014938273
Energy: 0.5046061563225297
Energy: 0.5945057324882101
Energy: 0.5053341693655886
Energy: 0.5047703983456208
Energy: 0.501015034507985
Energy: 0.5049751307491998
Energy: 0.5051351432981304
Energy: 0.5920903533036201
Energy: 0.5046946100352466
Energy: 0.5047852535702879
Energy: 0.5011735078864552
Energy: 0.5046605262031902
Energy: 0.5046239407812886
Energy: 0.5973814159280951
Energy: 0.486761075666888
Energy: 0.5173781758621931
Energy: 0.5213904901109717
Energy: 0.486822340064031
Energy: 0.5199227593420039
Energy: 0.5911238707224636
Energy: 0.5211714753431864
Energy: 0.5218102297109243
Energy: 0.5222278563320497
Energy: 0.5048443284011876
Energy: 0.5224506984906917
Energy: 0.5971831180422639
Energy: 0.4967756060563068
Energy: 0.5214899409459424
Energy: 0.5212007173725758
Energy: 0.49609547469681464
Energy: 0.5213725230429006
Energy: 0.5666527290699891
Energy: 0.4812943165775492
Energy: 0.4812932504344688
Energy: 0.5666823680908604
Energy: 0.48148765214273476
Energy: 0.48428422359771023
Energy: 0.5049615145808694
Energy: 0.5213257924267898
Energy: 0.5057999269153357
Energy: 0.5048944954503358
Energy: 0.5063519606951387
Energy: 0.5045986939683813
Energy: 0.5047977082870513
Energy: 0.505223701001279
Energy: 0.505994205741702
Energy: 0.5048793688365747
Energy: 0.5218908395595239
Energy: 0.5045073932889059
Energy: 0.5675861615039096
Energy: 0.5013018765065884
Energy: 0.5038856424928027
Energy: 0.5665745923390432
Energy: 0.5011636646470522
Energy: 0.504466620806399
Energy: 0.5974122514477356
Energy: 0.5227720387063095
Energy: 0.5212636807085739
Energy: 0.5058808799686356
Energy: 0.5186502875757584
Energy: 0.5212077673454136
Energy: 0.4907774581919825
Energy: 0.5226335089149695
Energy: 0.5165656669562287
Energy: 0.4869122012218103
Energy: 0.5222296637136613
Energy: 0.521369377116415
Energy: 0.5662303194956354
Energy: 0.5222783240422283
Energy: 0.5173338882611002
Energy: 0.4965723797217884
Energy: 0.5217656173057686
Energy: 0.521454591648745
Energy: 0.6911651968352983
Energy: 0.5065603144072601
Energy: 0.47944296264702196
Energy: 0.4797731068539853
Energy: 0.5058358549186972
Energy: 0.47958102310569806

minimum gb energy = 0.47924791595847044 eV
minimum distance =  2.71474675856785 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.5890683042101497
Energy: 0.5016237964524131
Energy: 0.5795695624283705
Energy: 0.47888667471302343
Energy: 0.5015136982293206
Energy: 0.5793671982107776
Energy: 0.5835830492089983
Energy: 0.4930611743580585
Energy: 0.45687790523920646
Energy: 0.4482306695096894
Energy: 0.4972173074346176
Energy: 0.41902378787757116
Energy: 0.5358932985056887
Energy: 0.490929375751906
Energy: 0.4486449159961079
Energy: 0.41971486727480695
Energy: 0.4957087700266426
Energy: 0.4192227326221119
Energy: 0.5362264666370441
Energy: 0.41932186141737543
Energy: 0.41854875686147214
Energy: 0.4518559991772204
Energy: 0.4590515397411685
Energy: 0.41841621360357223
Energy: 0.5840057444042062
Energy: 0.42287989995384295
Energy: 0.4195304894728484
Energy: 0.4612329886465516
Energy: 0.4274726037232423
Energy: 0.4194188973689356
Energy: 0.49847143820137463
Energy: 0.39936712382322687
Energy: 0.4238047678859411
Energy: 0.48996417289504113
Energy: 0.4242361167374506
Energy: 0.39698435092844797
Energy: 0.5011661574805337
Energy: 0.44619247511955973
Energy: 0.4417998886935536
Energy: 0.49804738306468654
Energy: 0.4465811554078629
Energy: 0.44740732220344825
Energy: 0.5006226208425266
Energy: 0.4448949191774232
Energy: 0.4433583191867254
Energy: 0.500065265601462
Energy: 0.44597734771207725
Energy: 0.4450994554816548
Energy: 0.5343108440062739
Energy: 0.41850989762343993
Energy: 0.4448091079629847
Energy: 0.4988507278081107
Energy: 0.4442769534909093
Energy: 0.4197542057028236
Energy: 0.5366748023188121
Energy: 0.448724219187044
Energy: 0.44655326130048223
Energy: 0.48440401681409406
Energy: 0.4526488005261432
Energy: 0.44652070974233943
Energy: 0.5356446269071651
Energy: 0.4850530146184929
Energy: 0.4842786937594985
Energy: 0.44760731291784284
Energy: 0.4857670882681004
Energy: 0.4480575994325918
Energy: 0.5265273204231038
Energy: 0.4476930010926242
Energy: 0.45689659746633743
Energy: 0.4493876326506933
Energy: 0.4476707027167459
Energy: 0.4189405223694559

minimum gb energy = 0.39698435092844797 eV
minimum distance =  2.73557754028421 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.9701603433023289
Energy: 0.39659299938881476
Energy: 0.4371562039504933
Energy: 0.4089166249570729
Energy: 0.41088428902192997
Energy: 0.4369553008711768
Energy: 0.4768090046874094
Energy: 0.39776799120072426
Energy: 0.38301659976581703
Energy: 0.4037945322425474
Energy: 0.42454553272318535
Energy: 0.4037578811175555
Energy: 0.45371294937637296
Energy: 0.4177311671644626
Energy: 0.41582345072194477
Energy: 0.4180593944085918
Energy: 0.43053928485581017
Energy: 0.4138428141555915
Energy: 0.4559038640842546
Energy: 0.38524948843548773
Energy: 0.38503829708339626
Energy: 0.4175826100148017
Energy: 0.39970564589553914
Energy: 0.3853350713345076
Energy: 0.4728500491815886
Energy: 0.39969109274869563
Energy: 0.3756683114487714
Energy: 0.4228433551921923
Energy: 0.3990532987797785
Energy: 0.40826577107361345
Energy: 0.42899694083925505
Energy: 0.3820859273396655
Energy: 0.4047050376139105
Energy: 0.4286879156257575
Energy: 0.4108568223052656
Energy: 0.41003299997495163
Energy: 0.42907400330828516
Energy: 0.39020996348598186
Energy: 0.38497434495061345
Energy: 0.42980872414621096
Energy: 0.38730922508308074
Energy: 0.40856513310344217
Energy: 0.42963845819883445
Energy: 0.40466921759642444
Energy: 0.3986690660880958
Energy: 0.4298155089406248
Energy: 0.41683192328307317
Energy: 0.40705923091326546
Energy: 0.43158341230361125
Energy: 0.40621174516063724
Energy: 0.4027238679010196
Energy: 0.4243214969260261
Energy: 0.41952704671987606
Energy: 0.4071723074430398
Energy: 0.42543027934884586
Energy: 0.3883922428771348
Energy: 0.3853449813163066
Energy: 0.40975933295748174
Energy: 0.39747481661678874
Energy: 0.3810222154772286
Energy: 0.42048293963117545
Energy: 0.42613539087392327
Energy: 0.4236588608645608
Energy: 0.4120379024141858
Energy: 0.42875321008059725
Energy: 0.4080328745110936
Energy: 0.43206019800184053
Energy: 0.4134425600721231
Energy: 0.39738933750785527
Energy: 0.39790119208905717
Energy: 0.42934881335955094
Energy: 0.384743089342976
Energy: 0.5951174189732481
Energy: 0.4131649798159354
Energy: 0.3848285223748858
Energy: 0.39868096877186726
Energy: 0.4121494193336108
Energy: 0.40701549197255604
Energy: 0.4868006313244937
Energy: 0.41040626826078525
Energy: 0.4083141927254127
Energy: 0.3975002537848355
Energy: 0.4078127981826331
Energy: 0.38551462968410927
Energy: 0.43291840009276317
Energy: 0.41181719672127143
Energy: 0.41197099738389875
Energy: 0.4249849428305493
Energy: 0.4136166478281145
Energy: 0.40765297617550905
Energy: 0.429922453163415
Energy: 0.40754275980724763
Energy: 0.41838643373955764
Energy: 0.4302772994427053
Energy: 0.4172617791964663
Energy: 0.4113577601926911
Energy: 0.4294591228436891
Energy: 0.3852373490818518
Energy: 0.3829224217867605
Energy: 0.4285102545729685
Energy: 0.3943782223585329
Energy: 0.40657553506060873
Energy: 0.4721740852136986
Energy: 0.3970467396870007
Energy: 0.4070063719070814
Energy: 0.4128932732740694
Energy: 0.4028713369142856
Energy: 0.38663869854538574
Energy: 0.453412493871233
Energy: 0.4022904524856285
Energy: 0.4039445881574554
Energy: 0.424618742602773
Energy: 0.40193788036826694
Energy: 0.4093161034977142
Energy: 0.45347829937250744
Energy: 0.4036805482879106
Energy: 0.40713887442852664
Energy: 0.41897329285788876
Energy: 0.41982656690304565
Energy: 0.40974745977433075
Energy: 0.4536370855686581
Energy: 0.4068174794392889
Energy: 0.404489716565971
Energy: 0.4126741610943423
Energy: 0.41701403651487634
Energy: 0.41099860178360903
Energy: 0.4732605522648889
Energy: 0.39840992415639004
Energy: 0.39964527026313
Energy: 0.40001967219371354
Energy: 0.4175212441409051
Energy: 0.3964290587186042
Energy: 0.48064477507334014
Energy: 0.3951831627825618
Energy: 0.4063251467351803
Energy: 0.39937576949241305
Energy: 0.4247587978644192
Energy: 0.38729535617258487
Energy: 0.45409867373762686
Energy: 0.39027555356036153
Energy: 0.40776670404920196
Energy: 0.40125596500799826
Energy: 0.43131032786829376
Energy: 0.41272415092301235
Energy: 0.6024712522028776
Energy: 0.3908170514270182
Energy: 0.5025710078415039
Energy: 0.4074968436356294
Energy: 0.4004073492155885
Energy: 0.40866873258124287
Energy: 0.45369176106434095
Energy: 0.38570061469431777
Energy: 0.3823763220909367
Energy: 0.4250819580856219
Energy: 0.39838454637042603
Energy: 0.4075866753138814
Energy: 0.40092078677597154
Energy: 0.3825211024458435
Energy: 0.38269918727857244
Energy: 0.40120791508541387
Energy: 0.40614069791248913
Energy: 0.4155573657247448
Energy: 0.4339604868223152
Energy: 0.3852387971639149
Energy: 0.38552723827963425
Energy: 0.4288298425027391
Energy: 0.3993034609032037
Energy: 0.38309230662010807
Energy: 0.4289158507140228
Energy: 0.3983728529072097
Energy: 0.4065421228310638
Energy: 0.4289450293188502
Energy: 0.40957223905150475
Energy: 0.4084256906766003
Energy: 0.4318383660884618
Energy: 0.4042231381358156
Energy: 0.40557945506767373
Energy: 0.4216898678577785
Energy: 0.4165561516868507
Energy: 0.3855184946936223
Energy: 0.42070488884149737
Energy: 0.3863906266108969
Energy: 0.4061855131720757
Energy: 0.4112714152599328
Energy: 0.4058318476055479
Energy: 0.40564868292318285
Energy: 0.42394491603925266
Energy: 0.4063407617204465
Energy: 0.4052480629477946
Energy: 0.40969702231338023
Energy: 0.4289815483356609
Energy: 0.38115794380227974
Energy: 0.449439533318171
Energy: 0.4133093292575452
Energy: 0.42944432629840795
Energy: 0.4086722927222575
Energy: 0.4306580298003205
Energy: 0.38542128292873273
Energy: 0.4499138344744921
Energy: 0.42884184098648326
Energy: 0.4061612907150501
Energy: 0.40633915327935416
Energy: 0.42834546449675615
Energy: 0.3847628926720836
Energy: 0.44641647591561145
Energy: 0.3991428650855482
Energy: 0.40969152179222046
Energy: 0.4091778016519643
Energy: 0.4231679824903042
Energy: 0.40801852689537277
Energy: 0.4480797548753095
Energy: 0.41238607291363005
Energy: 0.4034237985474271
Energy: 0.4199666634793808
Energy: 0.4136971378525272
Energy: 0.3894534420711057
Energy: 0.43065595535436435
Energy: 0.41820000564380855
Energy: 0.422019727920357
Energy: 0.4306914196392688
Energy: 0.41571045648404004
Energy: 0.39087760297247975
Energy: 0.4297099638446613
Energy: 0.4029513561966593
Energy: 0.4031494796145873
Energy: 0.42878982561190476
Energy: 0.4025642068766371
Energy: 0.41055709745781704
Energy: 0.453036515217837
Energy: 0.38654729899148155
Energy: 0.3856997660737679
Energy: 0.45213055232489163
Energy: 0.4090562306528958
Energy: 0.4318732165018628
Energy: 0.45374169864150277
Energy: 0.402586351667232
Energy: 0.40313321486262504
Energy: 0.42431835669183693
Energy: 0.4030630839051085
Energy: 0.403536834782052
Energy: 0.4514486080295406
Energy: 0.4123144717694836
Energy: 0.4073398307578474
Energy: 0.41767608102117376
Energy: 0.40392489587498026
Energy: 0.40599101426746453
Energy: 0.4535884988528282
Energy: 0.4206786212711646
Energy: 0.40831100996800884
Energy: 0.4089968354724343
Energy: 0.4205820140561241
Energy: 0.4050945420330888
Energy: 0.4711128222505867
Energy: 0.3951616995270301
Energy: 0.4094761297709131
Energy: 0.4048680467449749
Energy: 0.42586876124681394
Energy: 0.38721733607574155

minimum gb energy = 0.3756683114487714 eV
minimum distance =  2.69155837842273 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.19618919293600234
Energy: 0.2238173556132975
Energy: 0.22000342436735015
Energy: 0.19747558886774794
Energy: 0.2243542166534712
Energy: 0.19776522187615433
Energy: 0.24443417435584305
Energy: 0.21019202965151543
Energy: 0.2146325711371435
Energy: 0.22074389965362165
Energy: 0.22477170533749133
Energy: 0.21480677323356936
Energy: 0.24674206387547679
Energy: 0.22872433562210462
Energy: 0.21162213094204232
Energy: 0.22272290371097533
Energy: 0.2228267860751676
Energy: 0.21504318645127568
Energy: 0.2467214915573415
Energy: 0.22752611860202046
Energy: 0.2111478032006957
Energy: 0.2264034570343158
Energy: 0.2249631177871675
Energy: 0.21272820414874508
Energy: 0.24421756790963722
Energy: 0.20065147761582292
Energy: 0.21057359315502305
Energy: 0.2267017996476794
Energy: 0.19773099155345664
Energy: 0.2216647897562753
Energy: 0.2224024047373844
Energy: 0.19835362586920896
Energy: 0.19889466436772302
Energy: 0.20851421603017234
Energy: 0.2010612054206178
Energy: 0.21050713286491657
Energy: 0.21915558859519288
Energy: 0.21022094345846337
Energy: 0.21485458410818814
Energy: 0.22001241114050923
Energy: 0.2074566016566396
Energy: 0.2158528068184161
Energy: 0.22238605249278853
Energy: 0.2122235726102155
Energy: 0.22635239380848035
Energy: 0.2224220559109265
Energy: 0.20951991741438145
Energy: 0.21143339284782722
Energy: 0.24394872614856428
Energy: 0.21058861594306594
Energy: 0.2170609714464172
Energy: 0.2228926773139305
Energy: 0.2225498381189952
Energy: 0.21222590813190972
Energy: 0.2004930976141679
Energy: 0.21809989606074884
Energy: 0.19968676856643727
Energy: 0.20129286854339298
Energy: 0.222445676071346
Energy: 0.2101828383752632
Energy: 0.19688997483406936
Energy: 0.21077611336532892
Energy: 0.21821286242868745
Energy: 0.1972605296616862
Energy: 0.20779841429740298
Energy: 0.1992978922082626
Energy: 0.24530779095144017
Energy: 0.22663657759047875
Energy: 0.21559442338100276
Energy: 0.22126858045778208
Energy: 0.22205159424972168
Energy: 0.21564574335726971
Energy: 0.2464665533847189
Energy: 0.2498218630682139
Energy: 0.22827860795109822
Energy: 0.21004109463487652
Energy: 0.2469107794378629
Energy: 0.22724919413024958
Energy: 0.24452996840940525
Energy: 0.22580162787180227
Energy: 0.21760788495699937
Energy: 0.22221841121216676
Energy: 0.2219666431478158
Energy: 0.22120342023730288
Energy: 0.24690895830065832
Energy: 0.20343262403374074
Energy: 0.197958219144923
Energy: 0.22348530096048513
Energy: 0.19916715642337868
Energy: 0.1979804652792128
Energy: 0.22089387853521358
Energy: 0.21240994954584713
Energy: 0.21508601475859415
Energy: 0.2217144845769613
Energy: 0.1973948815537622
Energy: 0.21758400921270468
Energy: 0.22242901232170914
Energy: 0.20502505519793715
Energy: 0.2200046255044255
Energy: 0.22276505022139503
Energy: 0.22430395286995597
Energy: 0.21329673419767142
Energy: 0.24754014011147837
Energy: 0.21154260639031955
Energy: 0.22552607949521503
Energy: 0.24812271384418413
Energy: 0.20990273703661705
Energy: 0.21131842172969126
Energy: 0.1969327890199863
Energy: 0.21085653732057857
Energy: 0.21862585163643034
Energy: 0.1973959026624981
Energy: 0.2102355806058225
Energy: 0.2215893663036012

minimum gb energy = 0.19618919293600234 eV
minimum distance =  2.7393403049652 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.7927975759714915
Energy: 0.33912456900670035
Energy: 0.40117051306053425
Energy: 0.3566304423905796
Energy: 0.3286275699838821
Energy: 0.39793507428443287
Energy: 0.32803533434136833
Energy: 0.3284874025116535
Energy: 0.33034291807912036
Energy: 0.32499551556136275
Energy: 0.3259402367374438
Energy: 0.32372772765822566
Energy: 0.3280523011539695
Energy: 0.3336343587512289
Energy: 0.3287572210819958
Energy: 0.3277805164519972
Energy: 0.33332867365988306
Energy: 0.3249588989019068
Energy: 0.32872630492252675
Energy: 0.33976715958537623
Energy: 0.32335741707151516
Energy: 0.3286129449423446
Energy: 0.3260425313678941
Energy: 0.3293169409169011
Energy: 0.32645055415111424
Energy: 0.39014688048426827
Energy: 0.36247730672937767
Energy: 0.3364248206106668
Energy: 0.3253350179472417
Energy: 0.32979365628791435
Energy: 0.34991525875160157
Energy: 0.36478910493430405
Energy: 0.36821537191660897
Energy: 0.33399515165228266
Energy: 0.34128816614738977
Energy: 0.36348209873740783
Energy: 0.35359320752091267
Energy: 0.3282156155963243
Energy: 0.3315418806351525
Energy: 0.3250640471319172
Energy: 0.3334870628447151
Energy: 0.32574281436163216
Energy: 0.33527451419298093
Energy: 0.33845660790200366
Energy: 0.3377339147385366
Energy: 0.33630735510494236
Energy: 0.3379613850621496
Energy: 0.3388401421889568
Energy: 0.35349036617286195
Energy: 0.33034019564978306
Energy: 0.32366009914122157
Energy: 0.33868496645237334
Energy: 0.32538304939759455
Energy: 0.32407431501952416
Energy: 0.4679338133477329
Energy: 0.35481336171508915
Energy: 0.36345447854939444
Energy: 0.33072554898782264
Energy: 0.36862719386119364
Energy: 0.36739236191787206
Energy: 0.3719255670168267
Energy: 0.3546957293957063
Energy: 0.35539144219643776
Energy: 0.3269406539056768
Energy: 0.3629161511438857
Energy: 0.38995189978628325
Energy: 0.41965281519045944
Energy: 0.31987084986100367
Energy: 0.3241536755329141
Energy: 0.40991782867204524
Energy: 0.3172540016757631
Energy: 0.32496169242695866
Energy: 0.39890863086199857
Energy: 0.3206275353196756
Energy: 0.31160647111672557
Energy: 0.341275817186318
Energy: 0.3188912516943078
Energy: 0.3283852147855068
Energy: 0.3989733863760547
Energy: 0.3891929587942349
Energy: 0.3880122062827606
Energy: 0.3331778450872432
Energy: 0.3927538945641112
Energy: 0.38780165148019846
Energy: 0.40144992012698694
Energy: 0.332084142643572
Energy: 0.3539045403046853
Energy: 0.37398361983320205
Energy: 0.33001888568938
Energy: 0.3327193600144963
Energy: 0.5043073890253605
Energy: 0.38969416706328913
Energy: 0.38808334367667907
Energy: 0.35451802737420424
Energy: 0.3932849967275807
Energy: 0.38837480282303743
Energy: 0.550663285111545
Energy: 0.36432910529788204
Energy: 0.3262557365651158
Energy: 0.46729992290689704
Energy: 0.3794801027105649
Energy: 0.32646979166898255
Energy: 0.37857303642639545
Energy: 0.35505701880372725
Energy: 0.3893434033681211
Energy: 0.34279461812548945
Energy: 0.3631108633503868
Energy: 0.3886798950073017
Energy: 0.3763135072192612
Energy: 0.3287240453795012
Energy: 0.36864419199071086
Energy: 0.3342398590685397
Energy: 0.334881082298546
Energy: 0.3671550830425141
Energy: 0.44694000367735154
Energy: 0.41213059482424463
Energy: 0.33460188747891956
Energy: 0.42498389343381937
Energy: 0.33700791142863745
Energy: 0.3321693279316618
Energy: 0.5044677740761745
Energy: 0.36460853739971366
Energy: 0.357438712973384
Energy: 0.3696948616635771
Energy: 0.3898469401312879
Energy: 0.3559987785853142
Energy: 0.4607965210666919
Energy: 0.3373617472525022
Energy: 0.34738077697468456
Energy: 0.46870805403074123
Energy: 0.3408159212203419
Energy: 0.39316751884119056
Energy: 0.3247700939790061
Energy: 0.36541154292455214
Energy: 0.3580256174000997
Energy: 0.32513666266661057
Energy: 0.363339592855137
Energy: 0.35656923664650303
Energy: 0.3237668279651404
Energy: 0.32855065318709725
Energy: 0.3252755070372481
Energy: 0.3237890874386268
Energy: 0.3288702132108179
Energy: 0.32937114998503014
Energy: 0.39053588636615794
Energy: 0.328308234567837
Energy: 0.33023194789444155
Energy: 0.32862159911143984
Energy: 0.32733879712534336
Energy: 0.3279258649755512
Energy: 0.3725427803826732
Energy: 0.32576258870664293
Energy: 0.3287665251934597
Energy: 0.32308061046840447
Energy: 0.3245957881333084
Energy: 0.36395692842231175

minimum gb energy = 0.31160647111672557 eV
minimum distance =  2.67544430425359 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.7399836603928428
Energy: 0.366146936730844
Energy: 0.3486196730354625
Energy: 0.4115808556961806
Energy: 0.38403054562338235
Energy: 0.41165822305142985
Energy: 0.34794886233004946
Energy: 0.3544468626727113
Energy: 0.3464999310000326
Energy: 0.34940404657272234
Energy: 0.3484141231609716
Energy: 0.34643774360860763
Energy: 0.3481995368041162
Energy: 0.34672648359320507
Energy: 0.34604979968066885
Energy: 0.3494354191498153
Energy: 0.3496193111505349
Energy: 0.3461328629813037
Energy: 0.34898361491301955
Energy: 0.34524990197188427
Energy: 0.34736438937674396
Energy: 0.3489194981088525
Energy: 0.3496885969000832
Energy: 0.3491187659261492
Energy: 0.3476285799628673
Energy: 0.34691326100609093
Energy: 0.3460006066755241
Energy: 0.3591125198366345
Energy: 0.34998112687651795
Energy: 0.34705844021902815
Energy: 0.3928432511879621
Energy: 0.347850391474175
Energy: 0.3476256336518435
Energy: 0.36237456663661255
Energy: 0.35176014022875507
Energy: 0.35322374321189093
Energy: 0.391629598112224
Energy: 0.34954177293971755
Energy: 0.34831806074313265
Energy: 0.3492345268404561
Energy: 0.3602575825387084
Energy: 0.34821394033706915
Energy: 0.36327316496472367
Energy: 0.3731317953457332
Energy: 0.37201678486648837
Energy: 0.33106350056744815
Energy: 0.37572745258750806
Energy: 0.3479278200304858
Energy: 0.39245634444928934
Energy: 0.34809950556263564
Energy: 0.3470531487005936
Energy: 0.3617965496191384
Energy: 0.34949120787911325
Energy: 0.3466379829547611
Energy: 0.5243208249249365
Energy: 0.35244726777470764
Energy: 0.34698282882153336
Energy: 0.4527228715210864
Energy: 0.3640862819368531
Energy: 0.34790274853618486
Energy: 0.3926979432440262
Energy: 0.352441310136887
Energy: 0.3466204792917074
Energy: 0.35090573817370324
Energy: 0.36096418582280676
Energy: 0.34560321724951476
Energy: 0.40298681425496014
Energy: 0.3328019361200881
Energy: 0.33190831739675397
Energy: 0.36322383127508273
Energy: 0.33296171143825737
Energy: 0.3468297979172779
Energy: 0.3503183002565695
Energy: 0.3317131049303677
Energy: 0.33162122376252734
Energy: 0.36352924149422977
Energy: 0.33263848780182664
Energy: 0.3311181641514752
Energy: 0.3510570444672167
Energy: 0.3516416848168006
Energy: 0.3466914902006735
Energy: 0.3503859959229171
Energy: 0.3608291815731869
Energy: 0.34717862488179285
Energy: 0.37603425975587274
Energy: 0.36454347629444744
Energy: 0.3663478474701927
Energy: 0.37612748738554175
Energy: 0.3473106929725859
Energy: 0.3724427366241373
Energy: 0.3486203293534645
Energy: 0.3545896235388022
Energy: 0.3477111580751966
Energy: 0.36038770376774243
Energy: 0.3490747537451036
Energy: 0.3479269545171158
Energy: 0.6840852782769478
Energy: 0.34873818991487365
Energy: 0.3319525608702525
Energy: 0.3624924790955186
Energy: 0.36239042276185035
Energy: 0.3624322013335374
Energy: 0.3637071496613753
Energy: 0.3504252518738012
Energy: 0.34995661258136895
Energy: 0.35008782339262373
Energy: 0.3602023717579765
Energy: 0.332668499983058
Energy: 0.3495862756992946
Energy: 0.35061556891735046
Energy: 0.3479516937732897
Energy: 0.34954812296200294
Energy: 0.3495975214192311
Energy: 0.34765094909821537
Energy: 0.34736127386170323
Energy: 0.34580512995415885
Energy: 0.3465425457451646
Energy: 0.3490439548467877
Energy: 0.3500667678040819
Energy: 0.3470325308297517
Energy: 0.34812252267933697
Energy: 0.3473022553493798
Energy: 0.3464325748277948
Energy: 0.34892869803038623
Energy: 0.34888529877887237
Energy: 0.3463860435311781
Energy: 0.36733667286338073
Energy: 0.36218741081432276
Energy: 0.38384757060248975
Energy: 0.4139204022022887
Energy: 0.34658056874199017
Energy: 0.3917862567103457
Energy: 0.3921837212113364
Energy: 0.34807623226437084
Energy: 0.3477086806221842
Energy: 0.3603961397750161
Energy: 0.3490475662958058
Energy: 0.3474980280384441
Energy: 0.3632320598019668
Energy: 0.37521118833303635
Energy: 0.3505174765609735
Energy: 0.35848781035860927
Energy: 0.37730171560831594
Energy: 0.3497524561486165
Energy: 0.39192996489346593
Energy: 0.3492978966118473
Energy: 0.3478655390538627
Energy: 0.36057167138670976
Energy: 0.3497705926156225
Energy: 0.34840919406518334
Energy: 0.5249468310494271
Energy: 0.35208060897754767
Energy: 0.34809153384873226
Energy: 0.3516100501933745
Energy: 0.36118963399856097
Energy: 0.3461375786500674
Energy: 0.5249652126170165
Energy: 0.35244704366060065
Energy: 0.34710141171464254
Energy: 0.3505771959039393
Energy: 0.3645347003180633
Energy: 0.34839779599551457
Energy: 0.3929708773507794
Energy: 0.35895398702381726
Energy: 0.3572678820010968
Energy: 0.36076833821292975
Energy: 0.3439682077835302
Energy: 0.3555310309118738
Energy: 0.3508280287592861
Energy: 0.3314818016011437
Energy: 0.33121222949158974
Energy: 0.36608721959397145
Energy: 0.3314351437549364
Energy: 0.3603174427031203
Energy: 0.35017721039792604
Energy: 0.3528941899219864
Energy: 0.35137354120911113
Energy: 0.3482099054157692
Energy: 0.35277662264504883
Energy: 0.3516487144648558
Energy: 0.3497760340933945
Energy: 0.34661391915673734
Energy: 0.3452751434658069
Energy: 0.34991219096927256
Energy: 0.3470177162100826
Energy: 0.34773864441115027
Energy: 0.3492203449114079
Energy: 0.35003976558372946
Energy: 0.3461766363188333
Energy: 0.35177987475123634
Energy: 0.34999963365254144
Energy: 0.34779807142753194
Energy: 0.6841890830333834
Energy: 0.34943573765181035
Energy: 0.33354734737271896
Energy: 0.33388739877554696
Energy: 0.3458550132118139
Energy: 0.3326072415331097

minimum gb energy = 0.33106350056744815 eV
minimum distance =  2.69541689842652 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.4751340572847217
Energy: 0.45140038550482914
Energy: 0.38248550754349864
Energy: 0.3774719764077129
Energy: 0.451797101759308
Energy: 0.3813636885473647
Energy: 0.3858433783134504
Energy: 0.3729307357957984
Energy: 0.37220405071591717
Energy: 0.38378763492510326
Energy: 0.3826298169159094
Energy: 0.37341410470276065
Energy: 0.38546300239923925
Energy: 0.37382350292026323
Energy: 0.3738953467433633
Energy: 0.3741003974874775
Energy: 0.3738127499068688
Energy: 0.3810029611674477
Energy: 0.3866846490110511
Energy: 0.37585620850043117
Energy: 0.37795424749559325
Energy: 0.37383344524169343
Energy: 0.377532717406889
Energy: 0.37785004727091454
Energy: 0.38467111201185966
Energy: 0.3780643072204462
Energy: 0.362764559147371
Energy: 0.385148164082078
Energy: 0.388988560731363
Energy: 0.3635342879724989
Energy: 0.4098424503840453
Energy: 0.3770299129693739
Energy: 0.37799212540358595
Energy: 0.36265695092293043
Energy: 0.3768441849849803
Energy: 0.37894964337936954
Energy: 0.41092438940661435
Energy: 0.38612844326582907
Energy: 0.38670711107210515
Energy: 0.38323629362858747
Energy: 0.3987004329517042
Energy: 0.37744040237853227
Energy: 0.4043793095384142
Energy: 0.39488702023869077
Energy: 0.37761587297215143
Energy: 0.36209672891683325
Energy: 0.3940723665003621
Energy: 0.3783812591506119
Energy: 0.41036031594271494
Energy: 0.3627169522946981
Energy: 0.36310992736043995
Energy: 0.3983369871821131
Energy: 0.36468044093830115
Energy: 0.365424843643055
Energy: 0.41057636901006483
Energy: 0.37401528847603693
Energy: 0.3736603944173567
Energy: 0.37358476749648417
Energy: 0.3735612659438045
Energy: 0.38053672951118295
Energy: 0.40940152729568285
Energy: 0.37452249291221756
Energy: 0.3763417554014375
Energy: 0.3736142472354793
Energy: 0.36480455384933946
Energy: 0.376233726357681
Energy: 0.42581476062837226
Energy: 0.3621583871234792
Energy: 0.3619696655496397
Energy: 0.3811172661260809
Energy: 0.36923391098594627
Energy: 0.3618838472134624
Energy: 0.4138580382147362
Energy: 0.36253051681483933
Energy: 0.36240544639562783
Energy: 0.3626517350975505
Energy: 0.37159386494767493
Energy: 0.36205456677978026
Energy: 0.3907391696692445
Energy: 0.3753895873978365
Energy: 0.3754841120887001
Energy: 0.38712255807699886
Energy: 0.38477492564455845
Energy: 0.37576541820677817
Energy: 0.3785514610655742
Energy: 0.37448576883977797
Energy: 0.3743115085088348
Energy: 0.37408612101404143
Energy: 0.37498474479192323
Energy: 0.374012698424262
Energy: 0.386652868954716
Energy: 0.3833034293161518
Energy: 0.37367461935678786
Energy: 0.3970562654442436
Energy: 0.38447044457203017
Energy: 0.373825687403994
Energy: 0.62973526056212
Energy: 0.37724778028711553
Energy: 0.37471686662563525
Energy: 0.37645138911715
Energy: 0.40842306715582644
Energy: 0.3804907086806774
Energy: 0.4134393549501193
Energy: 0.3628913409653586
Energy: 0.3631618722029475
Energy: 0.4026652608889356
Energy: 0.36518300301892836
Energy: 0.36295222128998633
Energy: 0.3852236832204668
Energy: 0.36220691648626874
Energy: 0.362979160801553
Energy: 0.3736056860168057
Energy: 0.364839660910863
Energy: 0.3779343436873304
Energy: 0.36628629948092817
Energy: 0.3624862225664744
Energy: 0.36343215143563323
Energy: 0.36382636175557426
Energy: 0.36306506877309935
Energy: 0.37789854734301076
Energy: 0.3639498471691952
Energy: 0.3653437353467035
Energy: 0.3655819590437935
Energy: 0.36464799347829574
Energy: 0.36618638940527076
Energy: 0.36503721437977693
Energy: 0.41477146635498824
Energy: 0.38044370501259694
Energy: 0.37899915242867743
Energy: 0.4150181085521301
Energy: 0.37977557823695546
Energy: 0.3938080300060898
Energy: 0.3861404840145466
Energy: 0.37427097778486174
Energy: 0.3747497314192298
Energy: 0.3638776345995506
Energy: 0.3807935549825672
Energy: 0.3656236818422093
Energy: 0.4089872573089127
Energy: 0.36999311764300674
Energy: 0.3624139031441407
Energy: 0.3621664293650554
Energy: 0.37330420821815175
Energy: 0.3623009271426127
Energy: 0.4073233857816999
Energy: 0.3951334727345955
Energy: 0.37267665358664015
Energy: 0.38428444238791937
Energy: 0.382310083273474
Energy: 0.37245492559201976
Energy: 0.38522538032412657
Energy: 0.3758934300206451
Energy: 0.37992417063352735
Energy: 0.3737825025669587
Energy: 0.3738748041224114
Energy: 0.3806775745187345
Energy: 0.38568900148137114
Energy: 0.37876043413757504
Energy: 0.3775067678542282
Energy: 0.3742112489819146
Energy: 0.37475264269017855
Energy: 0.3766389941590774
Energy: 0.384695432290893
Energy: 0.3636217022124169
Energy: 0.3840732127038943
Energy: 0.38497559227506195
Energy: 0.37772615087549155
Energy: 0.37228421989925864
Energy: 0.45775940797984827
Energy: 0.38004538740126537
Energy: 0.37930255929315154
Energy: 0.457554831158247
Energy: 0.37914800190068476
Energy: 0.3778579000805299
Energy: 0.4099445853870093
Energy: 0.3679144896830783
Energy: 0.3834141293019361
Energy: 0.382563913593599
Energy: 0.37922066885528666
Energy: 0.3756766783623411
Energy: 0.4052503050469044
Energy: 0.3936915087862373
Energy: 0.3773232781701628
Energy: 0.36215988880645433
Energy: 0.4073512944271063
Energy: 0.3781202251414524
Energy: 0.411077900772212
Energy: 0.3631619397531164
Energy: 0.365380939803966
Energy: 0.3656010009033303
Energy: 0.3653390675757146
Energy: 0.3655295480080609
Energy: 0.40971601025482746
Energy: 0.3755459594589396
Energy: 0.37773433085942515
Energy: 0.3737953490021281
Energy: 0.3734657065574917
Energy: 0.3783215175623884
Energy: 0.44414744156717134
Energy: 0.3868508880162768
Energy: 0.37732479633577654
Energy: 0.3736264572351943
Energy: 0.3765592221240305
Energy: 0.3785995524463742
Energy: 0.4109108340191821
Energy: 0.36883221806299366
Energy: 0.36186368499883564
Energy: 0.38177270999067064
Energy: 0.3630990865495031
Energy: 0.3661477007307761
Energy: 0.4145236638135176
Energy: 0.3625740073701241
Energy: 0.3624466890352931
Energy: 0.362856138961702
Energy: 0.36252391551641727
Energy: 0.3620553679572446
Energy: 0.38807397285329553
Energy: 0.38637631630966923
Energy: 0.37425561126264334
Energy: 0.38611385381993896
Energy: 0.3866522659975862
Energy: 0.37408769605485886
Energy: 0.3905516284918872
Energy: 0.37424834612354235
Energy: 0.395830190435866
Energy: 0.3913355744618176
Energy: 0.37406597985461687
Energy: 0.39646737564419143
Energy: 0.38806042406537794
Energy: 0.38463453100864625
Energy: 0.3752887783144385
Energy: 0.37452405679592843
Energy: 0.3855945420457326
Energy: 0.37503658176580656
Energy: 0.6288955925204858
Energy: 0.38192481946550055
Energy: 0.3630363054091101
Energy: 0.37483151704237133
Energy: 0.363371712206248
Energy: 0.37884160011225365
Energy: 0.4121285784999514
Energy: 0.36358180762724507
Energy: 0.36328600144525003
Energy: 0.3885752146170785
Energy: 0.36499267607796587
Energy: 0.36336590887996145
Energy: 0.39118425199402834
Energy: 0.3618481129037998
Energy: 0.36302235645198805
Energy: 0.3732984837655403
Energy: 0.3624867504930514
Energy: 0.37695218751448734
Energy: 0.3881133525070375
Energy: 0.36230388982586814
Energy: 0.362119106705426
Energy: 0.37571263423654927
Energy: 0.3617534282162523
Energy: 0.36514255733284345
Energy: 0.36312455496565593
Energy: 0.36361806425653875
Energy: 0.36551166670411384
Energy: 0.3639072617323939
Energy: 0.3648320092984861
Energy: 0.36301043744865985
Energy: 0.41431297151768737
Energy: 0.38015291539682694
Energy: 0.3924050358663425
Energy: 0.41404048578012814
Energy: 0.3813380301389361
Energy: 0.3933345215403563
Energy: 0.3870950115370759
Energy: 0.3736904265488927
Energy: 0.3754757179504517
Energy: 0.37729463915128736
Energy: 0.3829573920596931
Energy: 0.37610616347410875
Energy: 0.6340609098095299
Energy: 0.36501987075324543
Energy: 0.36216779466975313
Energy: 0.36272119564306304
Energy: 0.37003717203983316
Energy: 0.36214929723568684

minimum gb energy = 0.3617534282162523 eV
minimum distance =  2.70123141280792 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.5623443959000136
Energy: 0.423666400386403
Energy: 0.4070699840450552
Energy: 0.407987075445422
Energy: 0.42314070552309346
Energy: 0.40904292581161594
Energy: 0.41971734730589494
Energy: 0.39473940573990307
Energy: 0.3948387139005358
Energy: 0.3945093637162879
Energy: 0.3955834429641566
Energy: 0.3944561652267577
Energy: 0.41470922360884005
Energy: 0.3827368841260539
Energy: 0.39553537128193694
Energy: 0.3958816076346068
Energy: 0.3810154761891718
Energy: 0.39537638105982836
Energy: 0.4149243596602773
Energy: 0.3954905927561238
Energy: 0.3953641837667388
Energy: 0.3939869855099295
Energy: 0.39542577271543866
Energy: 0.3953839174082815
Energy: 0.4178445340126741
Energy: 0.39531639578247685
Energy: 0.39625990296664143
Energy: 0.4179682226135826
Energy: 0.3952309227891786
Energy: 0.39660538180164484
Energy: 0.4188119934036009
Energy: 0.3973809690193086
Energy: 0.39736988309822396
Energy: 0.41914420976256883
Energy: 0.3975105636954636
Energy: 0.3976495503913189
Energy: 0.4437828636947215
Energy: 0.39549451307373407
Energy: 0.39458933011438396
Energy: 0.37810761390998465
Energy: 0.3951680522514144
Energy: 0.3943881122224219

minimum gb energy = 0.37810761390998465 eV
minimum distance =  2.74430226096123 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.6323858448066919
Energy: 0.5020792800035977
Energy: 0.45593986658126867
Energy: 0.491769200169409
Energy: 0.5129744323678709
Energy: 0.471420299839175
Energy: 0.48482860565451197
Energy: 0.4648544992838926
Energy: 0.46411823175515693
Energy: 0.4666756905654166
Energy: 0.46779196751060953
Energy: 0.45823402154139337
Energy: 0.4938845200560091
Energy: 0.47458632772230197
Energy: 0.47456621004236715
Energy: 0.4555550084230126
Energy: 0.47436368222643327
Energy: 0.45523343841666075
Energy: 0.4866283686863386
Energy: 0.45570164734038926
Energy: 0.4573566170015813
Energy: 0.488133612754657
Energy: 0.47586310118063546
Energy: 0.4560473197645248
Energy: 0.4922419156080392
Energy: 0.4615186314438653
Energy: 0.49329700711185287
Energy: 0.4937614989051235
Energy: 0.4899702704740754
Energy: 0.45473674074569764
Energy: 0.48533600445722197
Energy: 0.49106331034845874
Energy: 0.4901255365542237
Energy: 0.4865385752550705
Energy: 0.48757171727392457
Energy: 0.48900155522225625
Energy: 0.4842672752220082
Energy: 0.462355318988277
Energy: 0.4630718201271623
Energy: 0.49016424561038463
Energy: 0.4642805725477816
Energy: 0.49421446016191706
Energy: 0.5822162747242957
Energy: 0.5097321282090207
Energy: 0.4717182447540912
Energy: 0.4952604828557161
Energy: 0.5115325098309303
Energy: 0.5049984635926089
Energy: 0.4858970965007538
Energy: 0.4959444906416427
Energy: 0.4966147653315451
Energy: 0.49326349916065243
Energy: 0.4940445361500095
Energy: 0.4979459391985093
Energy: 0.4940281509382974
Energy: 0.4677244400311256
Energy: 0.46716949623468396
Energy: 0.5165804416150461
Energy: 0.4783583976882206
Energy: 0.47689304415761935
Energy: 0.5210700396234148
Energy: 0.46601126408816496
Energy: 0.47265329332782124
Energy: 0.5199504545636137
Energy: 0.4620051602407987
Energy: 0.5043416987728438
Energy: 0.538755097712422
Energy: 0.49681754232659847
Energy: 0.5021997617031271
Energy: 0.4909083214066637
Energy: 0.4859983981956591
Energy: 0.505512681176159
Energy: 0.480014633034931
Energy: 0.5023149732336706
Energy: 0.48490717178891934
Energy: 0.45992541554165006
Energy: 0.4857054441890017
Energy: 0.4853103447447347
Energy: 0.5072218298175691
Energy: 0.4880950562928077
Energy: 0.4874614358054605
Energy: 0.49902553905347385
Energy: 0.4857685366778667
Energy: 0.48810173421524666
Energy: 0.5301537887872515
Energy: 0.5142734283324242
Energy: 0.5205507097219352
Energy: 0.46953355446419115
Energy: 0.5137134612202245
Energy: 0.49267792254391846
Energy: 0.5078075566999509
Energy: 0.4918092493711845
Energy: 0.49430313296622136
Energy: 0.49778449324132196
Energy: 0.48797779176142564
Energy: 0.49297259672179483
Energy: 0.568905933431171
Energy: 0.4735655704185047
Energy: 0.4731405205386653
Energy: 0.5117333130778097
Energy: 0.47447769563261183
Energy: 0.478372394786669
Energy: 0.491400054479547
Energy: 0.4714451706238087
Energy: 0.5016209763377457
Energy: 0.493491917987937
Energy: 0.46899725233479456
Energy: 0.4939970890083437
Energy: 0.4828886275691574
Energy: 0.4884381333202755
Energy: 0.49011360731089604
Energy: 0.46923495075357513
Energy: 0.5088644572334037
Energy: 0.4750489083054273
Energy: 0.5216275162319074
Energy: 0.48558638869804094
Energy: 0.4889964203127637
Energy: 0.46946292792442545
Energy: 0.4844738341687427
Energy: 0.46653597186242435
Energy: 0.5004451555032354
Energy: 0.49123617643798384
Energy: 0.4942207480555889
Energy: 0.48245728567617036
Energy: 0.49447984687930896
Energy: 0.4951277939846032
Energy: 0.4878862708309792
Energy: 0.4890646598273695
Energy: 0.48551300397029273
Energy: 0.4889067778128441
Energy: 0.4893232906823366
Energy: 0.48443757552908695
Energy: 0.49229402922257215
Energy: 0.48872973516048285
Energy: 0.4877588313169162
Energy: 0.4931505545762213
Energy: 0.49138076296677785
Energy: 0.4888466568072423
Energy: 0.48809476535656915
Energy: 0.47043800086339693
Energy: 0.46984277965327287
Energy: 0.48820457913964926
Energy: 0.47110268726420323
Energy: 0.48795220428371044
Energy: 0.48504039847765545
Energy: 0.4863538303546969
Energy: 0.49982662370154934
Energy: 0.5075747861995273
Energy: 0.4861021393003711
Energy: 0.4997411543584943
Energy: 0.6219170519937699
Energy: 0.5313515650424916
Energy: 0.4798685275867016
Energy: 0.45917174077686507
Energy: 0.5364609630262845
Energy: 0.4590517615394403
Energy: 0.44223171083958457
Energy: 0.5037126295474076
Energy: 0.4633966678343696
Energy: 0.44236717160937106
Energy: 0.5028328923124905
Energy: 0.4571142391456208
Energy: 0.4858919123376786
Energy: 0.5013641394419737
Energy: 0.5048465330977623
Energy: 0.5094680593734001
Energy: 0.5024687596410586
Energy: 0.4998052071430224
Energy: 0.4950293486608217
Energy: 0.4748990742039763
Energy: 0.47445124347483897
Energy: 0.4951595667423823
Energy: 0.47559261162477684
Energy: 0.49099780858800035
Energy: 0.4868045392572508
Energy: 0.4917795307397445
Energy: 0.4921264232898248
Energy: 0.48756254299929974
Energy: 0.49223125781078503
Energy: 0.4944170926446318
Energy: 0.4870938860509459
Energy: 0.49403044061704954
Energy: 0.4918158423089986
Energy: 0.48752983117596577
Energy: 0.507757288816615
Energy: 0.4910552107703692
Energy: 0.491602981144089
Energy: 0.4893279827537752
Energy: 0.4905442759361357
Energy: 0.500057597529205
Energy: 0.48882960163722317
Energy: 0.5002733400115311
Energy: 0.5869538328159495
Energy: 0.5012016068404097
Energy: 0.5043696450788774
Energy: 0.46935615029755773
Energy: 0.5019052562539893
Energy: 0.4728426130724147
Energy: 0.4652326205510017
Energy: 0.499802002593718
Energy: 0.5020640854641378
Energy: 0.4728110670097625
Energy: 0.49288830365685016
Energy: 0.5031376808919036
Energy: 0.4951251002573472
Energy: 0.47589792818730037
Energy: 0.4777509565719787
Energy: 0.4925820898126374
Energy: 0.4621781702679004
Energy: 0.4935451012274447
Energy: 0.516367151917863
Energy: 0.4677227492629266
Energy: 0.46709469136456394
Energy: 0.5153130012441073
Energy: 0.4687417376541458
Energy: 0.4771148774365666
Energy: 0.5124746660700739
Energy: 0.49581508007162967
Energy: 0.49747435926923333
Energy: 0.504498290196505
Energy: 0.49500176681445407
Energy: 0.49920413809951564
Energy: 0.479364275674203
Energy: 0.4861112289218841
Energy: 0.4893943176510991
Energy: 0.4592596416570103
Energy: 0.48715913068672007
Energy: 0.5513153823503721
Energy: 0.5114799800275731
Energy: 0.49158579907466643
Energy: 0.49576354310555715
Energy: 0.49923226202897075
Energy: 0.48891468712727193
Energy: 0.49264639037539093
Energy: 0.5008129497922833
Energy: 0.4900230334450626
Energy: 0.4883616173714966
Energy: 0.46956935064243094
Energy: 0.4893710913517631
Energy: 0.4878099026775729
Energy: 0.5311414441982927
Energy: 0.4884810487726221
Energy: 0.4887040218152999
Energy: 0.5021284173413751
Energy: 0.5180023417576516
Energy: 0.4915648942256915
Energy: 0.5041735358630933
Energy: 0.47090395183991096
Energy: 0.47422896632283823
Energy: 0.5251894750014482
Energy: 0.47772288768569365
Energy: 0.5131012747465825
Energy: 0.5534604044861648
Energy: 0.47362569509214686
Energy: 0.47050312372127145
Energy: 0.5200268869393605
Energy: 0.46694446895561664
Energy: 0.48639342344476805
Energy: 0.49170014145923396
Energy: 0.4902039596895227
Energy: 0.4936811993337252
Energy: 0.49047621072982134
Energy: 0.48750037708280763
Energy: 0.48789395160018784
Energy: 0.6687568656303334
Energy: 0.44559493856652366
Energy: 0.49334552846058954
Energy: 0.488945929593653
Energy: 0.44432888097614465
Energy: 0.49334399490638947
Energy: 0.49132490903737147
Energy: 0.451463621464555
Energy: 0.4538457942866547
Energy: 0.49339740256356796
Energy: 0.44905567188769063
Energy: 0.4881454948190695
Energy: 0.48656410138970146
Energy: 0.4881118052369188
Energy: 0.48635390528169287
Energy: 0.49081949452696233
Energy: 0.4834355190924746
Energy: 0.48559092628505274
Energy: 0.4976336730985784
Energy: 0.4619657672844995
Energy: 0.492449426896848
Energy: 0.4973775755620499
Energy: 0.4503735916624334
Energy: 0.46908778362345555
Energy: 0.48573977707215726
Energy: 0.47054044434058084
Energy: 0.4569137902776304
Energy: 0.4870936535918114
Energy: 0.47469211259854416
Energy: 0.4561416185352992
Energy: 0.4941291301178828
Energy: 0.47031758950317504
Energy: 0.4700652618742467
Energy: 0.47134727313442987
Energy: 0.4703915456366444
Energy: 0.4556609043186165
Energy: 0.4723156284123913
Energy: 0.46283040920612156
Energy: 0.4617269174326043
Energy: 0.4611146793792934
Energy: 0.44553830634666347
Energy: 0.46071120385243153

minimum gb energy = 0.44223171083958457 eV
minimum distance =  2.66090347277079 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 0.9140388113965597
Energy: 0.45588235157355017
Energy: 0.4349464169012655
Energy: 0.43439539184048953
Energy: 0.45620864175696274
Energy: 0.48809108837720205
Energy: 0.4500187704284991
Energy: 0.452108373550524
Energy: 0.4527631227658422
Energy: 0.4467308297279618
Energy: 0.4207319344491329
Energy: 0.42053180790802147
Energy: 0.44851942712248427
Energy: 0.4832165414622477
Energy: 0.4842251967499369
Energy: 0.454049682916345
Energy: 0.48210670847698067
Energy: 0.4546749494106195
Energy: 0.45233314716636813
Energy: 0.4875662952298884
Energy: 0.43353133154654033
Energy: 0.5019795681539759
Energy: 0.485426151998803
Energy: 0.4609745656075797
Energy: 0.448480515199736
Energy: 0.4535829694571309
Energy: 0.5431656989894355
Energy: 0.5415564603137947
Energy: 0.4525169583905035
Energy: 0.4541238597712923
Energy: 0.45719014974964745
Energy: 0.5059993435904533
Energy: 0.5037578546177003
Energy: 0.544363748575262
Energy: 0.4228879017877639
Energy: 0.5416175915552521
Energy: 0.48012176822442043
Energy: 0.4921921052689318
Energy: 0.49053818857431547
Energy: 0.4817481910496228
Energy: 0.4539104329648574
Energy: 0.4954215132878434
Energy: 0.6049277758090581
Energy: 0.590417623240042
Energy: 0.5277472440011436
Energy: 0.4767303881236832
Energy: 0.529940948485815
Energy: 0.48740039103777866
Energy: 0.4784731083613764
Energy: 0.48439055357568706
Energy: 0.47952137929750194
Energy: 0.48848223909734645
Energy: 0.4795751447351275
Energy: 0.4805454305886058
Energy: 0.5000892185472197
Energy: 0.4713643249297702
Energy: 0.47679897936540033
Energy: 0.4879921894137769
Energy: 0.44712075783754307
Energy: 0.4474809918459816
Energy: 0.4969748574358691
Energy: 0.47032602081797814
Energy: 0.4697728427072682
Energy: 0.4844759338148669
Energy: 0.44286645573688144
Energy: 0.4815422110314385
Energy: 0.514081087915268
Energy: 0.48091264643275444
Energy: 0.47823551144022025
Energy: 0.48729967758528286
Energy: 0.4826589612533405
Energy: 0.479450527883681
Energy: 0.5023792649285109
Energy: 0.4846567867494846
Energy: 0.48209105033803756
Energy: 0.49314561548379454
Energy: 0.47994417020153735
Energy: 0.48333806788759925
Energy: 0.4807098190488186
Energy: 0.4760817051788855
Energy: 0.4745941525648465
Energy: 0.503648218594383
Energy: 0.4739125964032391
Energy: 0.47415503552705274
Energy: 0.612606221445495
Energy: 0.5486474084889871
Energy: 0.5435387833368487
Energy: 0.550344072480012
Energy: 0.553686039278049
Energy: 0.5452825662790066
Energy: 0.5081264360107873
Energy: 0.5479971348769287
Energy: 0.5526043332528691
Energy: 0.5086601841047823
Energy: 0.5244534527458083
Energy: 0.48706386173528876
Energy: 0.5705112061867689
Energy: 0.47977237609439044
Energy: 0.4813505318754397
Energy: 0.537149006075135
Energy: 0.48048471904764484
Energy: 0.4837039969557486
Energy: 0.5318482726510535
Energy: 0.5475642122097918
Energy: 0.5426330895546245
Energy: 0.5387554464956062
Energy: 0.48339453839194224
Energy: 0.5368584979886907
Energy: 0.46354272311311384
Energy: 0.5466045875917716
Energy: 0.48251955599218194
Energy: 0.4711620161749777
Energy: 0.5456653248637093
Energy: 0.4715480947526193
Energy: 0.46333032874974994
Energy: 0.5524307462593802
Energy: 0.4820995376782498
Energy: 0.47153358245643834
Energy: 0.48330554875776083
Energy: 0.47368581552032063
Energy: 0.5319487484076582
Energy: 0.48516087567628036
Energy: 0.5369596528642177
Energy: 0.5410799572363557
Energy: 0.48346621520973126
Energy: 0.5373353000429261
Energy: 0.5059316651124919
Energy: 0.48394713820214735
Energy: 0.48420563974434844
Energy: 0.5056504614268635
Energy: 0.48290157375813497
Energy: 0.48394066509206357
Energy: 0.5035514669745699
Energy: 0.5292286463375848
Energy: 0.549624872888899
Energy: 0.505034791312073
Energy: 0.5383758590818379
Energy: 0.5533470926244375
Energy: 0.5111623677412058
Energy: 0.5443369916281867
Energy: 0.5433717849331273
Energy: 0.5522471060485976
Energy: 0.5451908932800856
Energy: 0.5439896368418426
Energy: 0.4775320916628597
Energy: 0.48267281346226204
Energy: 0.4874411326229276
Energy: 0.5028404691956248
Energy: 0.4806798346721277
Energy: 0.4890942488209253
Energy: 0.5665483873850414
Energy: 0.5217175679981091
Energy: 0.5212879788934371
Energy: 0.47987357886991666
Energy: 0.5226254288859604
Energy: 0.48426990267722864
Energy: 0.5212918448752624
Energy: 0.478454655244152
Energy: 0.4779398419006432
Energy: 0.4848704393762269
Energy: 0.48294416852955363
Energy: 0.4786281824277181
Energy: 0.4956995302794995
Energy: 0.44723576404613696
Energy: 0.4806306727927956
Energy: 0.4855419676734766
Energy: 0.46880818263713714
Energy: 0.4873425700841075
Energy: 0.4990377747012983
Energy: 0.44585703912475977
Energy: 0.44831075224084926
Energy: 0.48659295437883526
Energy: 0.47191120222107213
Energy: 0.4806388659615826
Energy: 0.4818588586782673
Energy: 0.4837948449035131
Energy: 0.48368824643803077
Energy: 0.4871863332419879
Energy: 0.4825678537403786
Energy: 0.48380987650105484
Energy: 0.5028593053612315
Energy: 0.5047485490382094
Energy: 0.4883024292093667
Energy: 0.4870968329599717
Energy: 0.5041747618942317
Energy: 0.48283680386545447
Energy: 0.48320627950750383
Energy: 0.48038047518349897
Energy: 0.42099743440688114
Energy: 0.4820214489541589
Energy: 0.44785218171313046
Energy: 0.47877613966524063
Energy: 0.45295840608387256
Energy: 0.49775060548581
Energy: 0.5382370276953558
Energy: 0.5051253916720427
Energy: 0.4992680553749868
Energy: 0.49509525659175385
Energy: 0.45156309440914316
Energy: 0.41933230258293386
Energy: 0.5420413296020729
Energy: 0.4548573617038494
Energy: 0.44554539452164393
Energy: 0.4615438437336263
Energy: 0.4563118390472901
Energy: 0.4188162311611627
Energy: 0.5432169475367137
Energy: 0.45741072398408933
Energy: 0.48036160000572575
Energy: 0.4621910467867607
Energy: 0.5679829670048476
Energy: 0.4799068507594648
Energy: 0.47980781785365617
Energy: 0.4936575794088286
Energy: 0.48073678504737716
Energy: 0.49248034113515415
Energy: 0.45084862101485695
Energy: 0.4523594479877978
Energy: 0.4639115224400774
Energy: 0.4467929059333634
Energy: 0.4109533556298352
Energy: 0.42301732897930683
Energy: 0.5712494241533999
Energy: 0.4504836226252574
Energy: 0.43578204564384965
Energy: 0.4249371477659804
Energy: 0.4162139751913135
Energy: 0.487217541928357

minimum gb energy = 0.4109533556298352 eV
minimum distance =  2.64572780145129 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.6491957998808928
Energy: 0.47418724736699713
Energy: 0.43990282195151537
Energy: 0.44191727614916754
Energy: 0.526779295423017
Energy: 0.43857634993915734
Energy: 0.433709751181777
Energy: 0.4417002489310443
Energy: 0.4462183501510898
Energy: 0.4663930349042393
Energy: 0.44189207477800807
Energy: 0.4351314088035534
Energy: 0.4839947075706923
Energy: 0.42774760537752826
Energy: 0.4274105170643224
Energy: 0.45149137031806647
Energy: 0.4277548206102911
Energy: 0.4352558141918516
Energy: 0.4325780221436843
Energy: 0.42541802449802596
Energy: 0.4364956430567488
Energy: 0.4325080524927593
Energy: 0.4317677515956255
Energy: 0.43580851799208614
Energy: 0.43097249962901046
Energy: 0.4376560677225893
Energy: 0.43484737935602086
Energy: 0.43302496204107377
Energy: 0.43338579157411294
Energy: 0.43461399263783107
Energy: 0.4322548436849473
Energy: 0.43494908548033284
Energy: 0.4334403661644189
Energy: 0.435380059793999
Energy: 0.4352473384467492
Energy: 0.4335772672748512
Energy: 0.433348455822817
Energy: 0.4368019895233655
Energy: 0.4328364514558762
Energy: 0.4367068892854276
Energy: 0.4317442867925052
Energy: 0.4347980674944309
Energy: 0.48617759474289673
Energy: 0.43024221847409
Energy: 0.4302825808028947
Energy: 0.4365276774163018
Energy: 0.43009412509434747
Energy: 0.4319958805401308
Energy: 0.43269383978273834
Energy: 0.4302030352044106
Energy: 0.43168918354012065
Energy: 0.43350315075130064
Energy: 0.4306558058990495
Energy: 0.43461533182340095
Energy: 0.43189933178338624
Energy: 0.4372193641963264
Energy: 0.43719991148023174
Energy: 0.4460088332236228
Energy: 0.45001633388061624
Energy: 0.4368038347688337
Energy: 0.43709829414800494
Energy: 0.44502776982103454
Energy: 0.452178544549094
Energy: 0.4324558814734749
Energy: 0.43366707835268153
Energy: 0.4466472933140417
Energy: 0.43976818163617143
Energy: 0.43229739550247814
Energy: 0.4354702330253833
Energy: 0.43380437563864005
Energy: 0.43176759933215264
Energy: 0.4350064588422164
Energy: 0.4399614119040331
Energy: 0.43400478271116166
Energy: 0.44145718752115126
Energy: 0.42986039859299585
Energy: 0.4333480307640956
Energy: 0.44132818956031367
Energy: 0.4369171657119637
Energy: 0.43399501842766364
Energy: 0.4367064096299276
Energy: 0.435507955258231
Energy: 0.432872828137778
Energy: 0.441437910537646
Energy: 0.4370433176640986
Energy: 0.4394756471664304
Energy: 0.4396012029752981
Energy: 0.4412718142581916
Energy: 0.4308215437158959
Energy: 0.438855164471854
Energy: 0.4372642014420458
Energy: 0.4376270391075929
Energy: 0.4413807654405564
Energy: 0.43723007913353334
Energy: 0.4342608112539599
Energy: 0.4420070965357927
Energy: 0.4374219627362705
Energy: 0.45272716410759417
Energy: 0.4527289855555603
Energy: 0.43758475629090143
Energy: 0.4392435584382464
Energy: 0.43710947802778277
Energy: 0.4367644320660103
Energy: 0.44738355189570533
Energy: 0.4522719201242921
Energy: 0.4447650318067463
Energy: 0.44486977732722605
Energy: 0.4438199778888093
Energy: 0.43460096543399523
Energy: 0.43683802651009446
Energy: 0.4438729596907558
Energy: 0.4359599610182836
Energy: 0.4367968140408505
Energy: 0.43801487194815675
Energy: 0.43412000372560183
Energy: 0.4370392371679933
Energy: 0.44366888081455286
Energy: 0.4374005681754203
Energy: 0.43709556203509425
Energy: 0.43555337992175713
Energy: 0.43640618474468623
Energy: 0.4485638668891069
Energy: 0.44766944374676076
Energy: 0.4507810355788506
Energy: 0.4411616808830399
Energy: 0.4445755681664356
Energy: 0.49340876125287625
Energy: 0.44232376864418
Energy: 0.43949758153264107
Energy: 0.4760962899833435
Energy: 0.42678117767241897
Energy: 0.4838886310990209
Energy: 0.4476527826647659
Energy: 0.4483370126271832
Energy: 0.4483642105812372
Energy: 0.44532387596718687
Energy: 0.44509631679483574
Energy: 0.4506292137696958
Energy: 0.47361534957948653
Energy: 0.4371069859986367
Energy: 0.4368550803700688
Energy: 0.4557622017769417
Energy: 0.43845517608723344
Energy: 0.4430428086495074
Energy: 0.4874972437875818
Energy: 0.436730263955005
Energy: 0.4372225679339447
Energy: 0.44158821566308226
Energy: 0.43671432990111475
Energy: 0.443282014958066
Energy: 0.4698253540498027
Energy: 0.44239570384416793
Energy: 0.4402844971091748
Energy: 0.4446452177560263
Energy: 0.43806976845018897
Energy: 0.4397222550533322
Energy: 0.4695016576576775
Energy: 0.4425924657898587
Energy: 0.44442438772796644
Energy: 0.4356770599439238
Energy: 0.4421625165854203
Energy: 0.4441377676206091
Energy: 0.47060153633833535
Energy: 0.43835775456261844
Energy: 0.4370072486954379
Energy: 0.43148362370571025
Energy: 0.4356003380894888
Energy: 0.4360563857454603
Energy: 0.4286429176047087
Energy: 0.4351517995357178
Energy: 0.43410631458084475
Energy: 0.42859903872389776
Energy: 0.436283940619879
Energy: 0.43301182077626915
Energy: 0.43311355513958955
Energy: 0.438248638683609
Energy: 0.43723422766522135
Energy: 0.42951215691992917
Energy: 0.43294902675804764
Energy: 0.4337868258024102
Energy: 0.4304033345565806
Energy: 0.4590706424343539
Energy: 0.44742840771646464
Energy: 0.4423833510842341
Energy: 0.46360304118303647
Energy: 0.4273973121236629

minimum gb energy = 0.42541802449802596 eV
minimum distance =  2.67805174007806 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.6668256511939339
Energy: 0.4857784076209022
Energy: 0.4459347527626298
Energy: 0.4206726801246545
Energy: 0.48388279167785286
Energy: 0.48456546248257987
Energy: 0.5195883998648868
Energy: 0.44074144740143645
Energy: 0.44330732429604025
Energy: 0.45025099963472764
Energy: 0.4386298746958643
Energy: 0.43845891873268433
Energy: 0.5441179517827971
Energy: 0.4585617862825046
Energy: 0.45897034491466604
Energy: 0.43741079356818474
Energy: 0.4587498187228528
Energy: 0.460599359624921
Energy: 0.5196816132045082
Energy: 0.45879975070952017
Energy: 0.4590961166393688
Energy: 0.5223822867835624
Energy: 0.4717353061339324
Energy: 0.4373118167506322
Energy: 0.5266094034296239
Energy: 0.5005070563997024
Energy: 0.5019762943741984
Energy: 0.4434311047157771
Energy: 0.43498535996900595
Energy: 0.4310431440267518
Energy: 0.4567355084089763
Energy: 0.49992887325927937
Energy: 0.5028776418904126
Energy: 0.5072039115393385
Energy: 0.5010331176854514
Energy: 0.49787293804730226
Energy: 0.5310675020191093
Energy: 0.5172911220370382
Energy: 0.5057403361639813
Energy: 0.5011347240844636
Energy: 0.5165491906476102
Energy: 0.5051981529256366
Energy: 0.49359920693079545
Energy: 0.5258545024366176
Energy: 0.5285863126419411
Energy: 0.46997980804786205
Energy: 0.5258921789717705
Energy: 0.5181768057614279
Energy: 0.531622166100583
Energy: 0.517032264025937
Energy: 0.5106499297758069
Energy: 0.5125846494540308
Energy: 0.5299006081447261
Energy: 0.5125430546233656
Energy: 0.5179252509160169
Energy: 0.47879169855524717
Energy: 0.4823865916407349
Energy: 0.5070485425960185
Energy: 0.4774846278022754
Energy: 0.4896592867452571
Energy: 0.4935034530200482
Energy: 0.4719705728797931
Energy: 0.5131280843758118
Energy: 0.5286108476680919
Energy: 0.4728624909670821
Energy: 0.5296219324643346
Energy: 0.4189201030694271
Energy: 0.521251402684151
Energy: 0.5128262080315659
Energy: 0.4190979674531889
Energy: 0.5203431467473548
Energy: 0.412145646465516
Energy: 0.4205867601326301
Energy: 0.519419455125752
Energy: 0.46047833751836975
Energy: 0.41632679246769405
Energy: 0.5175338100587362
Energy: 0.4122487998773107
Energy: 0.4943531625966289
Energy: 0.5126719693569921
Energy: 0.5112041047041245
Energy: 0.5347074156012427
Energy: 0.5120919137346628
Energy: 0.5095514402846154
Energy: 0.5162050158891119
Energy: 0.4688688975667669
Energy: 0.47589676963747174
Energy: 0.5272115370539169
Energy: 0.4590533735758137
Energy: 0.47570049586612967
Energy: 0.5240243192520839
Energy: 0.5103774619320336
Energy: 0.5112217283941684
Energy: 0.510259188311446
Energy: 0.5126907139768825
Energy: 0.5092785541544272
Energy: 0.5272893354320133
Energy: 0.5105175779247303
Energy: 0.5103277272928155
Energy: 0.5078720739853471
Energy: 0.5109792269459872
Energy: 0.5089845718504487
Energy: 0.5305081332582925
Energy: 0.50435482443155
Energy: 0.5050529212776096
Energy: 0.5108733335086467
Energy: 0.5044407299672798
Energy: 0.5126934839694712
Energy: 0.5338868706651574
Energy: 0.5172143821814833
Energy: 0.5066078467574155
Energy: 0.5073074883864169
Energy: 0.5154671491196955
Energy: 0.5048574875221677
Energy: 0.532765307908763
Energy: 0.5179060525518333
Energy: 0.5099269321714169
Energy: 0.44485526161584005
Energy: 0.5218505347471107
Energy: 0.5077132048257492
Energy: 0.5203863131259772
Energy: 0.42893037902270853
Energy: 0.5030426238295719
Energy: 0.4377303075936404
Energy: 0.43819154042698744
Energy: 0.44143218313535
Energy: 0.559794451641643
Energy: 0.4802516137003958
Energy: 0.48138985001655366
Energy: 0.43411882648502786
Energy: 0.47989980709977526
Energy: 0.4686062987641299
Energy: 0.5170458293629563
Energy: 0.4386003030920337
Energy: 0.44257128537397805
Energy: 0.42751026463810854
Energy: 0.4388329918451178
Energy: 0.4416770117866676
Energy: 0.4589124425592933
Energy: 0.4396588726594288
Energy: 0.46035485679777677
Energy: 0.4171521780374894
Energy: 0.4393881101739355
Energy: 0.46134080828690277

minimum gb energy = 0.412145646465516 eV
minimum distance =  2.64538402233703 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.727073518768982
Energy: 0.4628976032847631
Energy: 0.47457240018210034
Energy: 0.42360421223704514
Energy: 0.4627310975428693
Energy: 0.4318992405211219
Energy: 0.533363225247463
Energy: 0.4775791633492594
Energy: 0.4338854495866791
Energy: 0.48450768932246235
Energy: 0.47823903918453714
Energy: 0.44014021759150107
Energy: 0.416774470134626
Energy: 0.4134052715284506
Energy: 0.41291327544355577
Energy: 0.46666680659747783
Energy: 0.41311986863372163
Energy: 0.4233484715240526
Energy: 0.46753331365177436
Energy: 0.42221797121440624
Energy: 0.4221263060608203
Energy: 0.4678179308441693
Energy: 0.3892903874601793
Energy: 0.4382730435596798
Energy: 0.4209109005570414
Energy: 0.409717322794152
Energy: 0.40684179794082564
Energy: 0.42149406178452975
Energy: 0.41346709965974277
Energy: 0.40774801878366457
Energy: 0.4238145970291481
Energy: 0.414470353920372
Energy: 0.4061998875346902
Energy: 0.3925970059733488
Energy: 0.4200426335763527
Energy: 0.39118002352924397
Energy: 0.41953725687475646
Energy: 0.4152429087933083
Energy: 0.41578820878171135
Energy: 0.4149089645359771
Energy: 0.4178894522106733
Energy: 0.4026303638300274
Energy: 0.4116733870107523
Energy: 0.3910398851674747
Energy: 0.3911709419393285
Energy: 0.3910621603575144
Energy: 0.3908150603487099
Energy: 0.39089307558134323
Energy: 0.4166180472077364
Energy: 0.38922333449092633
Energy: 0.38924123188345694
Energy: 0.41759894969988903
Energy: 0.3901513709061029
Energy: 0.40370999637521326
Energy: 0.41991327961870606
Energy: 0.40597358448642823
Energy: 0.40623165194167743
Energy: 0.4200406642845528
Energy: 0.40530937441774156
Energy: 0.4059067668259765
Energy: 0.41140726403004513
Energy: 0.40703851120943274
Energy: 0.40766608982121194
Energy: 0.4134417936910991
Energy: 0.42179074532007893
Energy: 0.4070664586353177
Energy: 0.42186971655464295
Energy: 0.46912804255322904
Energy: 0.46765060469866176
Energy: 0.40440571173783646
Energy: 0.46939058204333667
Energy: 0.44281938257983827
Energy: 0.41426304881894466
Energy: 0.4667564079306054
Energy: 0.46281067423865857
Energy: 0.403650375132285
Energy: 0.46644604509767723
Energy: 0.46293172375477626
Energy: 0.4201544607591541
Energy: 0.48090676975454416
Energy: 0.4324963455100517
Energy: 0.42196653739703405
Energy: 0.48519589678407327
Energy: 0.4381441297674821
Energy: 0.4498024308108711
Energy: 0.4662578239418523
Energy: 0.46656815046585925
Energy: 0.46427655688113534
Energy: 0.4663513034130417
Energy: 0.4550141564283719
Energy: 0.4183854674677765
Energy: 0.4808257988171975
Energy: 0.43308168152246157
Energy: 0.4782407986380494
Energy: 0.48698813551822057
Energy: 0.4321013595465555
Energy: 0.4015312191923712
Energy: 0.46683290128546145
Energy: 0.49617163944165193
Energy: 0.41622744526259725
Energy: 0.46645143535274936
Energy: 0.46951328420736965

minimum gb energy = 0.38922333449092633 eV
minimum distance =  2.65143973641511 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.7719844825757117
Energy: 0.5380158996186388
Energy: 0.4301300849626678
Energy: 0.40653858008042626
Energy: 0.6362044027329589
Energy: 0.43098806324678357
Energy: 0.5136705601315265
Energy: 0.3945360137202243
Energy: 0.38913089582050825
Energy: 0.48212562517101937
Energy: 0.4888992148505131
Energy: 0.4289145071598747
Energy: 0.5647779353045759
Energy: 0.37129783330252847
Energy: 0.3988121642862433
Energy: 0.48137278100381065
Energy: 0.37103456987114697
Energy: 0.4024413309892021
Energy: 0.47791751079898576
Energy: 0.4219847188349468
Energy: 0.42137948730728186
Energy: 0.47832243029418164
Energy: 0.37173411127799116
Energy: 0.4341454973692338
Energy: 0.41488860015563817
Energy: 0.39261011218528924
Energy: 0.394013260973105
Energy: 0.415218718545371
Energy: 0.4038388524820426
Energy: 0.3900854342078258
Energy: 0.41994641957117573
Energy: 0.3899339254899694
Energy: 0.36885392169399656
Energy: 0.37319930888117725
Energy: 0.409311822774868
Energy: 0.3696052787960843
Energy: 0.3817733025264126
Energy: 0.4142302988695186
Energy: 0.4093198154387729
Energy: 0.3659262677604495
Energy: 0.4112310010943199
Energy: 0.3643875919408069
Energy: 0.3991491097065892
Energy: 0.3630968344120954
Energy: 0.36653452413919296
Energy: 0.3662774060171
Energy: 0.3592200572106265
Energy: 0.3670598324039941
Energy: 0.3822448271764574
Energy: 0.3771922989331182
Energy: 0.3782783538424656
Energy: 0.3831341042266692
Energy: 0.3732953339345886
Energy: 0.38143180734759563
Energy: 0.3814210150398007
Energy: 0.36003143296184187
Energy: 0.36051356893374265
Energy: 0.3815277740149855
Energy: 0.36050859564498483
Energy: 0.3601407251954456
Energy: 0.3922506231280572
Energy: 0.3596870302559622
Energy: 0.3594780977446178
Energy: 0.36036676791685684
Energy: 0.38168233163237764
Energy: 0.36003192901726994
Energy: 0.383401879393206
Energy: 0.3877831762387815
Energy: 0.381585287417353
Energy: 0.383394739280067
Energy: 0.38502732865205536
Energy: 0.378304108007805
Energy: 0.3933446882871945
Energy: 0.36716535464883754
Energy: 0.36749795636018456
Energy: 0.3644635829908025
Energy: 0.392414036394387
Energy: 0.3698582522370618
Energy: 0.4086287354756343
Energy: 0.3645414146275368
Energy: 0.36427180917562896
Energy: 0.409610737996419
Energy: 0.364336908010133
Energy: 0.40913850890636483
Energy: 0.40903260386861723
Energy: 0.3692904993254765
Energy: 0.36804407200278644
Energy: 0.4090862990893676
Energy: 0.36906133516996803
Energy: 0.3850082514231166
Energy: 0.47595719824945343
Energy: 0.41091041661805516
Energy: 0.38950587484780563
Energy: 0.4039166385774652
Energy: 0.4153989817215631
Energy: 0.3929350821950117
Energy: 0.38214426768671333
Energy: 0.48358393424358953
Energy: 0.4589704448425703
Energy: 0.3780904708970656
Energy: 0.48118476523663284
Energy: 0.39550106499889454
Energy: 0.3819675345021885
Energy: 0.47251482541465595
Energy: 0.46853827264441406
Energy: 0.3787947152014439
Energy: 0.4803894212037015
Energy: 0.40227783198983186
Energy: 0.47651661731625305
Energy: 0.46409028922658685
Energy: 0.4293244390024229
Energy: 0.4136712160201629
Energy: 0.3979702946970168
Energy: 0.3891474874284049
Energy: 0.5640069100806445
Energy: 0.4053148489404659
Energy: 0.4053543558987242
Energy: 0.4629867387175063
Energy: 0.4054766355061059
Energy: 0.453158172167454
Energy: 0.4632359424946231
Energy: 0.45568099919185406
Energy: 0.4281912171459964
Energy: 0.4777542522679274
Energy: 0.4415854204440723
Energy: 0.38909711043298995
Energy: 0.38786650937476586
Energy: 0.4517227494626849
Energy: 0.4869557614501204
Energy: 0.3733113562037394
Energy: 0.46387633373223136
Energy: 0.4238714604814515
Energy: 0.390124613870844
Energy: 0.47191488633858486
Energy: 0.39091257350045666
Energy: 0.38587523745882396
Energy: 0.47024065554638417
Energy: 0.4511894361816188
Energy: 0.5633042280064792
Energy: 0.41226740667622364
Energy: 0.3905031839643609
Energy: 0.477557266014906
Energy: 0.3841307782470703
Energy: 0.4679369833221146
Energy: 0.4848386752816357
Energy: 0.37327955865672796
Energy: 0.3988396614778211
Energy: 0.47818911375980955
Energy: 0.3732932019822371
Energy: 0.4028382460910336
Energy: 0.4174501177602894
Energy: 0.4057423374182559
Energy: 0.3921950659275399
Energy: 0.41611884973755575
Energy: 0.40421414581456555
Energy: 0.4044923602593972
Energy: 0.3754264160498203
Energy: 0.3943611663969376
Energy: 0.39504831858194744
Energy: 0.3710014442135465
Energy: 0.39331807282975556
Energy: 0.3793979261627245
Energy: 0.3796726223013771
Energy: 0.41332236744900047
Energy: 0.40821263026257326
Energy: 0.38018943548337464
Energy: 0.4106238806831748
Energy: 0.4082516170254967
Energy: 0.3953513034650006
Energy: 0.36558821824365534
Energy: 0.3657321932716355
Energy: 0.36486026119395715
Energy: 0.4096297013691217
Energy: 0.36588604299622407
Energy: 0.38820082322569727
Energy: 0.36014900927568805
Energy: 0.3647935700939511
Energy: 0.38747173279243824
Energy: 0.3585586759393021
Energy: 0.36715517046925145
Energy: 0.38495402277461027
Energy: 0.35919710401512367
Energy: 0.3585733180767621
Energy: 0.38587524189017214
Energy: 0.3587761763578676
Energy: 0.3582503697942977
Energy: 0.38913805518249434
Energy: 0.3592018288764995
Energy: 0.3595822096153506
Energy: 0.3589211047099073
Energy: 0.3583467197884195
Energy: 0.3595623735885973
Energy: 0.38694164752049265
Energy: 0.38582269843243533
Energy: 0.38109520484581744
Energy: 0.3876401788297249
Energy: 0.38256070344914117
Energy: 0.38147539510750933
Energy: 0.37884392518788124
Energy: 0.3676513645328029
Energy: 0.3636582637308392
Energy: 0.36547275317241024
Energy: 0.3676079125362709
Energy: 0.36440952189056686
Energy: 0.41369624930056836
Energy: 0.3639031581151589
Energy: 0.3637557770446799
Energy: 0.4146106784103946
Energy: 0.36402403747959416
Energy: 0.36438833352372313
Energy: 0.4140289970632447
Energy: 0.36498444806296737
Energy: 0.3892276507871447
Energy: 0.4147204760981826
Energy: 0.36490143960798244
Energy: 0.4061145382030101
Energy: 0.5319682864093174
Energy: 0.3854163103165569
Energy: 0.3916528980949602
Energy: 0.40524916017642265
Energy: 0.410194117290642
Energy: 0.3903198861523619
Energy: 0.38584081839211276
Energy: 0.40477183162263775
Energy: 0.40397438024465454
Energy: 0.39852283104527775
Energy: 0.47733647859838485
Energy: 0.40461955953837186
Energy: 0.3818153881090968
Energy: 0.4458829080248527
Energy: 0.4036876761868638
Energy: 0.3853968516804288
Energy: 0.4496758442489276
Energy: 0.3996246589096374
Energy: 0.4092116569778906
Energy: 0.45396497783221723
Energy: 0.4705089535257429
Energy: 0.4160049184410661
Energy: 0.47882063782107925
Energy: 0.42753334570728635
Energy: 0.535219994711407
Energy: 0.3904904521074669
Energy: 0.4500113198239783
Energy: 0.47932498103859555
Energy: 0.39157780647785834
Energy: 0.45445308451070626
Energy: 0.5621446188471455
Energy: 0.4359095160444094
Energy: 0.39051592497595206
Energy: 0.47794092872059446
Energy: 0.4088645724021382
Energy: 0.4684175642501451
Energy: 0.3903510081678374
Energy: 0.47097814265742166
Energy: 0.4683083714318305
Energy: 0.38681940730973563
Energy: 0.4696299433074518
Energy: 0.43703606979576914

minimum gb energy = 0.3582503697942977 eV
minimum distance =  2.6781615441192 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.35801467330395925
Energy: 0.5561137316184224
Energy: 0.41008306961827456
Energy: 0.3597104389867117
Energy: 0.567049405600211
Energy: 0.41091252841426945
Energy: 0.4353586991764074
Energy: 0.373450459650165
Energy: 0.3695512302878647
Energy: 0.46772660051026915
Energy: 0.3715734903469243
Energy: 0.37076290656680966
Energy: 0.5347764210141702
Energy: 0.3550011518000145
Energy: 0.35585792040743336
Energy: 0.46802828401782104
Energy: 0.3528607370891471
Energy: 0.3866116964519744
Energy: 0.4588706991513
Energy: 0.35643658643561005
Energy: 0.4087384829483015
Energy: 0.39283388290194704
Energy: 0.3530827943845708
Energy: 0.4117857543834786
Energy: 0.3959658752474657
Energy: 0.3732508994423519
Energy: 0.3751257840774852
Energy: 0.39641010318292225
Energy: 0.39041302686753165
Energy: 0.37133098748277765
Energy: 0.35057359885790723
Energy: 0.3699561957458601
Energy: 0.3519578620645023
Energy: 0.34199344672214865
Energy: 0.41093357893372945
Energy: 0.35307808498944404
Energy: 0.3791038619989336
Energy: 0.4052036380504794
Energy: 0.4081751319166298
Energy: 0.34574542044297507
Energy: 0.4029756980482999
Energy: 0.3448869941929588
Energy: 0.4848195804076564
Energy: 0.3428300788345681
Energy: 0.34257318035992707
Energy: 0.39456320273032436
Energy: 0.3353455633949386
Energy: 0.35167763546422665
Energy: 0.3702103324563088
Energy: 0.36282683013850825
Energy: 0.3608537129005206
Energy: 0.3707746256275533
Energy: 0.35505945856481674
Energy: 0.37717998521062124
Energy: 0.377022144025619
Energy: 0.3346217124097946
Energy: 0.33452411301074186
Energy: 0.3773568371895009
Energy: 0.3352802500856992
Energy: 0.33391923151684993
Energy: 0.3571706972106793
Energy: 0.3638521100234899
Energy: 0.3407052623782761
Energy: 0.33552952128067964
Energy: 0.36242309796178607
Energy: 0.3395313106318841
Energy: 0.37032930071656067
Energy: 0.35928159735505766
Energy: 0.3615196334179157
Energy: 0.34873527547129857
Energy: 0.3565785582313096
Energy: 0.33227201130045325
Energy: 0.3629504908529691
Energy: 0.3678459815653173
Energy: 0.33424540761149785
Energy: 0.3334600037632551
Energy: 0.37137781570287187
Energy: 0.33424839196536615
Energy: 0.35438088913855864
Energy: 0.33230372041102585
Energy: 0.3449559408473752
Energy: 0.35538597753464984
Energy: 0.3528698051259185
Energy: 0.362807706132877
Energy: 0.366064285257785
Energy: 0.334811515056667
Energy: 0.33380672616352464
Energy: 0.35440404788493785
Energy: 0.3375614670228362
Energy: 0.3336040280181181
Energy: 0.3785818270986404
Energy: 0.376669066350253
Energy: 0.33498421847799853
Energy: 0.3355286065346471
Energy: 0.3750470254887161
Energy: 0.3347453477620095
Energy: 0.3548484114508112
Energy: 0.3750596383397953
Energy: 0.3771489337740071
Energy: 0.3382362817016211
Energy: 0.3727372834420178
Energy: 0.3501529613979373
Energy: 0.3554791604338721
Energy: 0.3505166748823476
Energy: 0.3497297016976787
Energy: 0.3561584893403902
Energy: 0.3509852691071096
Energy: 0.3501809627796914
Energy: 0.40092963359691086
Energy: 0.34534767926631027
Energy: 0.37353525395280673
Energy: 0.40150156404231185
Energy: 0.3512556301762224
Energy: 0.409149386496097
Energy: 0.4560362136989593
Energy: 0.35289180953252375
Energy: 0.35324373503169915
Energy: 0.39053321946234826
Energy: 0.35039663352290273
Energy: 0.36957657745263517
Energy: 0.5062434980586801
Energy: 0.39222758964582777
Energy: 0.3919392954093529
Energy: 0.3903167351530272
Energy: 0.3917298985141405
Energy: 0.3735677128840427
Energy: 0.3537040955888662
Energy: 0.440169760780757
Energy: 0.39003097838617856
Energy: 0.3447711530274655
Energy: 0.4693805218853299
Energy: 0.37098796773611165
Energy: 0.37122165751879593
Energy: 0.4295365034641057
Energy: 0.41999424386829004
Energy: 0.361645666620707
Energy: 0.46699134050570723
Energy: 0.4199635588462283
Energy: 0.5039691490184498
Energy: 0.3932023639509242
Energy: 0.3727887387126609
Energy: 0.3913884528507291
Energy: 0.3897580073784719
Energy: 0.3712328985797788
Energy: 0.5375821545864133
Energy: 0.3672928349895889
Energy: 0.37099883462464095
Energy: 0.44323711304247704
Energy: 0.36838046279682046
Energy: 0.4272629629580485
Energy: 0.5015712940555468
Energy: 0.41737254750184255
Energy: 0.37021935858395155
Energy: 0.4645787894029061
Energy: 0.41601952575437995
Energy: 0.39150177939077363
Energy: 0.3571379340636465
Energy: 0.4225015076966997
Energy: 0.4087059292697944
Energy: 0.35434799777948595
Energy: 0.4211451882429013
Energy: 0.3828997654134969

minimum gb energy = 0.33227201130045325 eV
minimum distance =  2.69925502447136 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.3082658032755991
Energy: 0.3938786984983863
Energy: 0.36245259972292776
Energy: 0.30439370239733987
Energy: 0.4072944837040945
Energy: 0.3413225174564683
Energy: 0.4290604739134312
Energy: 0.3115163882419072
Energy: 0.3075410788244863
Energy: 0.3108653966806894
Energy: 0.31653624130718777
Energy: 0.30828079692379745
Energy: 0.45944230772457123
Energy: 0.29476867534423307
Energy: 0.30612501256714036
Energy: 0.33947018238703974
Energy: 0.2951932706489695
Energy: 0.3055161537497951
Energy: 0.4027626432339244
Energy: 0.305270798748637
Energy: 0.3075425327054333
Energy: 0.34119070324000905
Energy: 0.34022220055556174
Energy: 0.35226494849213724
Energy: 0.3560624639472681
Energy: 0.3110124145930983
Energy: 0.31124645891236785
Energy: 0.34580645710841634
Energy: 0.31161362121741776
Energy: 0.3072406152726538
Energy: 0.297791892581353
Energy: 0.31100099288397637
Energy: 0.29858336315101136
Energy: 0.29778523893169584
Energy: 0.35694151108383454
Energy: 0.3070549250240698
Energy: 0.42366534666438377
Energy: 0.35707387778293165
Energy: 0.3393896591582835
Energy: 0.29178175603095324
Energy: 0.3598581944849778
Energy: 0.29014339608627815
Energy: 0.41998415766725966
Energy: 0.2813005093658576
Energy: 0.286305590834243
Energy: 0.29116833993182395
Energy: 0.2821692213286755
Energy: 0.28610860879992395
Energy: 0.3294049628945948
Energy: 0.285562351273571
Energy: 0.31217376284175824
Energy: 0.3303310415688991
Energy: 0.2943018725772149
Energy: 0.3281603340256715
Energy: 0.32925275187472247
Energy: 0.28115142247018926
Energy: 0.2811229992609871
Energy: 0.32900530196778527
Energy: 0.28079020212328787
Energy: 0.2806958123341078
Energy: 0.29489989007003986
Energy: 0.31123781386472577
Energy: 0.2795554323305458
Energy: 0.290056448045858
Energy: 0.31129928288784126
Energy: 0.2771306919962626
Energy: 0.33075603280705274
Energy: 0.31133278376310336
Energy: 0.31142320692830733
Energy: 0.2770538243631634
Energy: 0.3153193195561616
Energy: 0.2767517131095075
Energy: 0.3299940937274514
Energy: 0.2998258504249071
Energy: 0.3038937825228253
Energy: 0.30405016410811314
Energy: 0.29970515393848424
Energy: 0.3048873571780898
Energy: 0.3008688482078466
Energy: 0.2748919136231355
Energy: 0.3009814299288115
Energy: 0.3017578960835798
Energy: 0.2978710313480436
Energy: 0.3011753756498159
Energy: 0.30119348253654815
Energy: 0.27352367988486903
Energy: 0.27310476514533744
Energy: 0.3008959535400105
Energy: 0.2735027880277989
Energy: 0.2728982581449446
Energy: 0.2978372516762108
Energy: 0.2966628176593013
Energy: 0.27221432050925704
Energy: 0.28586728760689134
Energy: 0.29634465286988054
Energy: 0.27333745973111817
Energy: 0.30243551000408925
Energy: 0.29642376834914935
Energy: 0.2967671144846425
Energy: 0.2860300857614206
Energy: 0.2961939515806173
Energy: 0.27424732176431066
Energy: 0.29749297625646903
Energy: 0.2731548786386279
Energy: 0.2733364980853108
Energy: 0.29675804828668145
Energy: 0.29788724599021404
Energy: 0.27372374003761646
Energy: 0.29619874158122467
Energy: 0.28923407150231273
Energy: 0.2966466264789971
Energy: 0.29698284269388736
Energy: 0.32422242386119887
Energy: 0.2963535077968128
Energy: 0.2968608382737939
Energy: 0.30226101725097637
Energy: 0.2756815007289461
Energy: 0.3023165814354029
Energy: 0.298118926103438
Energy: 0.27627849906758345
Energy: 0.31272922638874273
Energy: 0.3010997052828403
Energy: 0.3015057451403279
Energy: 0.2716233038033419
Energy: 0.30091429990914803
Energy: 0.2765249787219622
Energy: 0.29869405019935963
Energy: 0.3012936262656078
Energy: 0.275328733163577
Energy: 0.2759232017079202
Energy: 0.30095340454272107
Energy: 0.2734984140911123
Energy: 0.31186811064387976
Energy: 0.27574150405008796
Energy: 0.27545884567739354
Energy: 0.3112148228314093
Energy: 0.27591746647847076
Energy: 0.27491608110196264
Energy: 0.31090006790594765
Energy: 0.2785599653823028
Energy: 0.3110149025535316
Energy: 0.311798229515013
Energy: 0.29227131430976516
Energy: 0.31115717101859386
Energy: 0.40906749336606596
Energy: 0.29046505424459285
Energy: 0.2958189395814823
Energy: 0.31378973407944566
Energy: 0.2905605136768174
Energy: 0.3136870083517098
Energy: 0.37820430443342695
Energy: 0.3284456642302558
Energy: 0.3288295290197311
Energy: 0.28021388944385106
Energy: 0.33267692403076277
Energy: 0.2797894047111351
Energy: 0.2964209452302226
Energy: 0.3284152413547186
Energy: 0.28932928019948534
Energy: 0.278503374230689
Energy: 0.3286922322428591
Energy: 0.2834975758684796
Energy: 0.3374766735307606
Energy: 0.2921188318333996
Energy: 0.2913476843455164
Energy: 0.33764824521496
Energy: 0.29220065125474937
Energy: 0.2904337430255043
Energy: 0.3580640174593954
Energy: 0.2952495343721139
Energy: 0.34150908207221
Energy: 0.3589434502534563
Energy: 0.283232397468738
Energy: 0.3341050493188752
Energy: 0.43588406678134684
Energy: 0.2880108366796265
Energy: 0.2963954069944802
Energy: 0.310259768831141
Energy: 0.28867144789245885
Energy: 0.29654021174672546
Energy: 0.4356525538568039
Energy: 0.34001218390097676
Energy: 0.31340944949017563
Energy: 0.31587936670743755
Energy: 0.3399031580945454
Energy: 0.3110035301315151
Energy: 0.3023969172310167
Energy: 0.3540086903325444
Energy: 0.32625523807326307
Energy: 0.29347537708551513
Energy: 0.3795559146122194
Energy: 0.30934465427673014
Energy: 0.36769340524636146
Energy: 0.34095106471179193
Energy: 0.33752264869244725
Energy: 0.3432976188716526
Energy: 0.34000623485783243
Energy: 0.3154754273071749
Energy: 0.4362098000869934
Energy: 0.31955866150527984
Energy: 0.32441606352243874
Energy: 0.3410911474257534
Energy: 0.33952073115394366
Energy: 0.3692040758645372
Energy: 0.4601815048588815
Energy: 0.30635678508485414
Energy: 0.3207013539948096
Energy: 0.36538127435678
Energy: 0.3058663556856901
Energy: 0.3469509121025405
Energy: 0.44284516743939956
Energy: 0.3404601999152563
Energy: 0.34161319155264536
Energy: 0.3132949378818904
Energy: 0.3396476915547312
Energy: 0.308884490987555

minimum gb energy = 0.2716233038033419 eV
minimum distance =  2.72039179662315 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.014472226054811696
Energy: 0.015571954701352034
Energy: 0.015120496964436667
Energy: 0.016109142767331688
Energy: 0.017727456175422773
Energy: 0.01507960391810884
Energy: 0.03477170152734901
Energy: 0.015042490383078522
Energy: 0.015323452568246599
Energy: 0.0347832172167106
Energy: 0.01729019731653759
Energy: 0.015336224669454149
Energy: 0.0337137657554711
Energy: 0.014901599554249401
Energy: 0.01496886107796286
Energy: 0.033689169140142555
Energy: 0.0148916493140692
Energy: 0.03419852038057656
Energy: 0.017192116200148422
Energy: 0.015261410521714867
Energy: 0.015030948836957745
Energy: 0.018159030238337405
Energy: 0.014962446760294434
Energy: 0.034325728359490104
Energy: 0.033970176516852024
Energy: 0.03366791606099161
Energy: 0.03379506413147139
Energy: 0.03445244035200489
Energy: 0.033657018739390414
Energy: 0.03466092418406506
Energy: 0.015201341201755956
Energy: 0.015324705633584082
Energy: 0.015299196941500256
Energy: 0.016318185246309697
Energy: 0.015354165963574883
Energy: 0.014971572142009833
Energy: 0.03460830754907885
Energy: 0.015318390303430589
Energy: 0.015268862700990427
Energy: 0.03358491276201124
Energy: 0.015161029151348473
Energy: 0.015360502271757809
Energy: 0.0335416463269074
Energy: 0.014940414753182274
Energy: 0.01519124750496196
Energy: 0.03363974250340599
Energy: 0.01482044032421329
Energy: 0.03485949861662741
Energy: 0.015605154680123426
Energy: 0.015189540200909573
Energy: 0.03541305631508387
Energy: 0.016511313053778832
Energy: 0.015003670648506605
Energy: 0.03500995378081957
Energy: 0.015259350847641179
Energy: 0.03361242671259777
Energy: 0.03379709161961185
Energy: 0.015343325347016618
Energy: 0.033607593109815564
Energy: 0.034039499820594545

minimum gb energy = 0.014472226054811696 eV
minimum distance =  2.85796340032676 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.34742127796670497
Energy: 0.3424149816338366
Energy: 0.34637180858143435
Energy: 0.28711765450135307
Energy: 0.34245201158030636
Energy: 0.320956304489426
Energy: 0.3532080476450254
Energy: 0.34248843516150074
Energy: 0.35798672162416806
Energy: 0.34579609887367413
Energy: 0.34495006229766756
Energy: 0.3645387416391667
Energy: 0.3526355990066265
Energy: 0.3292864276155354
Energy: 0.3295030530264523
Energy: 0.34053144603415836
Energy: 0.2980357604647116
Energy: 0.3619938196095328
Energy: 0.33652756063633693
Energy: 0.32965553050505825
Energy: 0.32974167232729723
Energy: 0.3367238496230204
Energy: 0.2966276641681296
Energy: 0.3442748938301891
Energy: 0.30439571572191887
Energy: 0.34726086632960584
Energy: 0.3438849102602018
Energy: 0.30434893363918514
Energy: 0.34467143572286174
Energy: 0.36459490943821826
Energy: 0.33330686942479737
Energy: 0.34787034547900353
Energy: 0.3363235574367131
Energy: 0.28358663738278833
Energy: 0.3486127442892923
Energy: 0.3190775533461538
Energy: 0.33553593901746087
Energy: 0.31425629862484655
Energy: 0.3403537009514708
Energy: 0.33548562048352365
Energy: 0.3153086224828435
Energy: 0.34294154710358
Energy: 0.3328996651494608
Energy: 0.28831687377757664
Energy: 0.32623213518233896
Energy: 0.33279985134234735
Energy: 0.2726911006067834
Energy: 0.31422504284793507
Energy: 0.35325779053558304
Energy: 0.32730200015475736
Energy: 0.3377045918780334
Energy: 0.3416786802501934
Energy: 0.28556389709880825
Energy: 0.3391722240177061
Energy: 0.29191816729300296
Energy: 0.3106954920933119
Energy: 0.31029003751079715
Energy: 0.3186478338147201
Energy: 0.3144052948431566
Energy: 0.3200080556566952
Energy: 0.2727060883015892
Energy: 0.33048256996922576
Energy: 0.3315452904516557
Energy: 0.2757152209491119
Energy: 0.2754118817281202
Energy: 0.31559973190415175
Energy: 0.2951536422957056
Energy: 0.33597189076863243
Energy: 0.3368580477463076
Energy: 0.2938791529266365
Energy: 0.28619031303742254
Energy: 0.2895744367311369
Energy: 0.2908919030974358
Energy: 0.26671803203502525
Energy: 0.3197376188410235
Energy: 0.2909640458125174
Energy: 0.2691390902705125
Energy: 0.29237707232991755
Energy: 0.3308495141409208
Energy: 0.30084020036964854
Energy: 0.32247214247525136
Energy: 0.29234892843728216
Energy: 0.2762695365225679
Energy: 0.3220474787626086
Energy: 0.33171865040095355
Energy: 0.2756853162381111
Energy: 0.2753321891928718
Energy: 0.33130839335933787
Energy: 0.27966721650809534
Energy: 0.2753295698179584
Energy: 0.27036597613958757
Energy: 0.31435911541665446
Energy: 0.3136946964467867
Energy: 0.2713220239544853
Energy: 0.3284086378392697
Energy: 0.31381538868967085
Energy: 0.27316683375315565
Energy: 0.31418056064012667
Energy: 0.3118051756389729
Energy: 0.27164528095929813
Energy: 0.2781662649868619
Energy: 0.2674642079461943
Energy: 0.26814735070764284
Energy: 0.31135947836391115
Energy: 0.3107159893936104
Energy: 0.2682370676800776
Energy: 0.2715876243071336
Energy: 0.30946967618958954
Energy: 0.3366445780813528
Energy: 0.2921615148487822
Energy: 0.308923751142789
Energy: 0.27133135935251723
Energy: 0.26811518069266377
Energy: 0.3092569926906095
Energy: 0.32984084390605906
Energy: 0.2684691754034035
Energy: 0.2675726952538152
Energy: 0.32979416809751233
Energy: 0.2723584101596783
Energy: 0.26769117654328156
Energy: 0.3290747551180971
Energy: 0.31386816727391853
Energy: 0.3139233274294896
Energy: 0.3283624658478694
Energy: 0.3132960282074947
Energy: 0.3128330489103687
Energy: 0.27880424185342756
Energy: 0.31111887802246024
Energy: 0.2963009665962211
Energy: 0.2786970923433758
Energy: 0.31159735901015073
Energy: 0.2753825410822283
Energy: 0.2755108473185919
Energy: 0.3219376175915339
Energy: 0.3227597327950485
Energy: 0.2755150417304755
Energy: 0.29386374045793573
Energy: 0.31960873108467336
Energy: 0.27420439534226637
Energy: 0.29075597835162525
Energy: 0.290763088146766
Energy: 0.26955460288833016
Energy: 0.29020037265220483
Energy: 0.3129117782647997
Energy: 0.30656954170909856
Energy: 0.290126229594396
Energy: 0.28976327520523243
Energy: 0.27746961007227644
Energy: 0.2949836490385414
Energy: 0.2899599511087536
Energy: 0.27583152237047814
Energy: 0.2808548265890411
Energy: 0.3227309129197552
Energy: 0.2758755253704619
Energy: 0.2928524596613319
Energy: 0.33163817853495153
Energy: 0.31319642827941174
Energy: 0.3224463864376755
Energy: 0.32545215675393885
Energy: 0.3132671520062241
Energy: 0.28293607555715317
Energy: 0.3203592916851253
Energy: 0.2966877623717018
Energy: 0.30370808674496524
Energy: 0.30530326364529786
Energy: 0.29663631162445664
Energy: 0.30459337842754935
Energy: 0.3069330829423499
Energy: 0.33694583216725155
Energy: 0.3334128253230828
Energy: 0.32898963793767017
Energy: 0.27879523990568955
Energy: 0.3336226603325654
Energy: 0.3179359033746594
Energy: 0.3160614286920882
Energy: 0.34466200580673023
Energy: 0.34307580959932094
Energy: 0.3160872042285443
Energy: 0.3380154786840638
Energy: 0.33788026665499754
Energy: 0.3376728886989179
Energy: 0.2930174662038657
Energy: 0.32896777269313565
Energy: 0.33735833610230276
Energy: 0.27478214774604215
Energy: 0.3292238780766712
Energy: 0.3532684284825451
Energy: 0.33089916442141953
Energy: 0.3516771403959804
Energy: 0.36194492591521527
Energy: 0.2916557595279325
Energy: 0.3639666279697056
Energy: 0.3110585580856788
Energy: 0.3330151156922293
Energy: 0.33655008711843637
Energy: 0.31099900806750663
Energy: 0.33723577525555737
Energy: 0.3268612900464483

minimum gb energy = 0.26671803203502525 eV
minimum distance =  2.66213842273878 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.4225210104876859
Energy: 0.4256377609929975
Energy: 0.4195787616896896
Energy: 0.3557395097060611
Energy: 0.4247154699550567
Energy: 0.4188713035027565
Energy: 0.4370425312562402
Energy: 0.4273772235167992
Energy: 0.4254495069648225
Energy: 0.4195854930499912
Energy: 0.42617226904729716
Energy: 0.42011958189066806
Energy: 0.4297937562868586
Energy: 0.36887362728895834
Energy: 0.41382590145429315
Energy: 0.4185766885653741
Energy: 0.3671911778581072
Energy: 0.41275202210316925
Energy: 0.4022925681887834
Energy: 0.4008582351868625
Energy: 0.40775331889674876
Energy: 0.4028103152526265
Energy: 0.4028981775200046
Energy: 0.41703327544828145
Energy: 0.3945085609586627
Energy: 0.4342020026301286
Energy: 0.43775419247549074
Energy: 0.3947289026450324
Energy: 0.42746068691538674
Energy: 0.4180501563413334
Energy: 0.40518262462080085
Energy: 0.3890891842683849
Energy: 0.40548307908051306
Energy: 0.3703734199946598
Energy: 0.38933063897997683
Energy: 0.4043489774004622
Energy: 0.40537066066394944
Energy: 0.3714691300393718
Energy: 0.4126151766850471
Energy: 0.40611038481737816
Energy: 0.3715953936829613
Energy: 0.3724830041770717
Energy: 0.40236051132280254
Energy: 0.3537246498450809
Energy: 0.40128320591138744
Energy: 0.4016469573862859
Energy: 0.3520911472678611
Energy: 0.4008691567522852
Energy: 0.4171606771609694
Energy: 0.37226619017523693
Energy: 0.37168805946096034
Energy: 0.3724386972906905
Energy: 0.36887967025905544
Energy: 0.41892274716554434
Energy: 0.38796124980122354
Energy: 0.373497155339207
Energy: 0.3747773262079327
Energy: 0.3880837260022417
Energy: 0.3710333811918242
Energy: 0.3690686199228717
Energy: 0.3514490826977947
Energy: 0.4019696062400572
Energy: 0.4025605737909763
Energy: 0.3538508346111946
Energy: 0.41167114063418075
Energy: 0.4033408717457734
Energy: 0.3561864760815714
Energy: 0.3741150340313876
Energy: 0.39991079501393484
Energy: 0.35688465302314626
Energy: 0.37122468964258865
Energy: 0.35251420652277277
Energy: 0.3585636229410666
Energy: 0.3563165393002791
Energy: 0.3958330605715118
Energy: 0.3590627726745828
Energy: 0.3537401704713044
Energy: 0.3524795754791829
Energy: 0.4165212749155356
Energy: 0.37909631132555505
Energy: 0.3961753591299309
Energy: 0.3529039124749641
Energy: 0.385158277294816
Energy: 0.3952529234480422
Energy: 0.40957547452347953
Energy: 0.3557580380672245
Energy: 0.35750154665026285
Energy: 0.4103803092561584
Energy: 0.35328053199830584
Energy: 0.35301204618530596
Energy: 0.4089032469433391
Energy: 0.40466777586537694
Energy: 0.4022079291191068
Energy: 0.3707934523309705
Energy: 0.38550950866235506
Energy: 0.3999427026176165
Energy: 0.3748538547827742
Energy: 0.350407313517875
Energy: 0.3939606009235069
Energy: 0.37506644571020487
Energy: 0.34829224205954395
Energy: 0.3703183778046572
Energy: 0.3757252562804438
Energy: 0.3732441989905395
Energy: 0.42098277844040355
Energy: 0.3763568695965252
Energy: 0.3718533165519466
Energy: 0.3696547541116832
Energy: 0.4050664197260613
Energy: 0.3581996762874405
Energy: 0.4083495011525774
Energy: 0.3589738202572038
Energy: 0.35791220084676995
Energy: 0.4096414139347239
Energy: 0.37309134168462615
Energy: 0.4070932192806491
Energy: 0.41113640926371653
Energy: 0.3739906126310545
Energy: 0.40179044149596554
Energy: 0.4043379493496525
Energy: 0.4070875396538932
Energy: 0.38523826602006617
Energy: 0.4217537263279159
Energy: 0.4066369120343317
Energy: 0.39785689156357235
Energy: 0.42195217827983356
Energy: 0.4291240503878576
Energy: 0.35773491320310763
Energy: 0.42120933550377837
Energy: 0.41902481292347266
Energy: 0.35564090948306865
Energy: 0.4212732457837358
Energy: 0.4179118577447616
Energy: 0.4053413823723134
Energy: 0.4103235636632898
Energy: 0.41789166667050115
Energy: 0.40301211075270793
Energy: 0.4129751188446012

minimum gb energy = 0.34829224205954395 eV
minimum distance =  2.6554400648998 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.7259286926725645
Energy: 0.45533519158392016
Energy: 0.49500175401067625
Energy: 0.4227755225316378
Energy: 0.4554720235522407
Energy: 0.4755035373751187
Energy: 0.5030891628755599
Energy: 0.44332257533645136
Energy: 0.44715691310061334
Energy: 0.44141740854076317
Energy: 0.4877686583627842
Energy: 0.4480674765611676
Energy: 0.49781760070465264
Energy: 0.44461818904412775
Energy: 0.4464000473811249
Energy: 0.44835468325688516
Energy: 0.4396304459024844
Energy: 0.47197473555904695
Energy: 0.4425121824828279
Energy: 0.4446861960321651
Energy: 0.45544022499180936
Energy: 0.4430473558039997
Energy: 0.44930329076861136
Energy: 0.47153588445929384
Energy: 0.44175483379536556
Energy: 0.4096981766324879
Energy: 0.48958283455321505
Energy: 0.4415099861498493
Energy: 0.44610010894458363
Energy: 0.4470628793298792
Energy: 0.4052666378171817
Energy: 0.4079340476660423
Energy: 0.40902605571374145
Energy: 0.40878471782165526
Energy: 0.40773012550895377
Energy: 0.40558250574097665
Energy: 0.44135034669670337
Energy: 0.4482110761694998
Energy: 0.4501799546902141
Energy: 0.4419305364826428
Energy: 0.40887943129275867
Energy: 0.4468035358551583
Energy: 0.443110828816208
Energy: 0.4131906427620102
Energy: 0.40825395430603806
Energy: 0.44307669313400033
Energy: 0.41030176919708095
Energy: 0.44691313834787016
Energy: 0.4371735331692035
Energy: 0.410544704356137
Energy: 0.4430940929131507
Energy: 0.41272162733941864
Energy: 0.4084688570605416
Energy: 0.4612000506851149
Energy: 0.43689939341253964
Energy: 0.4119183910279978
Energy: 0.4083288041938974
Energy: 0.435820027206785
Energy: 0.40915905149606413
Energy: 0.40786417644144507
Energy: 0.4350186253712825
Energy: 0.40939315471260956
Energy: 0.4088747521791883
Energy: 0.409429826962468
Energy: 0.4369106935515787
Energy: 0.40783057833254355
Energy: 0.4143963265238532
Energy: 0.4078211794874956
Energy: 0.4080869498605661
Energy: 0.4078199557102674
Energy: 0.41947306508623694
Energy: 0.40824177053587285
Energy: 0.4127061357241846
Energy: 0.4485024324515918
Energy: 0.4279082082258784
Energy: 0.41359326972040783
Energy: 0.41234324297284325
Energy: 0.4079853654925077
Energy: 0.3966035283930225
Energy: 0.4116918257067992
Energy: 0.44882772371977164
Energy: 0.3987026989010828
Energy: 0.4367649695318336
Energy: 0.39638322958037325
Energy: 0.3982687508601797
Energy: 0.4485108402014063
Energy: 0.44969183028416687
Energy: 0.3977363129445671
Energy: 0.44390982318935557
Energy: 0.43066790112065867
Energy: 0.41365470336954524
Energy: 0.416258625089717
Energy: 0.45092336565882557
Energy: 0.41315599342794246
Energy: 0.4160450194231308
Energy: 0.4497313100879301
Energy: 0.4950207227543647
Energy: 0.4214932094010298
Energy: 0.41577103780905833
Energy: 0.4495147901924677
Energy: 0.418458469678014
Energy: 0.46322123057540543
Energy: 0.5193140582381801
Energy: 0.4462102168785197
Energy: 0.449276265234662
Energy: 0.4893534757948263
Energy: 0.4443355624765213
Energy: 0.4789950526058841
Energy: 0.46456483438638824
Energy: 0.446582334821816
Energy: 0.41729286731700654
Energy: 0.418009710390363
Energy: 0.4468478104205433
Energy: 0.4491507037050606
Energy: 0.4618045003716101
Energy: 0.44533939989746896
Energy: 0.4125597684925307
Energy: 0.4627574554455162
Energy: 0.4457753312084068
Energy: 0.44715168774158126
Energy: 0.4960004034029911
Energy: 0.40803708371011443
Energy: 0.42610393995167634
Energy: 0.44703043915160057
Energy: 0.45007348729026875
Energy: 0.44309094796120957
Energy: 0.4422670106259444
Energy: 0.44386197152040757
Energy: 0.4463480389563886
Energy: 0.4425569326514198
Energy: 0.4429388646799888
Energy: 0.471891106937283
Energy: 0.4418489147168147
Energy: 0.4123656542628575
Energy: 0.4473532304143089
Energy: 0.44195409997491913
Energy: 0.4457221798051731
Energy: 0.44814375997549644
Energy: 0.4061156553857591
Energy: 0.40832514621419386
Energy: 0.40822580574645967
Energy: 0.41081256905345653
Energy: 0.4077830995791376
Energy: 0.4458781213728445
Energy: 0.44121780834394897
Energy: 0.44793932301329537
Energy: 0.44953672303770226
Energy: 0.44170653026957035
Energy: 0.4466640243357285
Energy: 0.4465911443542346
Energy: 0.4454532144438544
Energy: 0.4125754637548223
Energy: 0.40833089421515145
Energy: 0.44585728026282206
Energy: 0.40970417763099
Energy: 0.44651930031139814
Energy: 0.43724362671084244
Energy: 0.4080480915124848
Energy: 0.4084686407513904
Energy: 0.41309835722205895
Energy: 0.4188010100398306
Energy: 0.46182879406485083
Energy: 0.4373801039420785
Energy: 0.4122338032571273
Energy: 0.4085910935618025
Energy: 0.41294410473254956
Energy: 0.40929609722201915
Energy: 0.4077221894782871
Energy: 0.44291793363766263
Energy: 0.4371134267300416
Energy: 0.41058121925404384
Energy: 0.4105143296880871
Energy: 0.4088171162066278
Energy: 0.40776015080488126
Energy: 0.4074272492092072
Energy: 0.40778515753628675
Energy: 0.40789781532563685
Energy: 0.40748505268565005
Energy: 0.4165201097193047
Energy: 0.40800379743719334
Energy: 0.41070564648195146
Energy: 0.44843754489629706
Energy: 0.40802231662179034
Energy: 0.4114647637112009
Energy: 0.41257362996086233
Energy: 0.4078931118603379
Energy: 0.3978655735314534
Energy: 0.44849005132862485
Energy: 0.4486804100917074
Energy: 0.3981130597107507
Energy: 0.43721409684019685
Energy: 0.3963476266977746
Energy: 0.39813148823286276
Energy: 0.44899016972462996
Energy: 0.44970105150573275
Energy: 0.39877802641864607
Energy: 0.44456957876245284
Energy: 0.4283698060540345
Energy: 0.41343922000689903
Energy: 0.4534490231542837
Energy: 0.4466531036075135
Energy: 0.4128107710475059
Energy: 0.41577155466742793
Energy: 0.45053427977962596
Energy: 0.5198480986914316
Energy: 0.41644907083905286
Energy: 0.4158033563039512
Energy: 0.44775635444611706
Energy: 0.39833227973808194
Energy: 0.45204472608407187
Energy: 0.5170342779327417
Energy: 0.4423956653751699
Energy: 0.4126248053818626
Energy: 0.4444244302907087
Energy: 0.4456827965312176
Energy: 0.47774463870504374
Energy: 0.44356891650446595
Energy: 0.4474100779860913
Energy: 0.4182395207045379
Energy: 0.4168016152266031
Energy: 0.4481749172904677
Energy: 0.4133044893839838

minimum gb energy = 0.3963476266977746 eV
minimum distance =  2.65486815559221 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.6815124799851052
Energy: 0.5408222117756075
Energy: 0.5377098971645259
Energy: 0.474391365647316
Energy: 0.540615746296236
Energy: 0.4763658588578769
Energy: 0.5646445963123453
Energy: 0.5031028987687813
Energy: 0.48421450729920723
Energy: 0.5004917977164677
Energy: 0.5019035443376119
Energy: 0.4836126270384345
Energy: 0.575971809901968
Energy: 0.47356385003800366
Energy: 0.4720548344696963
Energy: 0.5001904044959908
Energy: 0.496162288288992
Energy: 0.47169893350572645
Energy: 0.5036426506428376
Energy: 0.47370671395782044
Energy: 0.472212201123266
Energy: 0.503799616815923
Energy: 0.47516103190471287
Energy: 0.49189837098352585
Energy: 0.4920917735751098
Energy: 0.48506325854091303
Energy: 0.4740648582838452
Energy: 0.4919450902901659
Energy: 0.5032857941194084
Energy: 0.47366503171064595
Energy: 0.5105617253543794
Energy: 0.5098013013077201
Energy: 0.47368298516921825
Energy: 0.4746135209439905
Energy: 0.5217375138197597
Energy: 0.473562203163427
Energy: 0.49149925226162616
Energy: 0.48455490697842063
Energy: 0.47468737202837546
Energy: 0.49163778441708256
Energy: 0.5052653214849061
Energy: 0.4750349511738906
Energy: 0.4932944264902805
Energy: 0.4743120257335561
Energy: 0.47382272183161933
Energy: 0.4941175102938668
Energy: 0.47533686607056
Energy: 0.4761780418972339
Energy: 0.5381363978556942
Energy: 0.47429603840583123
Energy: 0.4736845057832401
Energy: 0.46477983451570254
Energy: 0.4846081142654368
Energy: 0.47343202654931554
Energy: 0.5095872834557853
Energy: 0.49542974456524863
Energy: 0.47479377137483614
Energy: 0.4763305466766004
Energy: 0.49187645475987285
Energy: 0.4729172460731179
Energy: 0.5043689480015907
Energy: 0.48240572850514885
Energy: 0.4752427649849642
Energy: 0.4757670977828744
Energy: 0.46425836393519326
Energy: 0.47517900897976384
Energy: 0.5649787598150947
Energy: 0.4639290664167229
Energy: 0.46380339405355203
Energy: 0.5652779437282717
Energy: 0.4690133569916057
Energy: 0.5000069518402394
Energy: 0.5786253787926914
Energy: 0.4963500994335787
Energy: 0.48196791019055574
Energy: 0.5006469794082178
Energy: 0.4919397736407472
Energy: 0.4828253418856231
Energy: 0.4663024849378551
Energy: 0.5002678618636355
Energy: 0.4698210635738146
Energy: 0.4662534780971697
Energy: 0.4998184281630664
Energy: 0.46429194949695807

minimum gb energy = 0.46380339405355203 eV
minimum distance =  2.66591482116931 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.5403833814090956
Energy: 0.620936897328867
Energy: 0.6026765071211941
Energy: 0.570886680746912
Energy: 0.5684348597816917
Energy: 0.5625217902200788
Energy: 0.6513782654766118
Energy: 0.5475031467687939
Energy: 0.5529996700251748
Energy: 0.5700940799294151
Energy: 0.5475645809352686
Energy: 0.568878693109102
Energy: 0.614795919426558
Energy: 0.5388434292873892
Energy: 0.5502335469269313
Energy: 0.5619257026771493
Energy: 0.5388331380964064
Energy: 0.5573886272408468
Energy: 0.5710708627772167
Energy: 0.5388014014152525
Energy: 0.5393890705795122
Energy: 0.5519646430550713
Energy: 0.5406969545408108
Energy: 0.5653678485110525
Energy: 0.5608042745315562
Energy: 0.5475370931242013
Energy: 0.5567531067296543
Energy: 0.5650268385409398
Energy: 0.5469405714264622
Energy: 0.5672776449732225
Energy: 0.565288465177639
Energy: 0.5552295107331565
Energy: 0.5584076622980897
Energy: 0.5486593163073286
Energy: 0.5627302160988528
Energy: 0.5596715416667659
Energy: 0.5607721912566521
Energy: 0.5572387662856115
Energy: 0.5574666619256025
Energy: 0.5594398422413559
Energy: 0.5536534715891656
Energy: 0.5616708471278324
Energy: 0.5594463367978627
Energy: 0.5556457027719304
Energy: 0.5679492644541594
Energy: 0.5470828773731105
Energy: 0.5653245787111671
Energy: 0.567314472619763
Energy: 0.5483461248458307
Energy: 0.5654857422019033
Energy: 0.5655854875746111
Energy: 0.5384901953355072
Energy: 0.5611692839210958
Energy: 0.5413185979838697
Energy: 0.5471812631569317
Energy: 0.565210835740661
Energy: 0.5659008142060838
Energy: 0.5509868992574162
Energy: 0.561496325781112
Energy: 0.5414610906073737
Energy: 0.5597369985190331
Energy: 0.5520162958703394
Energy: 0.5681136228878386
Energy: 0.5471105802224028
Energy: 0.5577365752244094
Energy: 0.5574971212369758
Energy: 0.5499046370022149
Energy: 0.5624413319450168
Energy: 0.5630081834078228
Energy: 0.5502656488213312
Energy: 0.5493228791545841
Energy: 0.5627694098196259
Energy: 0.5467314053866197
Energy: 0.5648802218557006
Energy: 0.5639998523348365
Energy: 0.5468996515153067
Energy: 0.5603340509516643
Energy: 0.5605760057550694
Energy: 0.5565759181959239
Energy: 0.5626135392668458
Energy: 0.5652381221312368
Energy: 0.5397921953870919
Energy: 0.5818300800214415
Energy: 0.5576662247165657
Energy: 0.539034143982096
Energy: 0.5644570505258676
Energy: 0.5637455718693755
Energy: 0.53951735996474
Energy: 0.5611864639410863
Energy: 0.5627609703142771
Energy: 0.5394411874365315
Energy: 0.5647437388031173
Energy: 0.5639078558463321
Energy: 0.5404099023276617
Energy: 0.5634784059578154
Energy: 0.5394588201645227
Energy: 0.5388715281194437
Energy: 0.5574283922441593
Energy: 0.5647434827421499
Energy: 0.5390598101509576
Energy: 0.5579785394041638
Energy: 0.5579916374285266
Energy: 0.5857630361301169
Energy: 0.5862905023149291
Energy: 0.5810446427016714
Energy: 0.5662458290919671
Energy: 0.5852902195903072
Energy: 0.5628099934705603
Energy: 0.5505408741693483
Energy: 0.5571495157323825
Energy: 0.5647654748696473
Energy: 0.5507021150213094
Energy: 0.5545669630712107
Energy: 0.5639643248198588
Energy: 0.5720134240508022
Energy: 0.5400011670601744
Energy: 0.5401384268235192
Energy: 0.5598035427240056
Energy: 0.5400830446294269
Energy: 0.5656389298377541
Energy: 0.6013409550277563
Energy: 0.5396600608427303
Energy: 0.55933906501737
Energy: 0.5591103221844578
Energy: 0.5486743243932026
Energy: 0.5654955657762982
Energy: 0.5537473594606163
Energy: 0.5619036147025646
Energy: 0.564514654305108
Energy: 0.570096356806543
Energy: 0.5583914200541209
Energy: 0.56393126965106
Energy: 0.5441773132669507
Energy: 0.5573548697018437
Energy: 0.5561860745900491
Energy: 0.5383184517407146
Energy: 0.5572667681922683
Energy: 0.5635039294997082
Energy: 0.6024922951105068
Energy: 0.5632243206623904
Energy: 0.556533044052465
Energy: 0.5534097430236776
Energy: 0.5580432306660162
Energy: 0.5646736942365196
Energy: 0.6040272626570345
Energy: 0.5617173579566535
Energy: 0.557489823243482
Energy: 0.5852984603528125
Energy: 0.5608008930742284
Energy: 0.5595245773065348
Energy: 0.5913565453502834
Energy: 0.554803453448242
Energy: 0.5396215638625069
Energy: 0.5546474683583527
Energy: 0.5398939346045628
Energy: 0.5637365231024091
Energy: 0.6042593304292293
Energy: 0.5391287212242769
Energy: 0.5391852894544893
Energy: 0.5604984851735888
Energy: 0.541021729596643
Energy: 0.563282359853619
Energy: 0.5905212541779806
Energy: 0.5398848851921801
Energy: 0.5617981700470587
Energy: 0.5606233022480474
Energy: 0.5501040614189072
Energy: 0.5633905880647181
Energy: 0.5899748167924964
Energy: 0.554619323332907
Energy: 0.5531491496474327
Energy: 0.5731929159977276
Energy: 0.565547607990671
Energy: 0.5580703193811762
Energy: 0.6517969688867749
Energy: 0.5469991238113983
Energy: 0.5599615318683712
Energy: 0.5574359734818228
Energy: 0.5467201185808951
Energy: 0.5633470964266978
Energy: 0.5411681494353416
Energy: 0.5526070791332207
Energy: 0.563002578172304
Energy: 0.5404824911838135
Energy: 0.551130930082544
Energy: 0.5666865710349465

minimum gb energy = 0.5383184517407146 eV
minimum distance =  2.65752198822165 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 0.7813142000167511
Energy: 0.55742139835977
Energy: 0.5249533219211533
Energy: 0.5652475160863707
Energy: 0.8435624978244055
Energy: 0.5251644298979216
Energy: 0.602827776782083
Energy: 0.5397460922009458
Energy: 0.5374486218807427
Energy: 0.5391158562574303
Energy: 0.541130402831381
Energy: 0.5369630442901222
Energy: 0.5573007792484174
Energy: 0.5355602756054242
Energy: 0.5359709266889436
Energy: 0.5997849141996897
Energy: 0.5494630434934563
Energy: 0.5384248754306294
Energy: 0.5497600115912457
Energy: 0.538976610740302
Energy: 0.5370688307502666
Energy: 0.5495735020766078
Energy: 0.5481745306497946
Energy: 0.5371905389671773
Energy: 0.5489753644513258
Energy: 0.5392218476863815
Energy: 0.5380092635242519
Energy: 0.5388368556844193
Energy: 0.5403450835670981
Energy: 0.5368464545009595
Energy: 0.5501792644057918
Energy: 0.5582419627783722
Energy: 0.5376348101140918
Energy: 0.5395307372888802
Energy: 0.5388695752060205
Energy: 0.53764712147087
Energy: 0.5524817775571432
Energy: 0.5674767025844065
Energy: 0.5251546412993343
Energy: 0.5535492503019599
Energy: 0.5688494660242253
Energy: 0.5571664724562186
Energy: 0.6037697626651345
Energy: 0.5395705248299283
Energy: 0.5374735059468441
Energy: 0.5409845046655467
Energy: 0.5382245089002904
Energy: 0.5370973175015299
Energy: 0.5245088455936711
Energy: 0.5396769813242918
Energy: 0.5258144228578144
Energy: 0.5277882975759789
Energy: 0.5497045285661551
Energy: 0.5254757383336983
Energy: 0.5528456719333625
Energy: 0.5394274248033807
Energy: 0.5258488331425936
Energy: 0.5273546820776843
Energy: 0.5489061042620812
Energy: 0.5254665106872796
Energy: 0.6035111055071247
Energy: 0.5491462163576342
Energy: 0.5383198700469465
Energy: 0.5387417935150157
Energy: 0.537836540163025
Energy: 0.5372835799351919
Energy: 0.550596931916445
Energy: 0.5351605814103281
Energy: 0.5491903846654912
Energy: 0.5500590685548925
Energy: 0.5395102687413735
Energy: 0.5384431338753186
Energy: 0.5531484400421792
Energy: 0.5380857611190423
Energy: 0.5381449922880284
Energy: 0.5400561912991018
Energy: 0.5391834609911271
Energy: 0.5367333167650028
Energy: 0.5499676790634672
Energy: 0.6005377395702568
Energy: 0.5496093418681621
Energy: 0.5389711687935165
Energy: 0.5527638440126689
Energy: 0.5381228041911875
Energy: 0.5608655742201
Energy: 0.5251635327873382
Energy: 0.5372643785614986
Energy: 0.5589387401958952
Energy: 0.566506901811377
Energy: 0.5369135912161179
Energy: 0.5981169634746974
Energy: 0.5250924158799907
Energy: 0.5246969331160465
Energy: 0.5497690345367137
Energy: 0.5671276620289467
Energy: 0.5378148800944358
Energy: 0.5252919806065857
Energy: 0.5396608578862634
Energy: 0.5378262109063287
Energy: 0.5245888390421239
Energy: 0.5419518165996801
Energy: 0.5376139780423724

minimum gb energy = 0.5245088455936711 eV
minimum distance =  2.67148974812962 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.970124280650389
Energy: 0.6140231586912865
Energy: 0.647271771496648
Energy: 0.6063425578670595
Energy: 0.6027696658199708
Energy: 0.6467457756802942
Energy: 0.6409700995987422
Energy: 0.598175764103336
Energy: 0.5853447410336203
Energy: 0.583042435334142
Energy: 0.5980003133023795
Energy: 0.5876323940941093
Energy: 0.6068295459339591
Energy: 0.5901206270629025
Energy: 0.5925425399813754
Energy: 0.6072802443188301
Energy: 0.5829562625997281
Energy: 0.5906191725238218
Energy: 0.5917212113444317
Energy: 0.5934812241462657
Energy: 0.5883556576330488
Energy: 0.5929748927304626
Energy: 0.5833584504816431
Energy: 0.592726119349911
Energy: 0.5830285945880612
Energy: 0.5724637717321691
Energy: 0.5734065843662528
Energy: 0.5696583198190944
Energy: 0.5798708971719162
Energy: 0.5700417411397314
Energy: 0.5842593931100409
Energy: 0.5834807538470063
Energy: 0.581732624417741
Energy: 0.5899307227072147
Energy: 0.5852737596669885
Energy: 0.5815118303278873
Energy: 0.5890379036923348
Energy: 0.5816592904492488
Energy: 0.5972605031284146
Energy: 0.5894861014952926
Energy: 0.5842933090653766
Energy: 0.611640182801223
Energy: 0.5994123759210933
Energy: 0.5838163846305979
Energy: 0.5843320642586287
Energy: 0.5924236197012162
Energy: 0.5819549174459806
Energy: 0.5848234010654862
Energy: 0.6115191105954042
Energy: 0.5732270829753962
Energy: 0.5751711679058935
Energy: 0.6025468579971449
Energy: 0.5809753692928216
Energy: 0.5905190612828982
Energy: 0.598897510787273
Energy: 0.5735918417677788
Energy: 0.5752906342228872
Energy: 0.6023269345738252
Energy: 0.5805967864613162
Energy: 0.5697801647046024
Energy: 0.6000987331657189
Energy: 0.579825170763228
Energy: 0.5876845302607531
Energy: 0.5826984832808684
Energy: 0.5817438137989145
Energy: 0.5773598336533526
Energy: 0.6053019032330378
Energy: 0.5885252827605788
Energy: 0.589007147497512
Energy: 0.5959426732957896
Energy: 0.5841419361321473
Energy: 0.5870209324870184
Energy: 0.6158111976829265
Energy: 0.5839739038369017
Energy: 0.5854417626877807
Energy: 0.5852997447068887
Energy: 0.5831955567667583
Energy: 0.5804986376414151
Energy: 0.5954621319720536
Energy: 0.5887687549181475
Energy: 0.5912156827555891
Energy: 0.5935794852898489
Energy: 0.5861186754762306
Energy: 0.5924798759292111
Energy: 0.5996942591990817
Energy: 0.5791052930694023
Energy: 0.5894190425935865
Energy: 0.5907366165733177
Energy: 0.5791453717344883
Energy: 0.5721320935417752
Energy: 0.5900482763604178
Energy: 0.5936475305312631
Energy: 0.580940841915089
Energy: 0.5905859330925244
Energy: 0.5992822716120088
Energy: 0.5803200796500358
Energy: 0.6025291802409859
Energy: 0.5897519262087374
Energy: 0.5928202075809609
Energy: 0.6029319228069183
Energy: 0.592427058736854
Energy: 0.591759104291291
Energy: 0.6726119129402333
Energy: 0.5846114274154414
Energy: 0.5731330630678725
Energy: 0.5746363551676575
Energy: 0.5933331013326959
Energy: 0.5876892751727542
Energy: 0.5973908197928618
Energy: 0.5944217884654158
Energy: 0.5897527000539213
Energy: 0.5965226297969101
Energy: 0.5829526663998938
Energy: 0.5872512064835796
Energy: 0.5908649292235449
Energy: 0.5944820068461875
Energy: 0.5908977660580287
Energy: 0.5698900138129765
Energy: 0.595309601943235
Energy: 0.5871053288874191
Energy: 0.5931267135753238
Energy: 0.5980117758505866
Energy: 0.5850516362879805
Energy: 0.5813738546184525
Energy: 0.5968345403077857
Energy: 0.5892886078188994

minimum gb energy = 0.5696583198190944 eV
minimum distance =  2.62904659939419 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.6290063665452715
Energy: 0.8216480362144863
Energy: 0.5409040535010232
Energy: 0.5627212953514686
Energy: 0.8197261372878594
Energy: 0.5700469039037932
Energy: 0.6256098927033
Energy: 0.5699464556881818
Energy: 0.5859349540504751
Energy: 0.5732885851715835
Energy: 0.5766671373385313
Energy: 0.5730769980941031
Energy: 0.6376922189557407
Energy: 0.5758944318085305
Energy: 0.5712668417422178
Energy: 0.5761699669969789
Energy: 0.5850526946431448
Energy: 0.5773144014353961
Energy: 0.6224345207096106
Energy: 0.575250811111884
Energy: 0.5958615067356652
Energy: 0.6075082555431746
Energy: 0.5735674856950549
Energy: 0.5720551538197894
Energy: 0.5983355145088369
Energy: 0.5696431434089049
Energy: 0.569997145802704
Energy: 0.5701822750643633
Energy: 0.5779158675797104
Energy: 0.5712043356746302
Energy: 0.6336461513125382
Energy: 0.5719727598298789
Energy: 0.6079801695561319
Energy: 0.6083998723591444
Energy: 0.5765578510706243
Energy: 0.5743227757292408
Energy: 0.6258800111083823
Energy: 0.5444036845297501
Energy: 0.5430051122457652
Energy: 0.5684643328196831
Energy: 0.5403673960707256
Energy: 0.5421148847114682
Energy: 0.6193575841320997
Energy: 0.5595679240578585
Energy: 0.5942509344834591
Energy: 0.5631831280958203
Energy: 0.5613899498895837
Energy: 0.5982107229633953
Energy: 0.6916010958142494
Energy: 0.5979950336195966
Energy: 0.5960596542231162
Energy: 0.5980239257478446
Energy: 0.5999944320292842
Energy: 0.5953320814551513
Energy: 0.6906910824360089
Energy: 0.6019693738179046
Energy: 0.6024203149266697
Energy: 0.594892543681422
Energy: 0.6104158798172096
Energy: 0.5935502352164909
Energy: 0.620576961030162
Energy: 0.5977831782197892
Energy: 0.5931374493431931
Energy: 0.5953533623719485
Energy: 0.5831346124616391
Energy: 0.5940360661065014
Energy: 0.6257076427990019
Energy: 0.5981520726257826
Energy: 0.6038978896850798
Energy: 0.6018366942198035
Energy: 0.5977445267905699
Energy: 0.6028586660160316
Energy: 0.5675488402057633
Energy: 0.5998561033239017
Energy: 0.5450402005306256
Energy: 0.5669039628493614
Energy: 0.599629974277545
Energy: 0.5446575192380757
Energy: 0.5654249266092518
Energy: 0.6065334529908003
Energy: 0.6066335758877249
Energy: 0.5421289223246647
Energy: 0.60270090238052
Energy: 0.5411008795973203
Energy: 0.6249569211411968
Energy: 0.599742853802682
Energy: 0.5980940673404894
Energy: 0.6017596226524721
Energy: 0.6025463699207756
Energy: 0.6004620204447457
Energy: 0.6325792304310954
Energy: 0.5990533787363598
Energy: 0.6024749295641878
Energy: 0.5772628411969108
Energy: 0.600257426465349
Energy: 0.6025618451685153
Energy: 0.5932204407840646
Energy: 0.6007954221831381
Energy: 0.6016766432493689
Energy: 0.6003718390944578
Energy: 0.5993447427067381
Energy: 0.6015612438645255
Energy: 0.6345181055853063
Energy: 0.5966772732986577
Energy: 0.5949942520971628
Energy: 0.595324969895742
Energy: 0.6025786721897401
Energy: 0.5951427068063325
Energy: 0.6170683349438817
Energy: 0.5409062682997502
Energy: 0.5409216536959993
Energy: 0.5977474507536412
Energy: 0.5409511190254366
Energy: 0.540837397226627
Energy: 0.6268608167973703
Energy: 0.5409096187422241
Energy: 0.5407610386131791
Energy: 0.581173004142651
Energy: 0.5409899504335864
Energy: 0.5409331794745093
Energy: 0.6829256257577936
Energy: 0.575328650081729
Energy: 0.5974862196448553
Energy: 0.5957261720554202
Energy: 0.5974749279456121
Energy: 0.5960335697659775
Energy: 0.58968205580619
Energy: 0.5741190250171148
Energy: 0.5749363406782162
Energy: 0.5943749946099635
Energy: 0.5732932864028055
Energy: 0.5736928816534714
Energy: 0.6259488669141544
Energy: 0.572639232303091
Energy: 0.5758732907863052
Energy: 0.5678032731620468
Energy: 0.5977022811894692
Energy: 0.575257362655849
Energy: 0.626723515163599
Energy: 0.5734540108272966
Energy: 0.5707997581500159
Energy: 0.5668025783451494
Energy: 0.5738442671711265
Energy: 0.5695569267507918
Energy: 0.6181980222351271
Energy: 0.5761261875745084
Energy: 0.5741137880277506
Energy: 0.5419125963797278
Energy: 0.5755249218647885
Energy: 0.5699508484720529

minimum gb energy = 0.5403673960707256 eV
minimum distance =  2.58612438903524 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 0.5985111746895527
Energy: 0.5493810039593836
Energy: 0.5521218684917774
Energy: 0.5671437868155876
Energy: 0.5536687775200723
Energy: 0.5520425716533062
Energy: 0.6004032625888165
Energy: 0.5639259019776935
Energy: 0.5599898318259405
Energy: 0.5800875436309348
Energy: 0.5666019245122973
Energy: 0.5602400843926817
Energy: 0.5778247010897438
Energy: 0.5594326902482735
Energy: 0.5611932599655468
Energy: 0.5700668829091837
Energy: 0.5594859107349449
Energy: 0.5603949970237495
Energy: 0.5765163285032779
Energy: 0.5664026098169667
Energy: 0.5666231256688314
Energy: 0.5626341631239138
Energy: 0.5668358316476244
Energy: 0.5668533433330769
Energy: 0.5819766505816285
Energy: 0.5629130727998328
Energy: 0.5615677961287167
Energy: 0.5644156318713494
Energy: 0.5756871307376384
Energy: 0.5609825125677339
Energy: 0.5844218213490426
Energy: 0.5794665135077468
Energy: 0.5798834035835561
Energy: 0.5769567987157791
Energy: 0.5673993448593935
Energy: 0.5795875212481154
Energy: 0.5782930212824552
Energy: 0.5628781009050923
Energy: 0.5616296178872732
Energy: 0.5749098980094526
Energy: 0.5656261344269461
Energy: 0.5601068566708282
Energy: 0.576411800669929
Energy: 0.5650751373411373
Energy: 0.5588646624177002
Energy: 0.5624242413965435
Energy: 0.5661936696767581
Energy: 0.5640683463712576
Energy: 0.5757257234896073
Energy: 0.5593727419833234
Energy: 0.5637224623603971
Energy: 0.5708219135147936
Energy: 0.5616272335127691
Energy: 0.5641706036110146
Energy: 0.581406766062035
Energy: 0.5659414625770173
Energy: 0.565348896991
Energy: 0.5722265993968254
Energy: 0.5671903523041225
Energy: 0.565657238083807
Energy: 0.5779131573506576
Energy: 0.5538792429739955
Energy: 0.5530839837327558
Energy: 0.575185965001606
Energy: 0.5557098663397461
Energy: 0.5537849866703115
Energy: 0.5727450204468074
Energy: 0.5647310931956213
Energy: 0.5522752558024133
Energy: 0.5527135875178414
Energy: 0.5586974044037071
Energy: 0.5526728958242465
Energy: 0.590152091626573
Energy: 0.558860456062503
Energy: 0.5613630055085571
Energy: 0.5595373572472756
Energy: 0.5596555358479443
Energy: 0.5625736701302424
Energy: 0.6017422301223837
Energy: 0.571065937595066
Energy: 0.5701996579471245
Energy: 0.5514197338485787
Energy: 0.571971421223162
Energy: 0.5647064058495299
Energy: 0.5725929433927338
Energy: 0.5530201851723229
Energy: 0.5574230549687639
Energy: 0.5579279626893131
Energy: 0.5527498766257779
Energy: 0.5570222870643234
Energy: 0.5823869102707315
Energy: 0.5522125140984653
Energy: 0.5524013587894454
Energy: 0.5585414163471828
Energy: 0.5571246793805404
Energy: 0.5525041102340701
Energy: 0.5756794205042198
Energy: 0.5632113053662279
Energy: 0.5654897798355533
Energy: 0.5528901473003659
Energy: 0.5661139973552085
Energy: 0.5665200678990664
Energy: 0.5885116529129557
Energy: 0.5518529389066756
Energy: 0.5518816171346552
Energy: 0.5542489766483268
Energy: 0.5499390479473611
Energy: 0.551986339480753
Energy: 0.5834669891996869
Energy: 0.5668675485365965
Energy: 0.5668957439234272
Energy: 0.5719076442309697
Energy: 0.5586454734304546
Energy: 0.5569095156966688
Energy: 0.5690533226441659
Energy: 0.5540307830187831
Energy: 0.553861645260213
Energy: 0.5540311151311706
Energy: 0.5542261720778899
Energy: 0.5586184219345294
Energy: 0.5618527242477858
Energy: 0.5519501790329138
Energy: 0.5529283091024232
Energy: 0.5600697814697809
Energy: 0.5494702548257857
Energy: 0.5545003156343482
Energy: 0.5593986833939799
Energy: 0.5521415824324126
Energy: 0.5519500096928847
Energy: 0.5613667708024719
Energy: 0.550786088034467
Energy: 0.5523661910815919
Energy: 0.5749479208092121
Energy: 0.5730220238282955
Energy: 0.574591939099981
Energy: 0.5718668436895398
Energy: 0.571098649824839
Energy: 0.5584858401253104
Energy: 0.5884695042710104
Energy: 0.5500661280965506
Energy: 0.5560219776626432
Energy: 0.5790190174944795
Energy: 0.5492419711743827
Energy: 0.5582199450892998
Energy: 0.5862097703033394
Energy: 0.5504135168281207
Energy: 0.5539426519026157
Energy: 0.561862112498506
Energy: 0.5465737426188425
Energy: 0.5543735757999191
Energy: 0.5813403763872458
Energy: 0.5597982028201803
Energy: 0.5598756002742897
Energy: 0.5596081109906089
Energy: 0.5626475061746361
Energy: 0.5590243361291302
Energy: 0.5775688369568492
Energy: 0.5597106300025851
Energy: 0.5636214111521144
Energy: 0.5685908207026182
Energy: 0.5593556273445097
Energy: 0.5632763175103364
Energy: 0.5779226475668358
Energy: 0.5598945103636175
Energy: 0.5596229910407301
Energy: 0.5594619413235731
Energy: 0.560499802477455
Energy: 0.5595110154059522
Energy: 0.5866368039755059
Energy: 0.5813225911027007
Energy: 0.59002974933229
Energy: 0.551676922996465
Energy: 0.5849783017814189
Energy: 0.5609438076782011

minimum gb energy = 0.5465737426188425 eV
minimum distance =  2.63580373754972 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 0.8449610327991323
Energy: 0.5460837695659786
Energy: 0.5485266644360375
Energy: 0.535095575091531
Energy: 0.5461340330827564
Energy: 0.5305520936939958
Energy: 0.5678307791261483
Energy: 0.5431843753169595
Energy: 0.5446178399034769
Energy: 0.5517747966340811
Energy: 0.5444257873062603
Energy: 0.5440720366290595
Energy: 0.570624987763965
Energy: 0.5390317099060572
Energy: 0.5419514375130591
Energy: 0.5417635320828782
Energy: 0.5403918449964387
Energy: 0.5425728019367397
Energy: 0.5624282861667197
Energy: 0.5437031314837244
Energy: 0.5437272192372375
Energy: 0.5476129828579672
Energy: 0.5431977896336813
Energy: 0.5436784850007631
Energy: 0.5532666729079271
Energy: 0.541757598684999
Energy: 0.5437715381903195
Energy: 0.5482557354628627
Energy: 0.5604079244056429
Energy: 0.5468941507678374
Energy: 0.5511068140422164
Energy: 0.5455963252466651
Energy: 0.5430021518223231
Energy: 0.5565447852210027
Energy: 0.5515207500231897
Energy: 0.5458667939487589
Energy: 0.5613888040697894
Energy: 0.5375045097364545
Energy: 0.5391906408410256
Energy: 0.5572215108970483
Energy: 0.5383490568523279
Energy: 0.5421742832443914
Energy: 0.5619619313377715
Energy: 0.5414828587944236
Energy: 0.5417579710495221
Energy: 0.5549609601806947
Energy: 0.5479111963833647
Energy: 0.5565669666109178
Energy: 0.5430609807332472
Energy: 0.543913272196519
Energy: 0.5408280863112506
Energy: 0.5408969604023217
Energy: 0.5395820411104717
Energy: 0.539068775351182
Energy: 0.5510414086312857
Energy: 0.5518987565358078
Energy: 0.5505056103404493
Energy: 0.5443197186289778
Energy: 0.5422314396738757
Energy: 0.550511883449882
Energy: 0.5685565659520917
Energy: 0.5312418064787012
Energy: 0.5387416298008876
Energy: 0.558802236393226
Energy: 0.5315482774149541
Energy: 0.5357086903850823
Energy: 0.568597930377042
Energy: 0.5396569810775148
Energy: 0.546786411170001
Energy: 0.5514225491907229
Energy: 0.5413703402735802
Energy: 0.5472604834194837
Energy: 0.5531855915491388
Energy: 0.5400944534774287
Energy: 0.5441879901940058
Energy: 0.5396669511299198
Energy: 0.5393521825937497
Energy: 0.5419361942566303
Energy: 0.5580318982667192
Energy: 0.5465006435730211
Energy: 0.545128823808302
Energy: 0.54102174486498
Energy: 0.5432992882232552
Energy: 0.5431739638448266
Energy: 0.568186455435055
Energy: 0.5402141624883625
Energy: 0.5399708601805963
Energy: 0.5426208397761295
Energy: 0.5404904028068124
Energy: 0.5409539920589831
Energy: 0.5678330966820606
Energy: 0.5433057844331369
Energy: 0.5447108003981047
Energy: 0.5448638411693051
Energy: 0.5447512247116094
Energy: 0.5445718704148809
Energy: 0.5492126440456658
Energy: 0.5657462904413926
Energy: 0.5473726506598787
Energy: 0.5299457425512193
Energy: 0.5519187741746402
Energy: 0.5313465233370334
Energy: 0.5939450163082278
Energy: 0.5457264657342072
Energy: 0.5441690385988114
Energy: 0.5482150415192385
Energy: 0.5476860708357403
Energy: 0.5464189104167201
Energy: 0.5680077998110651
Energy: 0.541554583981788
Energy: 0.5414955746880783
Energy: 0.539454692572448
Energy: 0.5434658161729035
Energy: 0.5426122082830297
Energy: 0.5613851967812293
Energy: 0.5427788779577649
Energy: 0.5425698364941393
Energy: 0.549086363503359
Energy: 0.5425020585129418
Energy: 0.543084134657296
Energy: 0.5548233312343327
Energy: 0.5397966962708032
Energy: 0.5424923946867546
Energy: 0.5486768147323824
Energy: 0.5461004573283245
Energy: 0.544376947594175
Energy: 0.5521597633571566
Energy: 0.5445239408065189
Energy: 0.5437336316960286
Energy: 0.5446165407621234
Energy: 0.5422878924019123
Energy: 0.5428036680142364
Energy: 0.5570070271078946
Energy: 0.5403945624917263
Energy: 0.54112926438456
Energy: 0.5521899296699545
Energy: 0.5403618195429909
Energy: 0.5430171857326057
Energy: 0.5681188376705327
Energy: 0.5409293765875738
Energy: 0.5414942009923817
Energy: 0.5514222984467368
Energy: 0.5426182864297124
Energy: 0.5471552948461637
Energy: 0.5492476483859607
Energy: 0.5451473704303457
Energy: 0.5438818625110705
Energy: 0.5416178003336759
Energy: 0.5398668707464052
Energy: 0.542784488417158
Energy: 0.5436834079092732
Energy: 0.54771080835366
Energy: 0.5455800744742989
Energy: 0.5406908722910398
Energy: 0.5415995898122415
Energy: 0.5445614575617826
Energy: 0.5659772965941394
Energy: 0.5317607372309092
Energy: 0.5320036454247183
Energy: 0.5494436539624206
Energy: 0.5323939699113125
Energy: 0.5329765782846431
Energy: 0.5683139718694622
Energy: 0.5307079404994877
Energy: 0.5370433802773498
Energy: 0.5436047952709699
Energy: 0.5314699256590434
Energy: 0.5443870136078872
Energy: 0.5569612006692377
Energy: 0.543612846193113
Energy: 0.5439160919068291
Energy: 0.5385909391847798
Energy: 0.5433575526342073
Energy: 0.5427333737811492
Energy: 0.5547599538018994
Energy: 0.545991049443258
Energy: 0.5444668526640247
Energy: 0.5392669235847832
Energy: 0.5483250651696709
Energy: 0.5435210713479919
Energy: 0.5683675452323089
Energy: 0.543163945893138
Energy: 0.5426780392127194
Energy: 0.5427609035476676
Energy: 0.5400411133232289
Energy: 0.5432209344987325
Energy: 0.5681702858399214
Energy: 0.5458168708995589
Energy: 0.5447007794855556
Energy: 0.5394225629783794
Energy: 0.5414074002321378
Energy: 0.5448042367234556
Energy: 0.5518374028817956
Energy: 0.5460790840157925
Energy: 0.5324311778987285
Energy: 0.5285080481493747
Energy: 0.5399234489706042
Energy: 0.5313942021037732

minimum gb energy = 0.5285080481493747 eV
minimum distance =  2.62406385534029 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.013462267308950103
Energy: 0.5531363905097074
Energy: 0.013959163268127609
Energy: 0.01483896815126767
Energy: 0.5548134484017797
Energy: 0.013979247842050565
Energy: 0.25975892363691044
Energy: 0.07087328103095945
Energy: 0.06966572467266147
Energy: 0.07190168155592983
Energy: 0.07085017697773294
Energy: 0.06956075250849614
Energy: 0.7482062502240966
Energy: 0.5536366208059508
Energy: 0.552839173584358
Energy: 0.5542410511739184
Energy: 0.5553712109908098
Energy: 0.5525936745882342
Energy: 0.01403528511680771
Energy: 0.07087328103506008
Energy: 0.06966572467163631
Energy: 0.07190168155660683
Energy: 0.07085017697670777
Energy: 0.06956075250679399

minimum gb energy = 0.013462267308950103 eV
minimum distance =  2.84949746627494 Angstroms
sigma value = 1