Model name: model_name=EAM_Dynamo_LiuLiuBorucki_1999_AlCu__MO_020851069572_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.032073378562927
cohesive_energy=3.360270999181857
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.0212259326226998e-19, 2.65757844811482e-19, 3.03902466113754e-19, 3.4081821793774797e-19, 3.6802317718306796e-19, 3.92344218487188e-19, 4.1436132979161596e-19, 4.3353297539406e-19, 4.498174987020359e-19, 4.63395945675186e-19, 4.745791385805059e-19, 4.84793014622256e-19, 4.95253625865642e-19, 5.041937714833619e-19, 5.11345887977538e-19, 5.17209854457978e-19, 5.22307980507366e-19, 5.2673639672374195e-19, 5.304454356314519e-19, 5.334014515211819e-19, 5.356124552761019e-19, 5.371473404914739e-19, 5.3804295722988e-19, 5.38332951200634e-19, 5.38020526757004e-19, 5.37003144594414e-19, 5.351526305821439e-19, 5.323728541221539e-19, 5.28641384741568e-19, 5.236313784070499e-19, 5.16969527962878e-19, 5.08396280794344e-19, 4.9769213870258995e-19, 4.8420982232748e-19, 4.670312844577319e-19, 4.44881192492682e-19, 4.16174993741304e-19, 3.78869912995248e-19, 3.3068284855106395e-19, 2.69691188447952e-19, 1.9296615379895997e-19, 9.67943798194662e-20, -2.3618486850110998e-20, -1.7341158798098998e-19, -3.5857353939573594e-19, -5.890081959574199e-19, -8.820174631366078e-19, -1.2539163055973218e-18, -1.6972658172279e-18, -2.1969847093724998e-18, -2.7921773071371595e-18, -3.544687628594279e-18, -4.60620975745098e-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: 0.011785285293460896
Energy: 0.06799769076491136
Energy: 0.06781181109680777
Energy: 0.06789204282725562
Energy: 0.012503746923466737
Energy: 0.012645091091307153
Energy: 0.0682112665681288
Energy: 0.0677700024191477
Energy: 0.06792934176192444
Energy: 0.012461865544587145
Energy: 0.06809487279095892
Energy: 0.06835776367987684
Energy: 0.06862137872046965
Energy: 0.0678219541829248
Energy: 0.0691225712862753
Energy: 0.06813090404583554
Energy: 0.06806227495318398
Energy: 0.06822705627588843
Energy: 0.06776155051886631
Energy: 0.06884695058804079
Energy: 0.06766611827218595
Energy: 0.012350277093366143
Energy: 0.012074783829281331
Energy: 0.06797396986660535
Energy: 0.06766670977725359
Energy: 0.06857842465796411
Energy: 0.012235733802007532
Energy: 0.01206462373999226
Energy: 0.06788688641653624
Energy: 0.06779320634750549
Energy: 0.06791078077598116
Energy: 0.012352254885593708
Energy: 0.012188466560547081
Energy: 0.06774230439211654
Energy: 0.06777705674100103
Energy: 0.06820165375482455
Energy: 0.012315336611166648
Energy: 0.01215261089795283
Energy: 0.06744447638677556
Energy: 0.06766265081042286
Energy: 0.06783496050127767
Energy: 0.0679074877997329
Energy: 0.06783270161708628
Energy: 0.01212279660293338
Energy: 0.012177315193657046
Energy: 0.06760107294442014
Energy: 0.06821959769379991
Energy: 0.06873502319232068
Energy: 0.012228759135964891
Energy: 0.06765058216796171
Energy: 0.06772213567627638
Energy: 0.06751525413584707
Energy: 0.06843125089766054
Energy: 0.0121771163474524
Energy: 0.01251029413923178
Energy: 0.06772212395060373
Energy: 0.06790976261389282
Energy: 0.06879506076495434
Energy: 0.012185124025456016
Energy: 0.012414026186758617
Energy: 0.01238212732928286
Energy: 0.0678276419047761
Energy: 0.06773247202220936
Energy: 0.06936655937842072
Energy: 0.06805025480336015
Energy: 0.01239617229476018
Energy: 0.06946093834644176
Energy: 0.0678016456591942
Energy: 0.06882181023131728
Energy: 0.06810451334818483

minimum gb energy = 0.011785285293460896 eV
minimum distance =  2.816776754047 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 0.5909271016053065
Energy: 0.5082020859856655
Energy: 0.5088608262535655
Energy: 0.5043646570660195
Energy: 0.5151255535331051
Energy: 0.572471460220724
Energy: 0.5013565160519711
Energy: 0.5168689909697922
Energy: 0.5056820943517042
Energy: 0.5286216948852573
Energy: 0.5126288331540879
Energy: 0.6224759247335849
Energy: 0.508589870491215
Energy: 0.5061966722128494
Energy: 0.4758426231483523
Energy: 0.5140208803604247
Energy: 0.6150334989429853
Energy: 0.5114303911765712
Energy: 0.5014212445140145
Energy: 0.4991242630689517
Energy: 0.5077594740033425
Energy: 0.6094834782380356
Energy: 0.5165303144952538
Energy: 0.48982304468163435
Energy: 0.48988451688698237
Energy: 0.48909018212560157
Energy: 0.6096247427407614
Energy: 0.5980967354673178
Energy: 0.4922077957725744
Energy: 0.49214781247229417
Energy: 0.49704572333248015
Energy: 0.5108687790642746
Energy: 0.6088772761999375
Energy: 0.48386444140197205
Energy: 0.48939371307899865
Energy: 0.4980810122359296
Energy: 0.5148725173311354
Energy: 0.6082899594630817
Energy: 0.5073627006718225
Energy: 0.494964867087698
Energy: 0.5942934147749122
Energy: 0.581872379235074
Energy: 0.5581815082991907
Energy: 0.6002948540179356
Energy: 0.541786784041741
Energy: 0.5902428059803078
Energy: 0.5822905311580462
Energy: 0.6155536729045321
Energy: 0.5992424043352086
Energy: 0.5360396992898948
Energy: 0.5520812899889077
Energy: 0.5827382974893669
Energy: 0.5382368724029988
Energy: 0.4829270628337577
Energy: 0.599618495672351
Energy: 0.5524615013378495
Energy: 0.5604164972801199
Energy: 0.5195546640755899
Energy: 0.4951010126746877
Energy: 0.5997906801735836
Energy: 0.5315959837470374
Energy: 0.515129560475801
Energy: 0.6421914232556108
Energy: 0.4727472173799561
Energy: 0.5449668597203035
Energy: 0.5304238808593394
Energy: 0.565772728699273
Energy: 0.6435952167123411
Energy: 0.4710430263032463
Energy: 0.5170930554879724
Energy: 0.5236585212586827
Energy: 0.5132485950971992
Energy: 0.6432858938098928
Energy: 0.643706520735391
Energy: 0.5184761378048653
Energy: 0.5246990395823642
Energy: 0.5153618022677899
Energy: 0.5752236301907818
Energy: 0.5317261559422852
Energy: 0.51696168957171
Energy: 0.5159911442835563
Energy: 0.47228457140671104
Energy: 0.4879120388729025
Energy: 0.6305918537000825
Energy: 0.5144736852259919
Energy: 0.5165003960731078
Energy: 0.486326075997177
Energy: 0.42778697268868054
Energy: 0.6243755327363901
Energy: 0.5195907302543027
Energy: 0.536223656563846
Energy: 0.5058396214174286
Energy: 0.4845155111270808
Energy: 0.4869963154830048
Energy: 0.6202389552737562
Energy: 0.5003742500342173
Energy: 0.49062641526439227
Energy: 0.48357819358040105
Energy: 0.4865099430622438
Energy: 0.6205534186512652
Energy: 0.5927406824033338
Energy: 0.49656378852299043
Energy: 0.4890413047580092
Energy: 0.4958209777510085
Energy: 0.6203633232458069
Energy: 0.602859631829129
Energy: 0.4879699710257991
Energy: 0.5083146935756285
Energy: 0.4785708173843867
Energy: 0.6100614392067768
Energy: 0.6038588864213504
Energy: 0.499712902643617
Energy: 0.5789943401951254
Energy: 0.5722123906199726
Energy: 0.5171839428551648
Energy: 0.6025333110011333
Energy: 0.48438492696684043
Energy: 0.6119825065267259
Energy: 0.5654733602615839
Energy: 0.5166079905941958
Energy: 0.5380076628977676
Energy: 0.5995388393203637
Energy: 0.5531493382717944
Energy: 0.583646389118455
Energy: 0.55669125887209
Energy: 0.5377572501616712
Energy: 0.5979732468342708
Energy: 0.5563951237019988
Energy: 0.5929561264307708
Energy: 0.5566055761985653
Energy: 0.4928773733212924
Energy: 0.5148283518095229
Energy: 0.5181560190851908
Energy: 0.5547026671727314
Energy: 0.5760244048799336
Energy: 0.4898068480125598
Energy: 0.5434283062308577
Energy: 0.5171807797247278
Energy: 0.5553484211500345
Energy: 0.5780643136183252
Energy: 0.5723050108519767
Energy: 0.5104926446886662
Energy: 0.5158876754185054
Energy: 0.5150628196315634
Energy: 0.5503292027432052
Energy: 0.5732396994338541
Energy: 0.5201372462424736
Energy: 0.5264107643779743
Energy: 0.5143934431520711
Energy: 0.6490619369366799
Energy: 0.4921353074069022
Energy: 0.6225864047769459
Energy: 0.518673197012284
Energy: 0.5205621268421409
Energy: 0.47183667777898813
Energy: 0.6142074751808745
Energy: 0.6243107726865084
Energy: 0.5220508003030976
Energy: 0.516252608008899
Energy: 0.4721260820993024
Energy: 0.4956930857554135
Energy: 0.6083534865124356
Energy: 0.5153552384209017
Energy: 0.488420384110677
Energy: 0.48872977948640006
Energy: 0.49071870538403883
Energy: 0.6083718846719116
Energy: 0.5037310298011051
Energy: 0.4884731040736573
Energy: 0.48892678550595575
Energy: 0.4931785973655907
Energy: 0.49513738338242713
Energy: 0.6084980661261571
Energy: 0.49167405013191007
Energy: 0.4376395646574734
Energy: 0.5053033800430635
Energy: 0.48943904326519866
Energy: 0.6078843873222096
Energy: 0.495875393248895
Energy: 0.4374557834500044
Energy: 0.5705349888323803
Energy: 0.5377836842807053
Energy: 0.5421157782126583
Energy: 0.5996857655386483
Energy: 0.48895348585675874
Energy: 0.5624046764306385
Energy: 0.5372077970112781
Energy: 0.6007447853836732
Energy: 0.5999030862943343
Energy: 0.4867420506120519
Energy: 0.5553342857085019
Energy: 0.5820024510163594
Energy: 0.5253401521000153
Energy: 0.47624551523778874
Energy: 0.6006337704885244
Energy: 0.5683843679547455
Energy: 0.5858134405482693
Energy: 0.5392274868413564
Energy: 0.5128224575324037
Energy: 0.5989911932019779
Energy: 0.5324746512167957
Energy: 0.5530746085820374
Energy: 0.5744247198881499
Energy: 0.4714449873461984
Energy: 0.5470943445631613
Energy: 0.5328752311977998
Energy: 0.5752847884722962
Energy: 0.5742577376266149
Energy: 0.47164197168125077
Energy: 0.5447367791596895
Energy: 0.5227245244794488
Energy: 0.51798591750493
Energy: 0.6496489253611046
Energy: 0.5186290107443603
Energy: 0.5187178487394117
Energy: 0.5236919412439852
Energy: 0.5174605248013876
Energy: 0.6434602006134766
Energy: 0.5175040772017157
Energy: 0.5174456638733957
Energy: 0.5138391568549288
Energy: 0.512693679757139
Energy: 0.42714847293768277
Energy: 0.6472554435495784
Energy: 0.5205073159296599
Energy: 0.5140634646540738
Energy: 0.5161960460050112
Energy: 0.4273159763227654
Energy: 0.6221633773335656
Energy: 0.5190637803899356
Energy: 0.4638513271654872
Energy: 0.5059489893406297
Energy: 0.48420543659505805
Energy: 0.4847504731345223
Energy: 0.6153055055602535
Energy: 0.46563368061185667
Energy: 0.5050803071900178
Energy: 0.4834344626590125
Energy: 0.49790682825261917
Energy: 0.6201343613654013
Energy: 0.6052857076528819
Energy: 0.4928573356593636
Energy: 0.48967272900429887
Energy: 0.4866274715660569
Energy: 0.6203253591537363
Energy: 0.5332250445553802
Energy: 0.4950565353756472
Energy: 0.4911801067354372
Energy: 0.46401131369956766
Energy: 0.6200673951691649
Energy: 0.6051175082951166
Energy: 0.5017792812381691
Energy: 0.4943651586598934
Energy: 0.5352066251496523
Energy: 0.5109486544986998
Energy: 0.6066127430975278
Energy: 0.49224647098631086
Energy: 0.5786203259404031
Energy: 0.5567365838832004
Energy: 0.5045707378365712
Energy: 0.5471289831760999
Energy: 0.5117719590131763
Energy: 0.567027932350248
Energy: 0.5844194764575064
Energy: 0.5498916127987555
Energy: 0.5298963620899654
Energy: 0.6016220958907061
Energy: 0.5464471458845189
Energy: 0.5817529180514925
Energy: 0.5517461930539472
Energy: 0.5083809653311574
Energy: 0.5383382923590279
Energy: 0.5127054315072895
Energy: 0.5490797979321552
Energy: 0.5975233871771012
Energy: 0.4779664801335712
Energy: 0.5373026647704316
Energy: 0.5076334461387355
Energy: 0.5742088972359288
Energy: 0.6140188677309328
Energy: 0.5892947144626435
Energy: 0.5020370866733358
Energy: 0.5057288094546164
Energy: 0.5054907291429697
Energy: 0.6483426801345626
Energy: 0.5743244051030867
Energy: 0.5039621703408788
Energy: 0.5039888807517356
Energy: 0.5048165940992019
Energy: 0.6564280225274588

minimum gb energy = 0.42714847293768277 eV
minimum distance =  2.57030925829438 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 0.8080406530678369
Energy: 0.5497579321973985
Energy: 0.4931287148606829
Energy: 0.5154997086429506
Energy: 0.5126553683399285
Energy: 0.5064566682252595
Energy: 0.5108035114686279
Energy: 0.4999242917353545
Energy: 0.5249582983596337
Energy: 0.5072290359868439
Energy: 0.5299618671635199
Energy: 0.572023700301589
Energy: 0.5002799148397974
Energy: 0.5147237094311784
Energy: 0.49325147218616155
Energy: 0.5290648535541507
Energy: 0.5381995664693439
Energy: 0.5237645713811989
Energy: 0.5407222189065809
Energy: 0.5445468289478872
Energy: 0.5265387364541422
Energy: 0.5404552278918973
Energy: 0.6016726129506719
Energy: 0.5291139952400764
Energy: 0.4939076356963113
Energy: 0.5230936712029965
Energy: 0.542515211119177
Energy: 0.6029591901635962
Energy: 0.5181825378475707
Energy: 0.4937826329890805
Energy: 0.519447081137625
Energy: 0.5015768964245066
Energy: 0.555622602176274
Energy: 0.5410462108835902
Energy: 0.5068259001690154
Energy: 0.49161289915578665
Energy: 0.5400125307158775
Energy: 0.5485017549732205
Energy: 0.5475549727256855
Energy: 0.5074927255108613
Energy: 0.5395436221397704
Energy: 0.4830751168332455
Energy: 0.543674884960879
Energy: 0.5424360748844792
Energy: 0.5411238698941141
Energy: 0.5454397467819028
Energy: 0.48870238025068097
Energy: 0.5479254846395203
Energy: 0.5561770378586859
Energy: 0.5311872684980301
Energy: 0.5001147373033831
Energy: 0.4988145773497975
Energy: 0.5602418719039979
Energy: 0.5240755845721699
Energy: 0.5391035624444452
Energy: 0.48501732874692427
Energy: 0.49765879044832995
Energy: 0.5913394024577785
Energy: 0.600504485668991
Energy: 0.5294639943103209
Energy: 0.47918479425904564
Energy: 0.540836552747791
Energy: 0.5337102559188227
Energy: 0.5259422921056236
Energy: 0.5282768849963629
Energy: 0.5027559291814988
Energy: 0.5304111403387822
Energy: 0.5450354264147644
Energy: 0.5239243433586557
Energy: 0.5160481040406331
Energy: 0.48978719680964694
Energy: 0.5291443756516082
Energy: 0.5426039331079087
Energy: 0.5408362510810351
Energy: 0.520991438450187
Energy: 0.4903608445863581
Energy: 0.5251636473433865
Energy: 0.5423324818377344
Energy: 0.5407153773164242
Energy: 0.5091774497908944
Energy: 0.4974946845708476
Energy: 0.5338088306693816
Energy: 0.5057919793079265
Energy: 0.5170524221460083
Energy: 0.5400282196920017
Energy: 0.49764142612140716
Energy: 0.510454746130142
Energy: 0.5039691927571545
Energy: 0.5435364228800595
Energy: 0.5493155055925932
Energy: 0.5660151834152842
Energy: 0.5014877910874816
Energy: 0.4820268607932394
Energy: 0.5465490621618844
Energy: 0.5508685159464872
Energy: 0.5552894482144406
Energy: 0.5027153073873479
Energy: 0.47621235428771336
Energy: 0.5337817156684824
Energy: 0.5433208603380569
Energy: 0.5461325963802035
Energy: 0.48346941810822447
Energy: 0.5009116740981538
Energy: 0.5859080062968454
Energy: 0.5424766978459337
Energy: 0.5375090322229659
Energy: 0.4901810315304501
Energy: 0.5014692643089648
Energy: 0.518297274835104
Energy: 0.5470743123016613
Energy: 0.5264975140273699
Energy: 0.49476571638693106
Energy: 0.5332968253882348
Energy: 0.540821875561826
Energy: 0.5439866777502113
Energy: 0.5196752741224436
Energy: 0.4700289037387104
Energy: 0.5338917143907516
Energy: 0.537206349776134
Energy: 0.5487607592763039
Energy: 0.529407220260224
Energy: 0.5046517988481861
Energy: 0.5249084183938666
Energy: 0.6059171575037503
Energy: 0.5394800421755681
Energy: 0.5375471962635644
Energy: 0.50430664752313
Energy: 0.5119746343753953
Energy: 0.6040744498593256
Energy: 0.5336304832906105
Energy: 0.5142673814060773
Energy: 0.5344918693449386
Energy: 0.5519337273469369
Energy: 0.5129338653724259
Energy: 0.5430050338823904
Energy: 0.5151645685297377
Energy: 0.530632287768887
Energy: 0.5548041902206079
Energy: 0.5047955934646077
Energy: 0.5484982517695809
Energy: 0.5292426182115902
Energy: 0.5307647536861975
Energy: 0.4994387620908249
Energy: 0.48045270515131216
Energy: 0.5265304320864098
Energy: 0.531087552110314
Energy: 0.5378420111545965
Energy: 0.4983847944749049
Energy: 0.47902823129634653
Energy: 0.5272049358112953
Energy: 0.5261584265940801
Energy: 0.5160280237848508
Energy: 0.46568137457577063
Energy: 0.49920902712797854
Energy: 0.5101298055630906
Energy: 0.5254448246364943
Energy: 0.5134138592233546
Energy: 0.4941143830923149
Energy: 0.5000294755557889
Energy: 0.5130809625179137
Energy: 0.5148819688485085
Energy: 0.5080825494486373
Energy: 0.539390706937114
Energy: 0.5551491129478406
Energy: 0.5243088503320592
Energy: 0.5139665127193483
Energy: 0.5273551485086929
Energy: 0.5501426533349557
Energy: 0.5552640291355897
Energy: 0.5197704630461673
Energy: 0.5407710122840036
Energy: 0.5045143740955164
Energy: 0.5042601687424388
Energy: 0.5353558035273588
Energy: 0.5384603422252272
Energy: 0.5342510002107838
Energy: 0.5043000250292747
Energy: 0.5042435658594003
Energy: 0.5343149200517784
Energy: 0.538665108461287
Energy: 0.5412019592533107
Energy: 0.5461324962370171
Energy: 0.5233384596206037
Energy: 0.5350473965894555
Energy: 0.46908773409249455
Energy: 0.538141846992785
Energy: 0.5290498643864132
Energy: 0.5333663542990691
Energy: 0.5371061795590111
Energy: 0.4867235042133457
Energy: 0.5526542985257724
Energy: 0.5381329554490848
Energy: 0.5491240914046178
Energy: 0.5017125390447688
Energy: 0.488013955960876
Energy: 0.5423123820273367
Energy: 0.5389642401826275
Energy: 0.5472549504174962
Energy: 0.5012260814473253
Energy: 0.4835700416425233
Energy: 0.5269974379408654
Energy: 0.5371870737141288
Energy: 0.5282983016896334
Energy: 0.4817301542522525
Energy: 0.5015558872070794
Energy: 0.526332660470738
Energy: 0.5468907409685733
Energy: 0.5344070704084928
Energy: 0.48248328985688305
Energy: 0.5291250411953056
Energy: 0.5188846313052725
Energy: 0.523035587604024
Energy: 0.5185313269443692
Energy: 0.4930606709161681
Energy: 0.5397551480058864
Energy: 0.5262367911443158
Energy: 0.5118818476560981
Energy: 0.5188287032467771
Energy: 0.5290319024861142
Energy: 0.5433821513850717
Energy: 0.5186839178685552
Energy: 0.5360475797997927
Energy: 0.5044580716723881
Energy: 0.5040975179746483
Energy: 0.5310899629133818
Energy: 0.5189275454202216
Energy: 0.538655276408375
Energy: 0.5043826288145131
Energy: 0.5044720352266758
Energy: 0.5138011113271725
Energy: 0.48061153811198576
Energy: 0.5430033979454439
Energy: 0.5249153133527966
Energy: 0.52638719976824
Energy: 0.5347300425717809
Energy: 0.49690499824999096
Energy: 0.5476401299847915
Energy: 0.5303266909893459
Energy: 0.5406692601806723
Energy: 0.5291724185964825
Energy: 0.49723942596821863
Energy: 0.5327311952634005
Energy: 0.5449348203088152
Energy: 0.5637864494557617
Energy: 0.5020157843961159
Energy: 0.4861487068943146
Energy: 0.5334349390092252
Energy: 0.5400368649096794
Energy: 0.49773851248733986
Energy: 0.5065202557874523
Energy: 0.5393511635940427
Energy: 0.5392927207353654
Energy: 0.5529520679311822
Energy: 0.5299148332511131
Energy: 0.4947020559515474
Energy: 0.5455732381724469
Energy: 0.5248788976552687
Energy: 0.5394612091722332
Energy: 0.4826934524939362
Energy: 0.5032258639136881
Energy: 0.5335205952809424
Energy: 0.5382022428643104
Energy: 0.5212381225153769
Energy: 0.5393983853090435
Energy: 0.5148600580525542
Energy: 0.52079556018471
Energy: 0.5380807508095806
Energy: 0.5299969564613005
Energy: 0.5375607979192973
Energy: 0.5227969547480467
Energy: 0.5227342592048838
Energy: 0.5194601609631906
Energy: 0.5289818736458621
Energy: 0.5044574905432498
Energy: 0.5440404437849206
Energy: 0.5558863437742969
Energy: 0.51870443873293
Energy: 0.5420615425181807
Energy: 0.5042719815235622
Energy: 0.5319137501312621
Energy: 0.5110727266135414
Energy: 0.6024106346019212
Energy: 0.544285216453864
Energy: 0.5374005325804092
Energy: 0.5415433235101541
Energy: 0.5290710830872147
Energy: 0.5529526265179946
Energy: 0.5193325523864212
Energy: 0.5194866499048324
Energy: 0.5793339146898943
Energy: 0.500383166106395
Energy: 0.5479150722691715
Energy: 0.5067361894427876
Energy: 0.5163326307973839
Energy: 0.5198802002958477
Energy: 0.5220110967615544
Energy: 0.5660512774735961
Energy: 0.5013180163907961
Energy: 0.5183343369732301
Energy: 0.5107119527940538
Energy: 0.5286797756472662
Energy: 0.571793190732196
Energy: 0.5006254212142709
Energy: 0.5157816145765102
Energy: 0.49537824911539935
Energy: 0.5273139031911888
Energy: 0.5435212523229924
Energy: 0.5229837266924876
Energy: 0.5391749633889067
Energy: 0.5312443251939615
Energy: 0.5338357371619026
Energy: 0.5396181952171022
Energy: 0.6022957406340497
Energy: 0.5289565678435696
Energy: 0.4943488722824555
Energy: 0.5285190396475679
Energy: 0.5412934004089709
Energy: 0.6024351241913928
Energy: 0.514313422378099
Energy: 0.49383972178478974
Energy: 0.5191660542709713
Energy: 0.49851132271511744
Energy: 0.5482708993580184
Energy: 0.5476496234397461
Energy: 0.5074734722604531
Energy: 0.5067072701698241
Energy: 0.5338309365794037
Energy: 0.5527969858666246
Energy: 0.5465532535508195
Energy: 0.5080336108439316
Energy: 0.5397322343636891
Energy: 0.4831589836626217
Energy: 0.5434202353428157
Energy: 0.5424582663370112
Energy: 0.5421766981202943
Energy: 0.541730609310767
Energy: 0.48926554933357
Energy: 0.5507090011337888
Energy: 0.5555692236419686
Energy: 0.5268571600649073
Energy: 0.4968420834247591
Energy: 0.4987064972144249
Energy: 0.5648336972956439
Energy: 0.5228114371225706
Energy: 0.551113113790691
Energy: 0.4849735240669427
Energy: 0.49756418123189095
Energy: 0.5969047503393943
Energy: 0.5223043632217778
Energy: 0.5295814106153094
Energy: 0.48002932996326975
Energy: 0.5282773654548074
Energy: 0.5372323065569622
Energy: 0.5351565280927907
Energy: 0.5263302143292931
Energy: 0.5075163727529034
Energy: 0.5352674662738021
Energy: 0.5404338690199911
Energy: 0.525799448358149
Energy: 0.4994792920933296
Energy: 0.4997471418579165
Energy: 0.5304010888203564
Energy: 0.5421300935164935
Energy: 0.5406809389332702
Energy: 0.5119440795694676
Energy: 0.499531909830996
Energy: 0.5326931838425113
Energy: 0.5415465124786194
Energy: 0.541082513658142
Energy: 0.5171206851156436
Energy: 0.49757202560693203
Energy: 0.523090076096306
Energy: 0.5287642296428888
Energy: 0.5178574420246363
Energy: 0.5384512705863591
Energy: 0.49768566252712065
Energy: 0.5106933874122497
Energy: 0.49522374181805007
Energy: 0.5383153877103365
Energy: 0.5509037995088091
Energy: 0.5611073157841775
Energy: 0.5016475761664192
Energy: 0.48128259797298223
Energy: 0.5383797217946268
Energy: 0.5509942369093358
Energy: 0.5558824271422443
Energy: 0.5028917852242579
Energy: 0.4765005899482515
Energy: 0.5353217735599967
Energy: 0.5437089840280027
Energy: 0.5467849419031247
Energy: 0.4831984267558993
Energy: 0.5008716183412171
Energy: 0.599507430481818
Energy: 0.545202522510199
Energy: 0.5379211097025737
Energy: 0.4898544527928974
Energy: 0.5014166699234067
Energy: 0.5292873028746403
Energy: 0.5477274686051704
Energy: 0.5264346006140682
Energy: 0.49505018208409696
Energy: 0.5271879776498177
Energy: 0.5434003279239049
Energy: 0.5474468266347139
Energy: 0.5190917950712165
Energy: 0.4772075965006538
Energy: 0.5345475505350317
Energy: 0.537231457611713
Energy: 0.5530920631571647
Energy: 0.5343842524090412
Energy: 0.5048196399268794
Energy: 0.5253308797004975
Energy: 0.6025168620916794
Energy: 0.5310935730565972
Energy: 0.5343707771757629
Energy: 0.5044076016918951
Energy: 0.5109191592452748
Energy: 0.6040980673786178
Energy: 0.5170860011921605
Energy: 0.5039638856105145
Energy: 0.532585908364565
Energy: 0.5562578458174584
Energy: 0.5130750512319942
Energy: 0.5419132937602137
Energy: 0.5152855352288053
Energy: 0.5284907361716189
Energy: 0.5542162090813212
Energy: 0.5049094069794168
Energy: 0.5426400631352026
Energy: 0.5294808793949625
Energy: 0.5431659454147756
Energy: 0.49928244215083206
Energy: 0.48081804376477455
Energy: 0.5236271736031951
Energy: 0.5954234279526358
Energy: 0.5346078540902316
Energy: 0.498844562639578
Energy: 0.47905051169515095
Energy: 0.5193970440392341
Energy: 0.5263124683043463
Energy: 0.5093208241759989
Energy: 0.5067494323990984
Energy: 0.49957031489524695
Energy: 0.5108774121763426
Energy: 0.5254756070130315
Energy: 0.513882469911665
Energy: 0.4940983352465805
Energy: 0.5006329303413839
Energy: 0.5149580008104764
Energy: 0.5165344485686479
Energy: 0.5197753326038924
Energy: 0.5426540073787944
Energy: 0.5461870270834162
Energy: 0.5245349186077971
Energy: 0.5142948187985553
Energy: 0.5219328410697279
Energy: 0.5430358257650452
Energy: 0.555493803462444
Energy: 0.5199327590491134
Energy: 0.5386355576388832
Energy: 0.5044255518581019
Energy: 0.5044171179737483
Energy: 0.5372553659433444
Energy: 0.5387909151776386
Energy: 0.5329490002775444
Energy: 0.5042171750679257
Energy: 0.5042855304153713
Energy: 0.5361209259102683
Energy: 0.5387335875575165
Energy: 0.5484313786413307
Energy: 0.5477380195026673
Energy: 0.5236862553467239
Energy: 0.5340110660238454
Energy: 0.47064415330379256
Energy: 0.5381590348362651
Energy: 0.5306449986763447
Energy: 0.5190799480303149
Energy: 0.5365721530233034
Energy: 0.48222976467379597
Energy: 0.5628997561554205
Energy: 0.5338043072411454
Energy: 0.5684832692929271
Energy: 0.5015986896446577
Energy: 0.48796589238994603
Energy: 0.541723453043427
Energy: 0.539590122067674
Energy: 0.5504108212150817
Energy: 0.5012243784164889
Energy: 0.4835692136362713
Energy: 0.5319781457304286
Energy: 0.5369849960350728
Energy: 0.5243947679972553
Energy: 0.4772900610547866
Energy: 0.5351662897719542
Energy: 0.5273345003557222
Energy: 0.5480884961217958
Energy: 0.5386512314924038
Energy: 0.48306266535351816
Energy: 0.5344068908223741
Energy: 0.5192085637038891
Energy: 0.5238679469321933
Energy: 0.522852471863305
Energy: 0.4925582646066881
Energy: 0.541763188689533
Energy: 0.526546783977418
Energy: 0.5151213903564262
Energy: 0.5160146471871799
Energy: 0.5305176663108847
Energy: 0.5522489941552717
Energy: 0.5187236143200082
Energy: 0.5357511714453157
Energy: 0.5043838442198137
Energy: 0.5040445902407797
Energy: 0.5354413378562556
Energy: 0.5191144592511576
Energy: 0.5415984784492035
Energy: 0.5043532187621551
Energy: 0.5045646410813477
Energy: 0.5230010777695581
Energy: 0.47921838328468597
Energy: 0.5406277995139093
Energy: 0.5242448263767379
Energy: 0.5314543852947661
Energy: 0.539849353084871
Energy: 0.4958579561768926
Energy: 0.5475811827011168
Energy: 0.5304837528697398
Energy: 0.5411597235954868
Energy: 0.5322330454322628
Energy: 0.4975984743256208
Energy: 0.5377400891531182
Energy: 0.5457041392334968
Energy: 0.5629231919216753
Energy: 0.49732228799181494
Energy: 0.4900774707023877
Energy: 0.5332980269438834
Energy: 0.540070709091404
Energy: 0.49801863628861803
Energy: 0.5095590116965731
Energy: 0.5394693525524292
Energy: 0.5252683923034445
Energy: 0.5523475258951255
Energy: 0.5267760642852938
Energy: 0.49481147640707074
Energy: 0.545437415212163
Energy: 0.5253112218503747
Energy: 0.5395767161507053
Energy: 0.4889435841473238
Energy: 0.5031814637440741
Energy: 0.5189485653989164
Energy: 0.5384342897766553
Energy: 0.5246994098262131
Energy: 0.5405910542299861
Energy: 0.5183484579697375
Energy: 0.533168032331165
Energy: 0.5384915474266321
Energy: 0.5284161176719354
Energy: 0.5341058799409936
Energy: 0.5220293274171303
Energy: 0.5127568507566702
Energy: 0.5197913870790855
Energy: 0.5183663034659811
Energy: 0.5043727051413552
Energy: 0.5234990179248372
Energy: 0.5511122681548432
Energy: 0.518664706510004
Energy: 0.5108541280331362
Energy: 0.5044392800986247
Energy: 0.5291979824103331
Energy: 0.5232210918017317
Energy: 0.6046690603087291
Energy: 0.5479211426658611
Energy: 0.5404157450771158
Energy: 0.5378224020663255
Energy: 0.53970482047611
Energy: 0.5524257154197035
Energy: 0.5179720931711992
Energy: 0.5188719086307958
Energy: 0.5713075053478581

minimum gb energy = 0.46568137457577063 eV
minimum distance =  2.52745066274685 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

Energy: 0.8823602193321708
Energy: 0.4703128494854501
Energy: 0.49596749446784044
Energy: 0.46294824537255547
Energy: 0.45178332609008187
Energy: 0.5514564657686815
Energy: 0.46329346647112607
Energy: 0.48713381915694803
Energy: 0.47271394231738323
Energy: 0.45454549471684913
Energy: 0.49378695868031064
Energy: 0.48216485813425564
Energy: 0.4629187412251643
Energy: 0.4673994099383215
Energy: 0.46813311188064244
Energy: 0.5323209602090546
Energy: 0.4737676799387126
Energy: 0.47064187969108445
Energy: 0.47430063263678063
Energy: 0.4752061877327975
Energy: 0.47473344015415153
Energy: 0.4976085468261471
Energy: 0.6478428791938378
Energy: 0.47467846682862397
Energy: 0.5126747751217642
Energy: 0.4693603342208296
Energy: 0.4691758605582785
Energy: 0.4814240217063546
Energy: 0.475600348116044
Energy: 0.5162014985881004
Energy: 0.48562102698947496
Energy: 0.4671293855336593
Energy: 0.49687494270301097
Energy: 0.480346572482624
Energy: 0.49768231076860975
Energy: 0.49871406911369986
Energy: 0.4707673341962333
Energy: 0.4881786340041889
Energy: 0.4718773999779763
Energy: 0.5122874654391737
Energy: 0.5049145013595744
Energy: 0.4690447727800188
Energy: 0.4727147290652514
Energy: 0.46712365767163194
Energy: 0.46435611421956646
Energy: 0.5054893553307399
Energy: 0.48450763845798245
Energy: 0.464525661036998
Energy: 0.4675834730612263
Energy: 0.4667015403102306
Energy: 0.4609846583263788
Energy: 0.5338427454189285
Energy: 0.47387605457005244
Energy: 0.4852037756068826
Energy: 0.4831773899558274
Energy: 0.44582697507622854
Energy: 0.4926590979346256
Energy: 0.4744332172101004
Energy: 0.4933570811033265
Energy: 0.48361598680768936
Energy: 0.4819466333836042
Energy: 0.5071423524462985
Energy: 0.4708097309974478
Energy: 0.4785015036366515
Energy: 0.4946674155895626
Energy: 0.4717101274240967
Energy: 0.5109041925618422
Energy: 0.4635849737514588
Energy: 0.4914778430708646
Energy: 0.4909445398327834
Energy: 0.5194892827625677
Energy: 0.462672347317922
Energy: 0.46425480568009625
Energy: 0.46441777627595576
Energy: 0.5108193612354902
Energy: 0.4986566099055995
Energy: 0.4630367573998251
Energy: 0.4639654442110052
Energy: 0.5195047191233497
Energy: 0.5046706893189127
Energy: 0.5016187924617943
Energy: 0.5040692102697927
Energy: 0.4791654665864265
Energy: 0.4650340434244225
Energy: 0.4634477013920803
Energy: 0.5001066013295801
Energy: 0.5032158561051486
Energy: 0.47905386781524645
Energy: 0.46421673012046144
Energy: 0.4636095759974249
Energy: 0.49102099074400646
Energy: 0.4795162681071848
Energy: 0.5318802782395975
Energy: 0.4610952247190901
Energy: 0.4694619148661562
Energy: 0.48980694926026047
Energy: 0.47903325065586266
Energy: 0.5075260534047533
Energy: 0.46159557842298354
Energy: 0.46951332846395283
Energy: 0.5169562824807926
Energy: 0.4461161387376562
Energy: 0.5569993409942389
Energy: 0.4753711686856114
Energy: 0.5323457849346676
Energy: 0.48680809944979
Energy: 0.47112661816460943
Energy: 0.5167447633802514
Energy: 0.5175040741352276
Energy: 0.5325823907301755
Energy: 0.4816709180548132
Energy: 0.4792071352811478
Energy: 0.47011109431291614
Energy: 0.48437414466932693
Energy: 0.5107093077364686
Energy: 0.4808973924190705
Energy: 0.49012770952273943
Energy: 0.4726015566276448
Energy: 0.47985569229332153
Energy: 0.46916403074553004
Energy: 0.45581574746920583
Energy: 0.5347478048612323
Energy: 0.4603039033759395
Energy: 0.5402472882032211
Energy: 0.4791769312201899
Energy: 0.5024609929272693
Energy: 0.5013520551271117
Energy: 0.48247956005809634
Energy: 0.5427337550674867
Energy: 0.473419780407805
Energy: 0.46020531731080544
Energy: 0.48924834838816117
Energy: 0.4954521305392099
Energy: 0.4686155195229054
Energy: 0.4588695146441394
Energy: 0.46143375302541245
Energy: 0.5137958014777153
Energy: 0.5014068022087189
Energy: 0.4687259540580179
Energy: 0.45900733730891974
Energy: 0.46376968096043836
Energy: 0.48892208711829444
Energy: 0.5156847682903976
Energy: 0.4700320920756572
Energy: 0.4642444316176302
Energy: 0.48923530974003876
Energy: 0.49694938509473563
Energy: 0.515289126992299
Energy: 0.4699397611943559
Energy: 0.4641084570778216
Energy: 0.5978862234462291
Energy: 0.488743957547229
Energy: 0.47207123897228087
Energy: 0.5172974254019053
Energy: 0.4951409422508517
Energy: 0.5981785965117854
Energy: 0.4895929247390612
Energy: 0.4665908225375311
Energy: 0.4879005260711695
Energy: 0.48909715493732286
Energy: 0.4738865405613985
Energy: 0.4791234438963245
Energy: 0.46857972886226384
Energy: 0.4816756751661717
Energy: 0.48560327695636346
Energy: 0.4840830442161268
Energy: 0.4786091198001326
Energy: 0.47220189204454366
Energy: 0.4818429981931891
Energy: 0.48492705411801695
Energy: 0.45995747130070336
Energy: 0.5355646297705747
Energy: 0.5474951869534277
Energy: 0.4604928816509581
Energy: 0.48945304434071335
Energy: 0.4598685064924682
Energy: 0.5140600751465972
Energy: 0.4735625644089869
Energy: 0.46010215532160675
Energy: 0.4917498481296065
Energy: 0.4691824527405043
Energy: 0.5268820997903566
Energy: 0.5497219437708116
Energy: 0.4945003047046611
Energy: 0.4659911704533695
Energy: 0.46934243371806866
Energy: 0.5083511852168281
Energy: 0.5548020001661835
Energy: 0.4599953576330241
Energy: 0.46580542239196826
Energy: 0.4871435243279257
Energy: 0.53908679128575
Energy: 0.484433331025737
Energy: 0.4655417480002524
Energy: 0.4818093981534959
Energy: 0.4865863408264868
Energy: 0.47247052661269634
Energy: 0.5304892798822726
Energy: 0.46570660760388805
Energy: 0.4793806628248679
Energy: 0.47424620905493237
Energy: 0.5960769927422271
Energy: 0.47737561008096585
Energy: 0.4826498491172401
Energy: 0.4995837560208988
Energy: 0.47312888686605453
Energy: 0.49434045311059777
Energy: 0.4710144334677087
Energy: 0.5130658597186533
Energy: 0.4990295025821102
Energy: 0.4678442786016497
Energy: 0.5119943146395186
Energy: 0.49278732350837307
Energy: 0.49705541819718646
Energy: 0.4723176575422769
Energy: 0.467895148903969
Energy: 0.49059328082989795
Energy: 0.4966462224539742
Energy: 0.4793868518158469
Energy: 0.47229332959419285
Energy: 0.48127802454317986
Energy: 0.4855280179817192
Energy: 0.5178591122000262
Energy: 0.5041864164426249
Energy: 0.4702881508308299
Energy: 0.4851206682286535
Energy: 0.46801396214160995
Energy: 0.49486530309346016
Energy: 0.5197355037291476
Energy: 0.4679108035484133
Energy: 0.48946468139882376
Energy: 0.49432485739806076
Energy: 0.5012995088491888
Energy: 0.4907002919925334
Energy: 0.5034108945661178
Energy: 0.48972152688599774
Energy: 0.4943812400927423
Energy: 0.4762643818665131
Energy: 0.4900702220361679
Energy: 0.514970403201393
Energy: 0.494785330295622
Energy: 0.49609467453084816
Energy: 0.4967584661150859
Energy: 0.4844382994059903
Energy: 0.5614664561790875
Energy: 0.47766525448409314
Energy: 0.4960684197563481
Energy: 0.4862134077350034
Energy: 0.4837075111546363
Energy: 0.5616131144269486
Energy: 0.4648284310480316
Energy: 0.45767711852809856
Energy: 0.49374495538591906
Energy: 0.48288439894023616
Energy: 0.4643492984204613
Energy: 0.4645266541408887
Energy: 0.45768450040969316
Energy: 0.49355996017700204
Energy: 0.48233291717070975
Energy: 0.46459458509900453
Energy: 0.4629835848743591
Energy: 0.46990070272954715
Energy: 0.5046794968531794
Energy: 0.47910891166532127
Energy: 0.46463750201243886
Energy: 0.4641106792512929
Energy: 0.4694917846615604
Energy: 0.48903660826109124
Energy: 0.47915923105038005
Energy: 0.4637772873354662
Energy: 0.4832910789422375
Energy: 0.5407466234015053
Energy: 0.4756451893068491
Energy: 0.4676907001848882
Energy: 0.48324158492987945
Energy: 0.48174185423007243
Energy: 0.5405034398748759
Energy: 0.4630989649906346
Energy: 0.5342237476462044
Energy: 0.48230536521228456
Energy: 0.48001208612072777
Energy: 0.49278924285455467
Energy: 0.47944440986149117
Energy: 0.4737739656037815
Energy: 0.4728211256149442
Energy: 0.5262127196505899
Energy: 0.48478812858802195
Energy: 0.4740536282119949
Energy: 0.5160122704934471
Energy: 0.47298622480015795
Energy: 0.5410178738946502
Energy: 0.5000582538122952
Energy: 0.5025841163577118
Energy: 0.45705733821594025
Energy: 0.5002935171427221
Energy: 0.541102042406937
Energy: 0.5010154618605935
Energy: 0.5024200975929642
Energy: 0.45692552949812887
Energy: 0.5014437833609401
Energy: 0.4685563080587277
Energy: 0.45955801402452806
Energy: 0.49374736855713186
Energy: 0.5024902616351138
Energy: 0.48973024636617685
Energy: 0.4679661852812119
Energy: 0.45963227899730597
Energy: 0.495231094061742
Energy: 0.502945579673415
Energy: 0.49145114858776323
Energy: 0.46061950323719325
Energy: 0.4638231112714658
Energy: 0.4966445867915331
Energy: 0.5019109693394505
Energy: 0.5285610231749185
Energy: 0.4619631645898252
Energy: 0.464718342246371
Energy: 0.5033543385574601
Energy: 0.4929454934006462
Energy: 0.5557911261022718
Energy: 0.5000085008809033
Energy: 0.4573131705899738
Energy: 0.5966379444542115
Energy: 0.46144822029927185
Energy: 0.5509022644328495
Energy: 0.49926780575764823
Energy: 0.4572541586782776
Energy: 0.6123115470723494
Energy: 0.46108709821979266
Energy: 0.5815888395526746
Energy: 0.48592091483859184
Energy: 0.4713184823415196
Energy: 0.4641875557791691
Energy: 0.49649026871888063
Energy: 0.48890917936345046
Energy: 0.4849939429572359
Energy: 0.489500922907574
Energy: 0.46426822872963164
Energy: 0.5127468482052954
Energy: 0.47353845173347087
Energy: 0.48949655210957627
Energy: 0.48985319111074144
Energy: 0.46166365323134373
Energy: 0.5285063782159029
Energy: 0.4518545833249864
Energy: 0.4896420590946014
Energy: 0.490282226327865
Energy: 0.4608002831438391
Energy: 0.5605971406975061
Energy: 0.45168174993132926
Energy: 0.46555767146878146
Energy: 0.46670469824152105
Energy: 0.4691235505788231
Energy: 0.5183136416389312
Energy: 0.5393843438855123
Energy: 0.465214266761287
Energy: 0.4669177236278106
Energy: 0.4637541839453493
Energy: 0.5464947669251735
Energy: 0.5091528969460147
Energy: 0.46581968932011475
Energy: 0.4792380751723632
Energy: 0.4845395379738334
Energy: 0.4679834502388223
Energy: 0.49848882516241255
Energy: 0.4658860871842209
Energy: 0.4752080798601439
Energy: 0.4846066946865472
Energy: 0.47020941663963617
Energy: 0.49877756652576316
Energy: 0.46572473921088436
Energy: 0.49888037529891105
Energy: 0.47411458490178676
Energy: 0.46890309846351635
Energy: 0.48385065781544057
Energy: 0.4656830404591743
Energy: 0.4837870875833986
Energy: 0.46547078686649396
Energy: 0.468917513761098
Energy: 0.4818882643679366
Energy: 0.4784746282349396
Energy: 0.4719889570394783
Energy: 0.46819968326468114
Energy: 0.488098943120632
Energy: 0.5186493536320469
Energy: 0.47794036272968526
Energy: 0.4720736066496584
Energy: 0.46800190397364566
Energy: 0.4944185354376003
Energy: 0.46895099973381027
Energy: 0.45973183035663123
Energy: 0.46733633101718963
Energy: 0.46879069880662855
Energy: 0.46904647556610574
Energy: 0.5612969966695717
Energy: 0.4595208346390573
Energy: 0.4674362331248203
Energy: 0.48682161117202283
Energy: 0.46955800239464696
Energy: 0.5598081472648251
Energy: 0.4895994481271438
Energy: 0.4833962484400389
Energy: 0.4905955266844828
Energy: 0.506406808517618
Energy: 0.46887701378568536
Energy: 0.4898360580117839
Energy: 0.4832834048491388
Energy: 0.4879344886808386
Energy: 0.477816676270919
Energy: 0.4728070142045443
Energy: 0.47183326197288106
Energy: 0.47839699552876763
Energy: 0.49754521411962294
Energy: 0.5152410117362234
Energy: 0.464941349754427
Energy: 0.46816530272064716
Energy: 0.4798383544469951
Energy: 0.48189175351127045
Energy: 0.5161480136856613
Energy: 0.46232918926320443
Energy: 0.48336126786679917
Energy: 0.4646399815043237
Energy: 0.4648422110323986
Energy: 0.4719570175038459
Energy: 0.5018964880993817
Energy: 0.5057922867720643
Energy: 0.4641798424322874
Energy: 0.46482987437316
Energy: 0.5010188424744108
Energy: 0.5018819623338718
Energy: 0.4718919807988551
Energy: 0.4626710987938636
Energy: 0.4635194511052377
Energy: 0.4695760969962321
Energy: 0.490713415602634
Energy: 0.5592925771449655
Energy: 0.46418773123691504
Energy: 0.46397032199393695
Energy: 0.48802231402736945
Energy: 0.49142505783099893
Energy: 0.5220441037295553
Energy: 0.4630424154189268
Energy: 0.4677932450738572
Energy: 0.5212076958818813
Energy: 0.44579013282591395
Energy: 0.5219178579962315
Energy: 0.4633996245060266
Energy: 0.4683314648405989
Energy: 0.5179335126065528
Energy: 0.44568844945223346
Energy: 0.46634120870554746
Energy: 0.4893290369469296
Energy: 0.5547993802699928
Energy: 0.4835056004367239
Energy: 0.46145660373828523
Energy: 0.5539690327521253
Energy: 0.4892211585478041
Energy: 0.5596474223914591
Energy: 0.48300012607147963
Energy: 0.4648803930373737
Energy: 0.4593809383249504
Energy: 0.495310323950575
Energy: 0.5399049025140334
Energy: 0.47440683956453783
Energy: 0.5165379319000067
Energy: 0.45120128636762236
Energy: 0.4951885425530186
Energy: 0.5403096772347676
Energy: 0.5062874807275833
Energy: 0.5359854724385202
Energy: 0.4544242312141624
Energy: 0.5130127800276287
Energy: 0.46524072589069965
Energy: 0.4606143487817846
Energy: 0.523561237301143
Energy: 0.5001726739201384
Energy: 0.512140080666069
Energy: 0.4588181983033493
Energy: 0.46018913090726316
Energy: 0.5281323865710836
Energy: 0.49472635304257345
Energy: 0.46413364074760893
Energy: 0.4571069456608025
Energy: 0.45451340675586277
Energy: 0.5244192698765842
Energy: 0.4934870680326648
Energy: 0.4640878047495425
Energy: 0.4638577089977936
Energy: 0.4656065085350377
Energy: 0.5200021603327037
Energy: 0.4586325214497978
Energy: 0.5664490159770325
Energy: 0.47901941685969895
Energy: 0.4571473449633233
Energy: 0.48001201542526223
Energy: 0.47079110712328265
Energy: 0.5238806342156996
Energy: 0.49985094781661554
Energy: 0.5303830187680658
Energy: 0.489391440153633
Energy: 0.4629003503257631
Energy: 0.4787870338207171
Energy: 0.4992936428475805
Energy: 0.49545705266979934
Energy: 0.45111734823040534
Energy: 0.46462294486948313
Energy: 0.4809326515285647
Energy: 0.4829985272423352
Energy: 0.4878377955373362
Energy: 0.465820756504819
Energy: 0.5574174785171863
Energy: 0.4723834234980581
Energy: 0.4948010948982026
Energy: 0.4943104287741305
Energy: 0.5033867360447604
Energy: 0.5083991430728068
Energy: 0.46378117619368486
Energy: 0.4871196665941203
Energy: 0.4825177846266852
Energy: 0.4545764861505235

minimum gb energy = 0.44568844945223346 eV
minimum distance =  2.59757876945385 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.553903893993133
Energy: 0.4226680926303558
Energy: 0.4412821024873963
Energy: 0.4436869758575092
Energy: 0.40404430256161333
Energy: 0.5543976085921257
Energy: 0.4225223227330797
Energy: 0.4411818303035598
Energy: 0.44161387391454704
Energy: 0.40411798324673576
Energy: 0.45972234144601803
Energy: 0.44729584506003756
Energy: 0.4466068777552819
Energy: 0.4233784948416209
Energy: 0.4440724232107331
Energy: 0.4437945159135029
Energy: 0.44746087174014487
Energy: 0.4420748548357822
Energy: 0.42377740013663506
Energy: 0.4139911812477091
Energy: 0.42423547840245035
Energy: 0.44784293967531774
Energy: 0.4959902652211952
Energy: 0.44936510118629847
Energy: 0.4054891435057123
Energy: 0.42416911590318124
Energy: 0.4482639715926433
Energy: 0.4265537948464121
Energy: 0.4487943051885706
Energy: 0.40563747458439586
Energy: 0.4041733787778833
Energy: 0.4283310852749286
Energy: 0.44862431057282176
Energy: 0.4497521027997783
Energy: 0.5631800798826474
Energy: 0.4477459729115184
Energy: 0.42894321748663633
Energy: 0.44859501286334574
Energy: 0.449958919299023
Energy: 0.5630084920133099
Energy: 0.44653704226481367
Energy: 0.4377019305186772
Energy: 0.42299051174452035
Energy: 0.42511830467283357
Energy: 0.42461028208266915
Energy: 0.447242354103988
Energy: 0.43884379991112715
Energy: 0.4242298124204184
Energy: 0.4267018526705838
Energy: 0.45877752051886417
Energy: 0.4833196910713735
Energy: 0.5809874761269761
Energy: 0.42549030741805083
Energy: 0.43413279082376494
Energy: 0.46076036747951216
Energy: 0.4831270879379558
Energy: 0.5845918586177135
Energy: 0.42527953082793735
Energy: 0.4338325183366579
Energy: 0.4600715648523957
Energy: 0.447916852726995
Energy: 0.47556140047990864
Energy: 0.44511579583111893
Energy: 0.4577908174418565
Energy: 0.4369057140034923
Energy: 0.4500978232371637
Energy: 0.4744650738501387
Energy: 0.4445462361872099
Energy: 0.45944873232713906
Energy: 0.4368780078239746
Energy: 0.5088987935332969
Energy: 0.4222482084931578
Energy: 0.49814937903426854
Energy: 0.4979467961400247
Energy: 0.4449490503615198
Energy: 0.5668063030842618
Energy: 0.42224185665014136
Energy: 0.4974314034180452
Energy: 0.49759288419548664
Energy: 0.4729438182835214
Energy: 0.5949418849032428
Energy: 0.4435749830573183
Energy: 0.43986021058766667
Energy: 0.4260512057867899
Energy: 0.4225751123083335
Energy: 0.594140845680954
Energy: 0.44370311488439756
Energy: 0.4393799974813443
Energy: 0.4256779571555407
Energy: 0.4034069869535919
Energy: 0.4244357830267488
Energy: 0.44836959607626453
Energy: 0.4280477351138817
Energy: 0.44748104116556225
Energy: 0.457769850317889
Energy: 0.4126414794064143
Energy: 0.44819057705119314
Energy: 0.4278061431350445
Energy: 0.44779080519290376
Energy: 0.4594605008405622
Energy: 0.5023818149659278
Energy: 0.45118990397914804
Energy: 0.44914402714668616
Energy: 0.448209942313567
Energy: 0.5567396794609946
Energy: 0.4241968806592828
Energy: 0.42430301695155903
Energy: 0.4487003903686726
Energy: 0.4819570954114442
Energy: 0.5567264208633264
Energy: 0.4485398195591101
Energy: 0.4431537355787593
Energy: 0.4481918025459458
Energy: 0.4244114002445852
Energy: 0.4525811245545688
Energy: 0.44862859023351637
Energy: 0.4404093365209781
Energy: 0.4494872581780995
Energy: 0.42429397403964025
Energy: 0.44925748929103393
Energy: 0.4473538422823287
Energy: 0.4234794408346236
Energy: 0.423238470766299
Energy: 0.4392217575392945
Energy: 0.4408093246426418
Energy: 0.4473710732933552
Energy: 0.5086624324187233
Energy: 0.42369084289597636
Energy: 0.4400552263925047
Energy: 0.440120596501192
Energy: 0.42354469403343165
Energy: 0.5195583890606444
Energy: 0.44584912023694573
Energy: 0.4345912080722257
Energy: 0.4390650977907034
Energy: 0.42571884671643623
Energy: 0.5189936402800548
Energy: 0.4474140701834226
Energy: 0.4333402783488695
Energy: 0.43865992001357273
Energy: 0.5940778922184025
Energy: 0.4436172450670414
Energy: 0.44522712211004345
Energy: 0.44212659839978397
Energy: 0.4472520697441489
Energy: 0.5096750677917863
Energy: 0.44780107313720224
Energy: 0.44590992072189733
Energy: 0.4418227961088399
Energy: 0.4480500850110646

minimum gb energy = 0.4034069869535919 eV
minimum distance =  2.59918417426903 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.9101098122033593
Energy: 0.4589886564779031
Energy: 0.4229450090608666
Energy: 0.385190053656514
Energy: 0.40558292865767465
Energy: 0.36614219497435635
Energy: 0.40800103908744473
Energy: 0.4189354029333659
Energy: 0.4013129398080945
Energy: 0.3717166934682205
Energy: 0.3980453939834222
Energy: 0.41644521974097143
Energy: 0.38659523464765083
Energy: 0.3803492094454915
Energy: 0.3797383181709926
Energy: 0.3606981978750466
Energy: 0.4075918986435717
Energy: 0.40661903110801073
Energy: 0.40078840815183586
Energy: 0.4138581361763039
Energy: 0.385226690611547
Energy: 0.4293368243542975
Energy: 0.43018534520473645
Energy: 0.40161893300956925
Energy: 0.403185319974702
Energy: 0.3600873881810715
Energy: 0.4267613275758269
Energy: 0.4264887062104221
Energy: 0.4056835088622765
Energy: 0.4997795276657612
Energy: 0.39290112118117143
Energy: 0.4115910674167902
Energy: 0.3895522857644066
Energy: 0.38699328511395803
Energy: 0.42830161607328987
Energy: 0.39488754277485766
Energy: 0.39716756558466787
Energy: 0.3878472919413242
Energy: 0.3849368382134961
Energy: 0.4265777429478343
Energy: 0.45270362628714883
Energy: 0.38509323406563634
Energy: 0.3885003054436658
Energy: 0.4036968594726671
Energy: 0.4160027120087859
Energy: 0.4110354130232504
Energy: 0.3850863273112053
Energy: 0.39401321873661205
Energy: 0.397526392593731
Energy: 0.40544875810798187
Energy: 0.3961331015659133
Energy: 0.4769432482477783
Energy: 0.41415778558448085
Energy: 0.4640216062449606
Energy: 0.3779440558673873
Energy: 0.39642579240403725
Energy: 0.4759523752813287
Energy: 0.41082012320787936
Energy: 0.46414898066874327
Energy: 0.4096070790564443
Energy: 0.4220168063037197
Energy: 0.41860064276012393
Energy: 0.39007986759115076
Energy: 0.3774212249172716
Energy: 0.42059836767237685
Energy: 0.40152400707525754
Energy: 0.393621604966091
Energy: 0.392293145307419
Energy: 0.3874506661797882
Energy: 0.44434249775739537
Energy: 0.43798162876941676
Energy: 0.3896445146949075
Energy: 0.389366479205597
Energy: 0.4169876013334438
Energy: 0.42020266665634126
Energy: 0.41941391692963725
Energy: 0.39201370952854553
Energy: 0.3925926822590326
Energy: 0.39519098248638085
Energy: 0.42040937673574164
Energy: 0.4232542354608697
Energy: 0.4277772511418852
Energy: 0.4740277334709338
Energy: 0.4726834018069375
Energy: 0.4038159382714417
Energy: 0.4285556942433654
Energy: 0.41797442697307835
Energy: 0.4737276579531712
Energy: 0.4391255005973161
Energy: 0.3898963725180422
Energy: 0.40623927863706566
Energy: 0.39481522883162257
Energy: 0.39421967747936526
Energy: 0.4285140113264531
Energy: 0.4121399971607761
Energy: 0.4248583003518766
Energy: 0.40465950562238306
Energy: 0.3939271770730879
Energy: 0.40592802566194575
Energy: 0.40253706173294423
Energy: 0.37656880661590325
Energy: 0.39212650540144856
Energy: 0.3962669422317534
Energy: 0.41531144907603773
Energy: 0.4125996979820578
Energy: 0.3765419529812048
Energy: 0.3924251319175019
Energy: 0.394256281185106
Energy: 0.4157016542055909
Energy: 0.4179081621174391
Energy: 0.4015716977677047
Energy: 0.4093001959828197
Energy: 0.4315782787483631
Energy: 0.4012139553475987
Energy: 0.49757191353578806
Energy: 0.405735452942887
Energy: 0.415051685452935
Energy: 0.4388134033580719
Energy: 0.39786758513856474
Energy: 0.3995063462639311
Energy: 0.431492959654938
Energy: 0.42901197064417446
Energy: 0.42992337723535784
Energy: 0.36407497980597264
Energy: 0.3910461872559802
Energy: 0.43983111755123616
Energy: 0.43936194446958243
Energy: 0.4191754293840729
Energy: 0.3564782580571738
Energy: 0.380690510784505
Energy: 0.410236959099362
Energy: 0.4069453817687176
Energy: 0.3989584822141717
Energy: 0.3649348590440287
Energy: 0.37944265827874407
Energy: 0.4203575689300892
Energy: 0.3958014911424132
Energy: 0.3957976166183578
Energy: 0.35610831906505325
Energy: 0.35737574254781984
Energy: 0.428240388029376
Energy: 0.40107139723990415
Energy: 0.39587204858804836
Energy: 0.3936380340056582
Energy: 0.42099261873196847
Energy: 0.39931454337851024
Energy: 0.3917889362807907
Energy: 0.38185994226824077
Energy: 0.40231300484867843
Energy: 0.408934471546334
Energy: 0.4495075511683008
Energy: 0.40682474087774795
Energy: 0.40357643042275326
Energy: 0.37184068990957037
Energy: 0.4103940932643643
Energy: 0.4622006551209034
Energy: 0.39003790666497196
Energy: 0.4037963335765034
Energy: 0.3716839430462126
Energy: 0.40830781876431627
Energy: 0.42460451562830953
Energy: 0.38432600587111465
Energy: 0.3780267083171991
Energy: 0.40282657933258487
Energy: 0.4075868638754459
Energy: 0.3884462924594087
Energy: 0.3861682987250031
Energy: 0.3770690825536899
Energy: 0.40319859846312234
Energy: 0.40781400566258763
Energy: 0.3845963515748058
Energy: 0.3994125265651983
Energy: 0.4552694963068933
Energy: 0.43328428057123397
Energy: 0.4240243818129618
Energy: 0.3863274447616319
Energy: 0.4044654094424433
Energy: 0.4673837858749107
Energy: 0.40463118015278393
Energy: 0.396727349996554
Energy: 0.40571333910185853
Energy: 0.4170056356802481
Energy: 0.37776164592726996
Energy: 0.4071493424433685
Energy: 0.39716234877222273
Energy: 0.4267412583407101
Energy: 0.4418987484298754
Energy: 0.3777978211062335
Energy: 0.4025942919671609
Energy: 0.3958422876653815
Energy: 0.39494152430769974
Energy: 0.39186179148078726
Energy: 0.4424913014003294
Energy: 0.40578182818704644
Energy: 0.39109331772746064
Energy: 0.3929382680961707
Energy: 0.3904895297139955
Energy: 0.4113050044795877
Energy: 0.4211725676546846
Energy: 0.3938633752621338
Energy: 0.3922917215521843
Energy: 0.4378209614952449
Energy: 0.4094817902194255
Energy: 0.427528313418839
Energy: 0.3737176022266346
Energy: 0.3907826563790005
Energy: 0.4391448081634419
Energy: 0.43195574294646133
Energy: 0.4284980796837933
Energy: 0.39233704399684033
Energy: 0.4397100789015039
Energy: 0.47648776733174925
Energy: 0.4033940348116996
Energy: 0.37377594965576855
Energy: 0.3975385795187594
Energy: 0.4463033425053166
Energy: 0.4758216489690942
Energy: 0.4038356010161211
Energy: 0.4019227777289251
Energy: 0.42179582115050535
Energy: 0.39750430619007343
Energy: 0.4323736042922197
Energy: 0.4160466136771905
Energy: 0.42801795670780823
Energy: 0.3972682610375651
Energy: 0.3989227626926966
Energy: 0.41846430071075336
Energy: 0.4309131752963002
Energy: 0.4006215104135167
Energy: 0.39435243318387053
Energy: 0.39262042136652037
Energy: 0.41746969540513607
Energy: 0.37646911338414946
Energy: 0.37433915462742945
Energy: 0.3926167190035618
Energy: 0.39316157491605125
Energy: 0.4167530939968715
Energy: 0.4009029960646715
Energy: 0.3768590927490094
Energy: 0.39300388899554534
Energy: 0.4117815183892598
Energy: 0.4109096763978859
Energy: 0.3755130207014157
Energy: 0.4058229718904934
Energy: 0.40890111341064167
Energy: 0.4307299720265942
Energy: 0.40673529302116923
Energy: 0.46124745446043863
Energy: 0.40597333827505855
Energy: 0.4210173381887587
Energy: 0.4144918504898019
Energy: 0.36069616439106134
Energy: 0.35655936558164963
Energy: 0.38467577826495275
Energy: 0.4271620962306804
Energy: 0.4105002177988032
Energy: 0.36871545768486697
Energy: 0.36379448186120183
Energy: 0.43841446251587685
Energy: 0.43913411470809754
Energy: 0.38828157393730145
Energy: 0.3564841081668301
Energy: 0.3649249308502051
Energy: 0.4415817406872416
Energy: 0.41002336936474887
Energy: 0.3985495936565954
Energy: 0.3640429588783373
Energy: 0.3817886712451948
Energy: 0.4334514298208163
Energy: 0.39986942059573544
Energy: 0.4077542559223741
Energy: 0.49462994494436496
Energy: 0.3841642162681166
Energy: 0.43604094749262545
Energy: 0.3993626444945054
Energy: 0.40487336907443405
Energy: 0.5498336655424428
Energy: 0.40725555951876985
Energy: 0.43715396785180727
Energy: 0.3897955812493918
Energy: 0.40581404394607845
Energy: 0.3773128211038123
Energy: 0.40314211442646763
Energy: 0.43783733130172686
Energy: 0.4082256894290309
Energy: 0.404264195179254
Energy: 0.3775219254369556
Energy: 0.40560354372113905
Energy: 0.4300249091817379
Energy: 0.48470746465820463
Energy: 0.37310652563628877
Energy: 0.4643471148171862
Energy: 0.42668545100208
Energy: 0.4270148466263221
Energy: 0.3863287136186258
Energy: 0.37144547623601865
Energy: 0.402608749383682
Energy: 0.43771163682264946
Energy: 0.42593816297375914
Energy: 0.386332848023069
Energy: 0.4485977177096603
Energy: 0.4349657715229308
Energy: 0.412952997214179
Energy: 0.3841783652562853
Energy: 0.3986258852617505
Energy: 0.4389143447910926
Energy: 0.4354251011397993
Energy: 0.42738774995979345
Energy: 0.3854116529961205
Energy: 0.40404752648857567
Energy: 0.4274616051723934
Energy: 0.43040550701796587
Energy: 0.39823060178886976
Energy: 0.40706160175562345
Energy: 0.43558893247171804
Energy: 0.3780161178356137
Energy: 0.40852138300320384
Energy: 0.4163176599511806
Energy: 0.4054312264996587
Energy: 0.4048599844827119
Energy: 0.4447165724814128
Energy: 0.421442533577287
Energy: 0.514319609283307
Energy: 0.39277844728225586
Energy: 0.39232933275541715
Energy: 0.46924959149748435
Energy: 0.4211565354921487
Energy: 0.5118070357137365
Energy: 0.3927422504747695
Energy: 0.3901384064577861
Energy: 0.4064152381150353
Energy: 0.41329954552408954
Energy: 0.37383156460379424
Energy: 0.3936855307151255
Energy: 0.425454787238265
Energy: 0.41653480118265457
Energy: 0.4166121706671019
Energy: 0.3737200075651951
Energy: 0.3899826104954161
Energy: 0.4391506116699282
Energy: 0.4974747633869153
Energy: 0.3924965422136884
Energy: 0.39938290961505185
Energy: 0.4202638714715406
Energy: 0.4800295653830701
Energy: 0.4110196894944931
Energy: 0.3899130474501214
Energy: 0.4070768377923237
Energy: 0.41988531201063395
Energy: 0.47994605310906885
Energy: 0.420091798629423
Energy: 0.5647242995813307
Energy: 0.4050026358556348
Energy: 0.3954042455321367
Energy: 0.3929538043560148
Energy: 0.40240720301489563
Energy: 0.3769085901876874
Energy: 0.4015137458881103
Energy: 0.39666738819691977
Energy: 0.3948162103360638
Energy: 0.3763388426592079
Energy: 0.4119191443239491
Energy: 0.3941611290183335
Energy: 0.40288544738013143
Energy: 0.4170492408847622
Energy: 0.37703578690606715
Energy: 0.4120764217704825
Energy: 0.39415972243747055
Energy: 0.40256894301278473
Energy: 0.4199798590132603
Energy: 0.4011437750777368
Energy: 0.4253176002954391
Energy: 0.4146058494360458
Energy: 0.4104462613411208
Energy: 0.4154216549904554
Energy: 0.4111896518753325
Energy: 0.4011482792601827
Energy: 0.4100913675126846
Energy: 0.426785760839049
Energy: 0.4026046597079614
Energy: 0.5156458728212875
Energy: 0.3975840644788164
Energy: 0.4387675597166682
Energy: 0.4399482693503181
Energy: 0.38892367073753703
Energy: 0.460325165136344
Energy: 0.3713428758067917
Energy: 0.41640835919658475
Energy: 0.42188095780613694
Energy: 0.3733920435964063

minimum gb energy = 0.35610831906505325 eV
minimum distance =  2.62537147602649 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 0.33096191925864027
Energy: 0.36470050216999517
Energy: 0.4033835777324943
Energy: 0.28904816741957273
Energy: 0.18086713366798343
Energy: 0.1805108389183514
Energy: 0.22996049052674467
Energy: 0.3017919022426468
Energy: 0.3131297862605113
Energy: 0.28586961383468434
Energy: 0.3132866382100217
Energy: 0.3690622930684438
Energy: 0.3943086293853611
Energy: 0.34534216272671797
Energy: 0.31155667158509526
Energy: 0.2393550053624162
Energy: 0.2394929868981844
Energy: 0.37461334165854715
Energy: 0.3223031802907853
Energy: 0.2430961922877777
Energy: 0.2694995182126855
Energy: 0.3782933898603024
Energy: 0.42300565912351756
Energy: 0.2843697963372336
Energy: 0.21383589069002268
Energy: 0.2828498088021895
Energy: 0.25616656823881906
Energy: 0.3744410768010531
Energy: 0.3721343130542571
Energy: 0.221028912165386
Energy: 0.22071812843183355
Energy: 0.39127146099657517
Energy: 0.32028103520661433
Energy: 0.2817987069342841
Energy: 0.22020056440575236
Energy: 0.2228706985732037
Energy: 0.2839214709261443
Energy: 0.37962813544237445
Energy: 0.31709681776568593
Energy: 0.22031249374362202
Energy: 0.3651622531604634
Energy: 0.37499015333806074
Energy: 0.3213321564362953
Energy: 0.3161194006155071
Energy: 0.2804260141064625
Energy: 0.27958601249676557
Energy: 0.31709004935884366
Energy: 0.2973259306821528
Energy: 0.26202840338383665
Energy: 0.30679973299154195
Energy: 0.3061600592781367
Energy: 0.31717619666726765
Energy: 0.2653906458768145
Energy: 0.18163395711555633
Energy: 0.18453570757095547
Energy: 0.3638460839060407
Energy: 0.3459781485279257
Energy: 0.25186453307332096
Energy: 0.22088654427712376
Energy: 0.21416014259990954
Energy: 0.3299757258364821
Energy: 0.36628785287445614
Energy: 0.32613963042439487
Energy: 0.18207094706185628
Energy: 0.18630830453465844
Energy: 0.37886483106457514
Energy: 0.3382052871185913
Energy: 0.3013159780754987
Energy: 0.22223835117679328
Energy: 0.2886332534054163
Energy: 0.3307678219752264
Energy: 0.35190085017461453
Energy: 0.34907916963337665
Energy: 0.2728857097473582
Energy: 0.32045214474302663
Energy: 0.3532959306364825
Energy: 0.3227272800148683
Energy: 0.2915899162591896
Energy: 0.2820076145895938
Energy: 0.35213844915128995
Energy: 0.3418384514014209
Energy: 0.29250013000857156
Energy: 0.18044088540804692
Energy: 0.1814723601365832
Energy: 0.32960993084872686
Energy: 0.35117887842374906
Energy: 0.3200233777502477
Energy: 0.2227505418408256
Energy: 0.2209907971231297
Energy: 0.30344269737646284
Energy: 0.392154200459224
Energy: 0.30686122317014697
Energy: 0.17090478547049337
Energy: 0.3335516496749037
Energy: 0.2876456665309081
Energy: 0.37264813105885247
Energy: 0.37003262310385593
Energy: 0.21995326719261124
Energy: 0.32405437154692884
Energy: 0.38248226004798447
Energy: 0.3732297282111331
Energy: 0.3283684181801422
Energy: 0.2073381803860856
Energy: 0.32978139919950517
Energy: 0.37015555827306523
Energy: 0.3811471198258592
Energy: 0.1700536917029248
Energy: 0.18442876821291854
Energy: 0.35476774694457497
Energy: 0.34012859038126025
Energy: 0.2687390107567043
Energy: 0.2214090012801015
Energy: 0.22059481446127008
Energy: 0.37860585384479295
Energy: 0.36550730671083664
Energy: 0.2955381497252633
Energy: 0.18165753002567364
Energy: 0.1803576358415707
Energy: 0.32072109164965895
Energy: 0.4473292558134584
Energy: 0.39037438951126685
Energy: 0.3800112213930201
Energy: 0.34296334763468045
Energy: 0.3360022794584136
Energy: 0.4262905719940746
Energy: 0.375758131600073
Energy: 0.3202408184406125
Energy: 0.3434531581517697
Energy: 0.3574392261480017
Energy: 0.4121569489782189
Energy: 0.2029574743767273
Energy: 0.20471219896871806
Energy: 0.31717953545650396
Energy: 0.36037091745868116
Energy: 0.3987468592104861
Energy: 0.20159505439123865
Energy: 0.20262066478481006
Energy: 0.37361557940421697
Energy: 0.3629031029949015
Energy: 0.40117691082921303
Energy: 0.1856887359389242
Energy: 0.20276250702443072
Energy: 0.3366969135802537
Energy: 0.45033284922096184
Energy: 0.37398806332507484
Energy: 0.18508925518731664
Energy: 0.20179474312997256
Energy: 0.31445537142976415
Energy: 0.4096611703989205
Energy: 0.4084981522684504
Energy: 0.3204292088684327
Energy: 0.40748394556153883
Energy: 0.39604438678776976
Energy: 0.30384064774051395
Energy: 0.3401748401117201
Energy: 0.3557936216738032
Energy: 0.3714389126233256
Energy: 0.3592803312217404
Energy: 0.4324398375798924
Energy: 0.35833664630984846
Energy: 0.22229411484740286
Energy: 0.3508217231873924
Energy: 0.3849007803127547
Energy: 0.34278939403281866
Energy: 0.180157508554237
Energy: 0.18232055432638208
Energy: 0.3295082032128948
Energy: 0.3667222393285796
Energy: 0.4143223311289187
Energy: 0.2237493211465837
Energy: 0.2135759392789872
Energy: 0.3119013253871244
Energy: 0.7457631950095431
Energy: 0.30363162934387117
Energy: 0.3581348196767585
Energy: 0.1830427167872973
Energy: 0.34660497742822055
Energy: 0.44338759111220705
Energy: 0.41044948205686044
Energy: 0.3584678468042173
Energy: 0.3172610596576156
Energy: 0.3262669272945845
Energy: 0.41127942500204545
Energy: 0.29856139109384444
Energy: 0.1846753764507925
Energy: 0.36474109652280096
Energy: 0.34849409595010766
Energy: 0.40521158991783757
Energy: 0.3686471499371664
Energy: 0.18590683618264853
Energy: 0.2021285492986384
Energy: 0.41268524275041185
Energy: 0.3912646951562533
Energy: 0.3678947401019015
Energy: 0.20160242712936388
Energy: 0.2012350083508538
Energy: 0.3114936063777988
Energy: 0.3867896752484981
Energy: 0.2093250933133432
Energy: 0.20179942073262677
Energy: 0.3902695728531744
Energy: 0.35909957061033004
Energy: 0.29903288330675215
Energy: 0.3626219751234156
Energy: 0.3828660235320682
Energy: 0.38375258936625817
Energy: 0.4591529763963854
Energy: 0.3584216946679679
Energy: 0.3512442536854028
Energy: 0.30703130382286514
Energy: 0.3330856432580825
Energy: 0.385110172129558
Energy: 0.3419101809410954
Energy: 0.18291502266276807
Energy: 0.1712191695583608
Energy: 0.35576831559050426
Energy: 0.3027329913713371
Energy: 0.3215031460664076
Energy: 0.21451640652794304
Energy: 0.3272177780640366
Energy: 0.27607623632014966
Energy: 0.37456327779219856
Energy: 0.29023184483843617
Energy: 0.18376172692121895
Energy: 0.18066514165411013
Energy: 0.29290295662808613
Energy: 0.3451830417982117
Energy: 0.371053450661131
Energy: 0.2205813942509238
Energy: 0.22036726872066512
Energy: 0.37891514576291424
Energy: 0.3494215721056855
Energy: 0.29118284753130724
Energy: 0.327439542701246
Energy: 0.3335284943460828
Energy: 0.3672597452812343
Energy: 0.37098713781365916
Energy: 0.3663416864125224
Energy: 0.3100954207256549
Energy: 0.38419684656474457
Energy: 0.43118397055723623
Energy: 0.3318546203076015
Energy: 0.22016050546679242
Energy: 0.21541091944040672
Energy: 0.3097091684171456
Energy: 0.3910079076930331
Energy: 0.31880053009560455
Energy: 0.18144636555274815
Energy: 0.18565018741827694
Energy: 0.3068369701075761
Energy: 0.4080001533589365
Energy: 0.29729735207013713
Energy: 0.1995480328859346
Energy: 0.21485249373643098
Energy: 0.3348312655452811
Energy: 0.29654209156998534
Energy: 0.29923810867119344
Energy: 0.1829253745908134
Energy: 0.1841672383197034
Energy: 0.35214697550617197
Energy: 0.324825633690824
Energy: 0.3513095878290864
Energy: 0.3153623842514931
Energy: 0.3231525727495126
Energy: 0.35111851403567956
Energy: 0.34508873494549475
Energy: 0.32481609876310263
Energy: 0.3161237797200649
Energy: 0.3481835401535371
Energy: 0.3153319705995057
Energy: 0.334689162219952
Energy: 0.22076803386770477
Energy: 0.2208964166198305
Energy: 0.364447035679116
Energy: 0.33796146284305323
Energy: 0.3233427129718892
Energy: 0.18041116917744085
Energy: 0.18113307142452684
Energy: 0.36707217484641286
Energy: 0.40482631351085213
Energy: 0.2732998989598621
Energy: 0.27319558298762003
Energy: 0.19978003357183832
Energy: 0.3383980202005875
Energy: 0.43039677462652426
Energy: 0.3260245430985665
Energy: 0.2760398839464668
Energy: 0.29861980222834683
Energy: 0.3576041214373489
Energy: 0.2925122259298156
Energy: 0.2564159341218579
Energy: 0.23931067643936726
Energy: 0.3588752710534581
Energy: 0.38320659593550155
Energy: 0.37945255612851586
Energy: 0.2831461772203701
Energy: 0.21408832752513912
Energy: 0.28684768733381066
Energy: 0.34156298958500664
Energy: 0.3892796359912071
Energy: 0.1983894443407788
Energy: 0.22021120251949186
Energy: 0.29967277372779055
Energy: 0.4290624679369842
Energy: 0.28902672478642744
Energy: 0.21454340284153137
Energy: 0.22035874982516374
Energy: 0.3227482014844095
Energy: 0.3847157475332673
Energy: 0.3622937874885446
Energy: 0.3247254763507633
Energy: 0.32965246893780065
Energy: 0.35799294936105225
Energy: 0.4264388642139162
Energy: 0.24851640785005447
Energy: 0.23858975009105754
Energy: 0.3009488461891042
Energy: 0.28211123705500396
Energy: 0.35820587856148317
Energy: 0.35942341804467304
Energy: 0.28696164920594186
Energy: 0.30130724762398436
Energy: 0.2944929466080723
Energy: 0.2906836360558258
Energy: 0.3227178388465305
Energy: 0.18356964798418404
Energy: 0.3125064542941908
Energy: 0.3581104961773635
Energy: 0.38352346823546357
Energy: 0.2859033339106453

minimum gb energy = 0.1700536917029248 eV
minimum distance =  2.6347283041352 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.7449883474058401
Energy: 0.3485176700651371
Energy: 0.3868545431027409
Energy: 0.3556898682562833
Energy: 0.340253118103702
Energy: 0.3380176244786611
Energy: 0.3421073951533712
Energy: 0.37747982251697765
Energy: 0.3639297001883242
Energy: 0.36737905423393324
Energy: 0.3589329201727025
Energy: 0.3467239592235579
Energy: 0.3655810118567979
Energy: 0.36658300671087884
Energy: 0.33892691170892175
Energy: 0.33919343009936337
Energy: 0.3335266938586116
Energy: 0.3720156533477669
Energy: 0.3628992196914338
Energy: 0.369618535137185
Energy: 0.35449946602390137
Energy: 0.34612298699191957
Energy: 0.34564603564599505
Energy: 0.421886542815732
Energy: 0.3465496550741739
Energy: 0.3609070977886613
Energy: 0.34040175421807833
Energy: 0.3400211368594335
Energy: 0.35091131320836305
Energy: 0.34607448557420056
Energy: 0.3736718993437307
Energy: 0.3675985817448223
Energy: 0.38100873129718005
Energy: 0.351573659739505
Energy: 0.38438712799088526
Energy: 0.3878443324266438
Energy: 0.3737476771569611
Energy: 0.3782123208184897
Energy: 0.38678067739161753
Energy: 0.4606395010711459
Energy: 0.36120216528250665
Energy: 0.37410971436003565
Energy: 0.3822010961903428
Energy: 0.3594900304096932
Energy: 0.38564277127328994
Energy: 0.3657900753249025
Energy: 0.3775132712703503
Energy: 0.354676807649798
Energy: 0.35641462248258365
Energy: 0.3813540418262717
Energy: 0.36142091953072863
Energy: 0.3612084357302671
Energy: 0.42143486642927164
Energy: 0.3468801063658784
Energy: 0.36661230382912635
Energy: 0.36651389838982634
Energy: 0.3675999870561263
Energy: 0.39668580275373816
Energy: 0.34749907682549547
Energy: 0.36675205984026654
Energy: 0.41766343771334685
Energy: 0.41907209738597
Energy: 0.38012180841708193
Energy: 0.3844043010909178
Energy: 0.35801983661711395
Energy: 0.40916173142180673
Energy: 0.41955731011053954
Energy: 0.37994928806459377
Energy: 0.38392821691967677
Energy: 0.35661146171518326
Energy: 0.35615148712565714
Energy: 0.3620502169776965
Energy: 0.3593827217278336
Energy: 0.35666720360790244
Energy: 0.35590576092718446
Energy: 0.35594970762339767
Energy: 0.37110164949187324
Energy: 0.359650935148919
Energy: 0.3568112612129066
Energy: 0.3558922969977562
Energy: 0.35610972481962955
Energy: 0.3891850654364171
Energy: 0.3679658495238216
Energy: 0.3699807248330109
Energy: 0.37318267635863805
Energy: 0.35612485987985043
Energy: 0.3912243121300202
Energy: 0.367874754184475
Energy: 0.36687724986626014
Energy: 0.3557965459765923
Energy: 0.4720873579470608
Energy: 0.378252767099803
Energy: 0.3781210186208513
Energy: 0.3556622783193199
Energy: 0.35484774530715657
Energy: 0.41506918446581265
Energy: 0.3832209003016191
Energy: 0.6370523102325834
Energy: 0.3559093933798107
Energy: 0.3866334483731321
Energy: 0.35589264607111754
Energy: 0.36049424185258294
Energy: 0.3844386426930271
Energy: 0.3549956234819239
Energy: 0.3552165259796884
Energy: 0.36152877198635636
Energy: 0.3607160316472912
Energy: 0.3721635331211061
Energy: 0.35741864804716816
Energy: 0.355414684160922
Energy: 0.38707793513983185
Energy: 0.37068758870797563
Energy: 0.4244222060128138
Energy: 0.3555512815580857
Energy: 0.3471510370595566
Energy: 0.3875663983409405
Energy: 0.37066611019957196
Energy: 0.36965458083868313
Energy: 0.3553083190593087
Energy: 0.34641845542260014
Energy: 0.35980358764426384
Energy: 0.478579604653008
Energy: 0.35508969685019776
Energy: 0.37496709084774477
Energy: 0.3682858371971416
Energy: 0.369762208342393
Energy: 0.49410635883907045
Energy: 0.35501898377196217
Energy: 0.3744963385572251
Energy: 0.3476312029387168
Energy: 0.39768897084381666
Energy: 0.4530906586190051
Energy: 0.35496301399203145
Energy: 0.3555312808570933
Energy: 0.40344695494683236
Energy: 0.39152351731716156
Energy: 0.37051912126475606
Energy: 0.3549396999166982
Energy: 0.35548863087892696
Energy: 0.403740731290471
Energy: 0.3927447348833112
Energy: 0.3549861497315319
Energy: 0.4249608986060317
Energy: 0.3473100970565874
Energy: 0.37616292783610294
Energy: 0.39574863183740117
Energy: 0.358188491747037
Energy: 0.4252792665029953
Energy: 0.34823267613319875
Energy: 0.37593460266179063
Energy: 0.4262856585435453
Energy: 0.35485164811810715
Energy: 0.35602524980070305
Energy: 0.3692000106886418
Energy: 0.3615345690046111
Energy: 0.42423885901965414
Energy: 0.35819282930618607
Energy: 0.3576612473830404
Energy: 0.44745214225196617
Energy: 0.3951741402200096
Energy: 0.45141441807169597
Energy: 0.3551710371169205
Energy: 0.35597290286423816
Energy: 0.3773323523482345
Energy: 0.3824740249123564
Energy: 0.4105743560534844
Energy: 0.3565274343106218
Energy: 0.3575381739000665
Energy: 0.3651666585728302
Energy: 0.3943539438571683
Energy: 0.3530171985449677
Energy: 0.3862552011416186
Energy: 0.3683118619325218
Energy: 0.3685226432287047
Energy: 0.39198484733854594
Energy: 0.3512946402725504
Energy: 0.38785801878196385
Energy: 0.3690117901485655
Energy: 0.3662311985763858
Energy: 0.3925738388066757
Energy: 0.35439370198934883
Energy: 0.3497212834353589
Energy: 0.3711387091157042
Energy: 0.3559401904862333
Energy: 0.3785579670056574
Energy: 0.3514965888734628
Energy: 0.3444529991607113
Energy: 0.48533730410717474
Energy: 0.3572804290044482
Energy: 0.3731375891565149
Energy: 0.376792019684182
Energy: 0.3471109906252725
Energy: 0.35849374628530134
Energy: 0.3713256827304151
Energy: 0.38787882432940546
Energy: 0.3793259065546648
Energy: 0.34191892353876646
Energy: 0.3475972245182794
Energy: 0.40132453389577905
Energy: 0.40782775698965346
Energy: 0.36105864841178076
Energy: 0.3591181137530502
Energy: 0.34366522988897413
Energy: 0.3828594962133247
Energy: 0.3585895969681828
Energy: 0.3764928292743921
Energy: 0.3639178802132235
Energy: 0.40891821292004155
Energy: 0.3826901258688431
Energy: 0.3599465679701662
Energy: 0.357568011952899
Energy: 0.3818840945740694
Energy: 0.3499934978358986
Energy: 0.34384916417589884
Energy: 0.3659352602583972
Energy: 0.35828325068546013
Energy: 0.3833898451916555
Energy: 0.34461551955624514
Energy: 0.3418921949580714
Energy: 0.36434317187364373
Energy: 0.3460895957583561
Energy: 0.38434509873303385
Energy: 0.37713809581569746
Energy: 0.34422485452249046
Energy: 0.3437889234659984
Energy: 0.34699791742066854
Energy: 0.3841872361521231
Energy: 0.3848645217028215
Energy: 0.3424758666979497
Energy: 0.34255090375690583
Energy: 0.37408972742773977
Energy: 0.3469874465911176
Energy: 0.3633768525675967
Energy: 0.3807879074981581
Energy: 0.3503861874902978
Energy: 0.3676024556938234
Energy: 0.346919465763034
Energy: 0.3689866171775026
Energy: 0.3812662947459183
Energy: 0.36883958689663965
Energy: 0.3563983938067512
Energy: 0.3823561840391588
Energy: 0.36269279945598665
Energy: 0.374987703913212
Energy: 0.35346157649545445
Energy: 0.35649844315799806
Energy: 0.3640412601359952
Energy: 0.36415519948012126
Energy: 0.3809824505216124
Energy: 0.35905514541380057
Energy: 0.38396175767153173
Energy: 0.3769383225776172
Energy: 0.36357982779062586
Energy: 0.41106881601366074
Energy: 0.36929231540178553
Energy: 0.3680309558975879
Energy: 0.3774333605111011
Energy: 0.36617248260400403
Energy: 0.36460351361460086
Energy: 0.36925665802261937
Energy: 0.34623287256764135
Energy: 0.35624359413713097
Energy: 0.4180443751174663
Energy: 0.40729085516905517
Energy: 0.3782910464094826
Energy: 0.3465642590498031
Energy: 0.3564120472819699
Energy: 0.41764809992521806
Energy: 0.4094643475455562
Energy: 0.38062443789878037
Energy: 0.37438177616152607
Energy: 0.35682934205046807
Energy: 0.3560250396868146
Energy: 0.38953628579505883
Energy: 0.34673510098274146
Energy: 0.35695759140589384
Energy: 0.35601784859757735
Energy: 0.3567609867797202
Energy: 0.3900952695230965
Energy: 0.34642784168169594
Energy: 0.36961689096694844
Energy: 0.35666341628206166
Energy: 0.36834357652219635
Energy: 0.39062062328199704
Energy: 0.4165210309492631
Energy: 0.37662392256026517
Energy: 0.357180045442818
Energy: 0.37606679296905865
Energy: 0.37762764147361844
Energy: 0.3479578819376005
Energy: 0.355411243390947
Energy: 0.3763439779191796
Energy: 0.4147851289218464
Energy: 0.39822476378691785
Energy: 0.3553263461663969
Energy: 0.35521692614096245
Energy: 0.376610213102884
Energy: 0.40370641405949376
Energy: 0.41876596046335834
Energy: 0.355353347224128
Energy: 0.3551478348333482
Energy: 0.35574530478237026
Energy: 0.4039230743004042
Energy: 0.34769580795533117
Energy: 0.3732540898346673
Energy: 0.3549655311952253
Energy: 0.35565058215589324
Energy: 0.40554114493968313
Energy: 0.34787038703829676
Energy: 0.37295871002526915
Energy: 0.35732991620410975
Energy: 0.4328266185295372
Energy: 0.38886421094031665
Energy: 0.36945744447430606
Energy: 0.3552007102143416
Energy: 0.4189880639853605
Energy: 0.3670703303069757
Energy: 0.3889011622359551
Energy: 0.36068779483995617
Energy: 0.3556649993345408
Energy: 0.3565344874190976
Energy: 0.3472537939128729
Energy: 0.3864350404316156
Energy: 0.3554058688393254
Energy: 0.35745878350955446
Energy: 0.3851732478563711
Energy: 0.34762990443561315
Energy: 0.38440890930906146
Energy: 0.3550419479556213
Energy: 0.35749719206352065
Energy: 0.3556475199745441
Energy: 0.3801694467473542
Energy: 0.4401532105999179
Energy: 0.37563058877848193
Energy: 0.3552635784103562
Energy: 0.3559792705792828
Energy: 0.3550305893519855
Energy: 0.44011955378930595
Energy: 0.3685451198676738
Energy: 0.3552861332300049
Energy: 0.34966259476740014
Energy: 0.37986021676818926
Energy: 0.3843425777482188
Energy: 0.3583452880186878
Energy: 0.3660339850843922
Energy: 0.3693752220179794
Energy: 0.3803371954272651
Energy: 0.3783864763296857
Energy: 0.3560047523807195
Energy: 0.3662138607597225
Energy: 0.34587427442843577
Energy: 0.3984570990863033
Energy: 0.356654081998672
Energy: 0.35725460649906476
Energy: 0.35783614603364705
Energy: 0.35578868025984883
Energy: 0.3915867617161711
Energy: 0.35515501422957724
Energy: 0.3566759776654935
Energy: 0.3565072727702855
Energy: 0.368109835458103
Energy: 0.3539754910407175
Energy: 0.3874149957127824
Energy: 0.35714794687967594
Energy: 0.3463168092842325
Energy: 0.3724512946686246
Energy: 0.37215083493956586
Energy: 0.37155057915132744
Energy: 0.35552421286252034
Energy: 0.34581876336071926
Energy: 0.4193376068884765
Energy: 0.3722803284923921
Energy: 0.3507809638638942
Energy: 0.36933742229165595
Energy: 0.3678054459269761
Energy: 0.3659861092659322
Energy: 0.3884203034124596
Energy: 0.3529652626675915
Energy: 0.3778320587521607
Energy: 0.4582952099401609
Energy: 0.3705584889892177
Energy: 0.38355647368095397
Energy: 0.3503412512899872
Energy: 0.3447397670078779
Energy: 0.3574843833978632
Energy: 0.3742837236406807
Energy: 0.37986508316066125
Energy: 0.35227689549834473
Energy: 0.35081725404651315
Energy: 0.3564019466634704
Energy: 0.3846850664891035
Energy: 0.3860429052176834
Energy: 0.384887953427324
Energy: 0.34186080172243
Energy: 0.3477654266495398
Energy: 0.38055361540084004
Energy: 0.3863062441501064
Energy: 0.3796242088110952
Energy: 0.34445474865411885
Energy: 0.35817785414786574
Energy: 0.3746825940062837
Energy: 0.3674618486193034
Energy: 0.342773761123714
Energy: 0.3477967758246205
Energy: 0.340438930790141
Energy: 0.37291546909621265
Energy: 0.3672017398386272
Energy: 0.346400052134919
Energy: 0.35941918377092036
Energy: 0.4172812010082843
Energy: 0.3436484196162379
Energy: 0.3648299336620355
Energy: 0.3647000684790236
Energy: 0.34901038444915017
Energy: 0.3380358351415743
Energy: 0.34180818201139906
Energy: 0.36398769161607136
Energy: 0.3638746935005593
Energy: 0.36420234829994785
Energy: 0.3440292472423949
Energy: 0.34412585247428384
Energy: 0.3868240212101711
Energy: 0.3681765290861841
Energy: 0.3659967092871279
Energy: 0.38432942392951036
Energy: 0.3417819817071439
Energy: 0.38767916630457067
Energy: 0.368388811725314
Energy: 0.3664371655822031
Energy: 0.3440543841694446
Energy: 0.3535117163388272
Energy: 0.33109121495355376
Energy: 0.3668985851876578
Energy: 0.3955980714184019
Energy: 0.36966373815065506
Energy: 0.3540314016495015
Energy: 0.36602921576816994
Energy: 0.36814194990321353
Energy: 0.39309170015641726
Energy: 0.37220959417726496
Energy: 0.3886705306520105
Energy: 0.35970781899932075
Energy: 0.36484050223413245
Energy: 0.36419477737012435
Energy: 0.36573890486101734
Energy: 0.3681207915365682
Energy: 0.3568367476293109
Energy: 0.36908934095951007
Energy: 0.3627013558091491
Energy: 0.36478644976937774
Energy: 0.3799232940273287
Energy: 0.371793438106501
Energy: 0.3684684326304162
Energy: 0.39013619592729104
Energy: 0.3668518349650263
Energy: 0.38068985033789104
Energy: 0.3688909531467815
Energy: 0.36791068798324117
Energy: 0.38899831110838756
Energy: 0.3655676803307467
Energy: 0.4274904629801311
Energy: 0.3476457146459774
Energy: 0.35666902989467814
Energy: 0.3565606442803283
Energy: 0.41795187584245647
Energy: 0.43444239026990794
Energy: 0.3569051117506943
Energy: 0.35647845844279946
Energy: 0.3564504977102826
Energy: 0.4232666936430715
Energy: 0.35973233175878166
Energy: 0.3701588299785962
Energy: 0.3696896650693356
Energy: 0.3564331634770602
Energy: 0.4303302496050936
Energy: 0.3599847843507408
Energy: 0.3696179842182693
Energy: 0.35614214019636187
Energy: 0.35625659988744135
Energy: 0.4233299161302144
Energy: 0.3772476573765282
Energy: 0.34775864898660097
Energy: 0.4214253286260935
Energy: 0.3483150853419752
Energy: 0.38286587641521147
Energy: 0.37671951085483507
Energy: 0.34782116276026537
Energy: 0.446914980213347
Energy: 0.3487993703905204
Energy: 0.3897730140329317
Energy: 0.3599723034970742
Energy: 0.35525416231940204
Energy: 0.3551795666707663
Energy: 0.3637739691391933
Energy: 0.39441799108808673
Energy: 0.359742885240024
Energy: 0.3552073593853124
Energy: 0.3552491482609258
Energy: 0.4283528676192967
Energy: 0.39167500499896113
Energy: 0.3680097372396011
Energy: 0.38472512348109356
Energy: 0.35579109317478574
Energy: 0.47251103534288574
Energy: 0.4294156904537265
Energy: 0.3483897913498114
Energy: 0.3730160983061628
Energy: 0.35582579398793873
Energy: 0.44133909721286646
Energy: 0.4212988767462816
Energy: 0.3472381641578198
Energy: 0.36297617836332136
Energy: 0.36845070145744363
Energy: 0.3691594278538608
Energy: 0.38874656898961923
Energy: 0.34743105701278887
Energy: 0.3604437291482051
Energy: 0.3680145308723847
Energy: 0.3700019761837735
Energy: 0.38578584222747375
Energy: 0.3549611129472474
Energy: 0.3571449617577486
Energy: 0.3564196345537182
Energy: 0.3950797749806005
Energy: 0.3599144168388048
Energy: 0.35486197259884195
Energy: 0.3548492214194896
Energy: 0.3555193071199972
Energy: 0.39480424519115476
Energy: 0.3597067788436782
Energy: 0.37560875324322124
Energy: 0.3556634657834758
Energy: 0.3689557975571062
Energy: 0.3826305453652533
Energy: 0.45193494541703655
Energy: 0.3697031464472097
Energy: 0.35608918029185616
Energy: 0.36648656765716014
Energy: 0.3822634155001064
Energy: 0.41941763705982177
Energy: 0.36221634092093297
Energy: 0.36781551621575564
Energy: 0.4190501133815989
Energy: 0.3900602287780965
Energy: 0.36270327554615506
Energy: 0.3592588907141721
Energy: 0.3702323252585557
Energy: 0.42604948418433597
Energy: 0.3894006404019537
Energy: 0.35362673397674316
Energy: 0.35384989123340993
Energy: 0.35517993300633594
Energy: 0.35553066892216145
Energy: 0.36515294995072395
Energy: 0.3577568461001382
Energy: 0.35763078026762757
Energy: 0.35884682005145097
Energy: 0.3813159046188608
Energy: 0.36332242431668094
Energy: 0.35363165919990713
Energy: 0.34736294934219575
Energy: 0.3677779726699655
Energy: 0.39010664346549145
Energy: 0.38755623741141754
Energy: 0.42708433455761013
Energy: 0.3489317099930004
Energy: 0.3656575999026546
Energy: 0.3580837260033002
Energy: 0.45212285408677944
Energy: 0.4376228225625522
Energy: 0.3683862790359682
Energy: 0.3473826561905961
Energy: 0.41273602990937736
Energy: 0.3484451414837796
Energy: 0.3485682719705026
Energy: 0.3674820946852291
Energy: 0.3480670788809599
Energy: 0.4142551325816991
Energy: 0.3548055656089004
Energy: 0.3551643240761868
Energy: 0.35849856399245356
Energy: 0.3543033614294083
Energy: 0.3817429491014497
Energy: 0.3487131606530652
Energy: 0.3393436051575094
Energy: 0.33915736684425896
Energy: 0.38330247010716306
Energy: 0.38957201328603663
Energy: 0.3535989795057519
Energy: 0.3543319754247796
Energy: 0.38256130841688163
Energy: 0.34871717427706517
Energy: 0.3866456493245911
Energy: 0.3824574899944615
Energy: 0.33760594236530767
Energy: 0.3641185506317697
Energy: 0.3389110063266436
Energy: 0.3788358447120465
Energy: 0.3521941331297862
Energy: 0.3667131229465614

minimum gb energy = 0.33109121495355376 eV
minimum distance =  2.61180793514599 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 0.6762587257725783
Energy: 0.4395882008666465
Energy: 0.47723804161766903
Energy: 0.4300594458568863
Energy: 0.41624410931521777
Energy: 0.539081866764342
Energy: 0.440603925571837
Energy: 0.4782498809423279
Energy: 0.4596562672191052
Energy: 0.41867040004723655
Energy: 0.4373789593874073
Energy: 0.43075571297123894
Energy: 0.4176211754751579
Energy: 0.4308148409584666
Energy: 0.4390218858190735
Energy: 0.437517006479595
Energy: 0.43143248372527265
Energy: 0.4316167694830079
Energy: 0.43065119637954397
Energy: 0.4521058943205327
Energy: 0.46197714910568716
Energy: 0.4299709718783696
Energy: 0.4309171320243942
Energy: 0.4410362316657726
Energy: 0.4355520250885005
Energy: 0.4311128591316715
Energy: 0.4301440920653636
Energy: 0.4311177713154488
Energy: 0.43998812106805807
Energy: 0.4346513892461935
Energy: 0.5147180651970108
Energy: 0.4565998114421599
Energy: 0.4410349582973708
Energy: 0.4434548682503442
Energy: 0.4362960053265421
Energy: 0.45534999957280364
Energy: 0.45644026883232136
Energy: 0.4410352925044426
Energy: 0.4417400526665084
Energy: 0.42707830196295016
Energy: 0.4375142271840154
Energy: 0.4393856571456774
Energy: 0.4029933753419672
Energy: 0.43775683331332466
Energy: 0.437393190725553
Energy: 0.43802405536129313
Energy: 0.4036232416135491
Energy: 0.40303477486198097
Energy: 0.4380853117025954
Energy: 0.43765514251728865
Energy: 0.4372099883110114
Energy: 0.4409423904923154
Energy: 0.5168964479959236
Energy: 0.4584613961588176
Energy: 0.42891742881758843
Energy: 0.4373181695392499
Energy: 0.44230563029294656
Energy: 0.5159959819407232
Energy: 0.45832981053165256
Energy: 0.42920007161233154
Energy: 0.41596259351550247
Energy: 0.5384096467271081
Energy: 0.439401344267439
Energy: 0.43872502515635176
Energy: 0.4380031749610323
Energy: 0.5887182502693177
Energy: 0.5395340565242926
Energy: 0.4393023124712032
Energy: 0.47487726421241333
Energy: 0.4375206682589338
Energy: 0.4388182183147701
Energy: 0.45060490481892007
Energy: 0.45487474290442814
Energy: 0.4442160897638041
Energy: 0.4382842990988273
Energy: 0.42944967582324534
Energy: 0.4505345428485928
Energy: 0.4562880385933657
Energy: 0.4430242809998758
Energy: 0.4389939755379836
Energy: 0.4155334736430944
Energy: 0.4528040474727608
Energy: 0.44013198712767565
Energy: 0.44098589665382903
Energy: 0.4376995328502395
Energy: 0.4156046642525142
Energy: 0.43144813412775823
Energy: 0.440674738865723
Energy: 0.44072309320143577
Energy: 0.4371542672001965

minimum gb energy = 0.4029933753419672 eV
minimum distance =  2.61404882540304 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 0.6321635742231594
Energy: 0.5257870538161546
Energy: 0.5193067474021605
Energy: 0.4924364356723275
Energy: 0.4884249439961658
Energy: 0.6321481185427534
Energy: 0.5093908348599075
Energy: 0.5027021686909966
Energy: 0.49117028497912074
Energy: 0.4891812288356007
Energy: 0.5825091363300212
Energy: 0.5013823081825884
Energy: 0.4832632183047481
Energy: 0.48371135543702876
Energy: 0.49380483990665586
Energy: 0.5609289538144935
Energy: 0.5008801195262632
Energy: 0.48284373495749255
Energy: 0.48577511817090235
Energy: 0.514441634944108
Energy: 0.5582536755180688
Energy: 0.5005567061846953
Energy: 0.5006493418917627
Energy: 0.48026375029926305
Energy: 0.5223929635550455
Energy: 0.5512891107727529
Energy: 0.5275664166744573
Energy: 0.5004864960193293
Energy: 0.4801698426049256
Energy: 0.5927833070390299
Energy: 0.5198876863259645
Energy: 0.5070542360605839
Energy: 0.6282348000897425
Energy: 0.5519069334405552
Energy: 0.5911831110970943
Energy: 0.5682095546714349
Energy: 0.5074281705136305
Energy: 0.6297318096436544
Energy: 0.5583190336795051
Energy: 0.5914432516297741
Energy: 0.5100218018703258
Energy: 0.6342667790168722
Energy: 0.5550964588163962
Energy: 0.5448556286382125
Energy: 0.49756445043652636
Energy: 0.5091529510005074
Energy: 0.6320772718041289
Energy: 0.6073460961078854
Energy: 0.4876637398017356
Energy: 0.5027584625496785
Energy: 0.499471453780432
Energy: 0.5888486375611154
Energy: 0.5006360008100285
Energy: 0.48366881605813433
Energy: 0.5016494945730438
Energy: 0.49925809392927895
Energy: 0.6118268161260854
Energy: 0.4792777452922232
Energy: 0.4820715927997179
Energy: 0.5030899294276344
Energy: 0.5028202886695793
Energy: 0.6708179126214199
Energy: 0.5114557544249262
Energy: 0.47908454270368084
Energy: 0.47971094184749885
Energy: 0.5882346364405497
Energy: 0.6711333853395605
Energy: 0.5115358590589997
Energy: 0.4789303741465032
Energy: 0.48251390079136125
Energy: 0.49912981610776685
Energy: 0.5101235997782186
Energy: 0.5244630363521801
Energy: 0.4928359372124069
Energy: 0.5298822381025619
Energy: 0.49857535536437053
Energy: 0.51087332851618
Energy: 0.5256312842455579
Energy: 0.4914548038603158
Energy: 0.5144222362394855
Energy: 0.49962350154028223
Energy: 0.5355290924161489
Energy: 0.5254732445293234
Energy: 0.5303650398891097
Energy: 0.5181299758523066
Energy: 0.5232849998963582
Energy: 0.5336810349935975
Energy: 0.5240454999497415
Energy: 0.526438221217599
Energy: 0.4827484118524668
Energy: 0.5228194128213841
Energy: 0.5391135968845828
Energy: 0.5768720857668805
Energy: 0.5311515557544747
Energy: 0.5397584442342775
Energy: 0.5247947375645754
Energy: 0.5284771215411228
Energy: 0.504706997824653
Energy: 0.5906985314461661
Energy: 0.5474025697630696
Energy: 0.4788553680619596
Energy: 0.5036671175749413
Energy: 0.6336621992531751
Energy: 0.6263094845621071
Energy: 0.573831187096132
Energy: 0.4790013932969318
Energy: 0.5033447989353304
Energy: 0.6317244137577841
Energy: 0.5712851365811906
Energy: 0.6129365855900558
Energy: 0.47927676652624446
Energy: 0.48003054713977866
Energy: 0.5329363692027865
Energy: 0.47961606074465923
Energy: 0.4848466057509689
Energy: 0.4796243879241609
Energy: 0.5008813882350415
Energy: 0.5328740397233973
Energy: 0.47929301202667046
Energy: 0.4850955658408657
Energy: 0.47886711916039876
Energy: 0.5220700076143835
Energy: 0.6670583157993099
Energy: 0.5036063428630141
Energy: 0.4843976215822837
Energy: 0.4770850513285592
Energy: 0.6366792033255733
Energy: 0.6421765247056306
Energy: 0.5029265757106515
Energy: 0.4843513714958025
Energy: 0.5652401850182124
Energy: 0.6429195089320973
Energy: 0.6356097435370972
Energy: 0.5173883678387057
Energy: 0.546584080349833
Energy: 0.5735520599229836
Energy: 0.6424189111317846
Energy: 0.6361715940139209
Energy: 0.5073022246929696
Energy: 0.5569042378716912
Energy: 0.5314617536066433
Energy: 0.536897139961029
Energy: 0.5250357963978158
Energy: 0.5652537483752125
Energy: 0.5563964511900708
Energy: 0.5451653804797074
Energy: 0.5331141660750954
Energy: 0.5772487451084213
Energy: 0.5669658951698344
Energy: 0.556211298237232
Energy: 0.4804110650854646
Energy: 0.5239847053477257
Energy: 0.5244129313266522
Energy: 0.5346980368085489
Energy: 0.5034893350975629
Energy: 0.5237287965642051
Energy: 0.5258791242499108
Energy: 0.5250786951772045
Energy: 0.5280943547186644
Energy: 0.5184857833756538
Energy: 0.5348556003271825
Energy: 0.5007647205938889
Energy: 0.5091132352986111
Energy: 0.6249967159204273
Energy: 0.48935801951756724
Energy: 0.5311274889795136
Energy: 0.5016410758887883
Energy: 0.5093016433965802
Energy: 0.6248083879005221
Energy: 0.48920679064966116
Energy: 0.5033988949366587
Energy: 0.4816533700130727
Energy: 0.5092338677140067
Energy: 0.5500095826094524
Energy: 0.5020133735849445
Energy: 0.48142079982422076
Energy: 0.48270452594821406
Energy: 0.5095679725599962
Energy: 0.5513357002307512
Energy: 0.5019824273069914
Energy: 0.4998233472087952
Energy: 0.4796336889220403
Energy: 0.5185971699057315
Energy: 0.6722249167388693
Energy: 0.51563988148872
Energy: 0.500081077520687
Energy: 0.47926338165246496
Energy: 0.5206287955391701
Energy: 0.6434412662528388
Energy: 0.532711445828706
Energy: 0.4880664076534603
Energy: 0.5918799153050762
Energy: 0.597203603073522
Energy: 0.5924262103427306
Energy: 0.510889892186227
Energy: 0.5551375845745525
Energy: 0.5472205179148938
Energy: 0.5951325818845127
Energy: 0.5621401820854343
Energy: 0.5109252657313117
Energy: 0.5550414619204462
Energy: 0.55789235320324
Energy: 0.49767132661173075
Energy: 0.5006018758795553
Energy: 0.5101261303029775
Energy: 0.561706409281591
Energy: 0.5184126892773187
Energy: 0.4971698574997296
Energy: 0.5103714065339058
Energy: 0.5642867894451928
Energy: 0.49800921219382804
Energy: 0.47903308637936287
Energy: 0.5089200663994541
Energy: 0.49980352587448684
Energy: 0.5285343331184004
Energy: 0.5206848158443127
Energy: 0.47892327586237404
Energy: 0.4985052282286799
Energy: 0.5004321841271492
Energy: 0.5891978426142592
Energy: 0.5030635412540228
Energy: 0.5117308336398454
Energy: 0.4783152658215519
Energy: 0.48117613477077115
Energy: 0.592348184798115
Energy: 0.5108689595450043
Energy: 0.4751278816047811
Energy: 0.47846460074007024
Energy: 0.4808238438474141
Energy: 0.6386124584518413
Energy: 0.5246407359276051
Energy: 0.4806771140155551
Energy: 0.49523538649303567
Energy: 0.5106401673214276
Energy: 0.6697021016417585
Energy: 0.524367651522802
Energy: 0.506770048025668
Energy: 0.526468721474919
Energy: 0.5115431774217076
Energy: 0.5927048136457392
Energy: 0.5750477307910533
Energy: 0.5311359276865897
Energy: 0.5052890880394452
Energy: 0.5280394812979473
Energy: 0.5968578337140725
Energy: 0.5463581506757357
Energy: 0.529184641313415
Energy: 0.5046756373934809
Energy: 0.5279633908381333
Energy: 0.5959323272804367
Energy: 0.5365716556834224
Energy: 0.5387530392948292
Energy: 0.5361126163175368
Energy: 0.5262366314294715
Energy: 0.5914116855314323
Energy: 0.5348798666468625
Energy: 0.5361126438381447
Energy: 0.5357412907473503
Energy: 0.5248705719767132
Energy: 0.5401797760697064
Energy: 0.4887380073576344
Energy: 0.631375621946783
Energy: 0.5039443041794778
Energy: 0.47881675016800285
Energy: 0.5037387093272184
Energy: 0.5721733442019756
Energy: 0.6322372352752625
Energy: 0.5047060321609317
Energy: 0.47924690369941775
Energy: 0.5042337653463692
Energy: 0.5044387903360444
Energy: 0.5053740651750321
Energy: 0.4778404784847227
Energy: 0.4812611029782163
Energy: 0.48015020320658947
Energy: 0.5042953562806317
Energy: 0.5095953501004894
Energy: 0.4777567112936839
Energy: 0.4796031030019239
Energy: 0.500537596664658
Energy: 0.5617995069487782
Energy: 0.5034960014722668
Energy: 0.48545101846670646
Energy: 0.4784678048591421
Energy: 0.4966641166941215
Energy: 0.5885328567276349
Energy: 0.5041254015153799
Energy: 0.4844982190488818
Energy: 0.48915542162030845
Energy: 0.4968312177929466
Energy: 0.5912578418530575
Energy: 0.5320813964290201
Energy: 0.5411775586073487
Energy: 0.6013668534113844
Energy: 0.5193130435701523
Energy: 0.5917187479032274
Energy: 0.5216010940943017
Energy: 0.5491436047549906
Energy: 0.5674386067789041
Energy: 0.5533668396633121
Energy: 0.5272405032814664
Energy: 0.5343527330714806
Energy: 0.558071080767322
Energy: 0.5568018791559313
Energy: 0.5282081897183404
Energy: 0.5240259240394208
Energy: 0.5371504532578101
Energy: 0.5591723559785705
Energy: 0.5569701652651894
Energy: 0.5206617205018133
Energy: 0.5330236643956067
Energy: 0.5238576392790613
Energy: 0.5326362506538825
Energy: 0.4806408589516085
Energy: 0.5244329115444851
Energy: 0.5247590793094036
Energy: 0.5578922478975296
Energy: 0.5308617118857158
Energy: 0.4826182953517591
Energy: 0.5243957184885972
Energy: 0.5189452786890332
Energy: 0.5264888930018107
Energy: 0.6291935579576082
Energy: 0.5094504253743926
Energy: 0.5294148565781993
Energy: 0.5186354502106065
Energy: 0.49807184681775113
Energy: 0.6303262448299839
Energy: 0.5372927815330049
Energy: 0.5256651670736623
Energy: 0.49383267826573735
Energy: 0.5135484865955825
Energy: 0.5689877269037241
Energy: 0.5086823469369652
Energy: 0.48324924937756175
Energy: 0.5094605045714838
Energy: 0.5527750658383476
Energy: 0.5474730330464717
Energy: 0.507772559664463
Energy: 0.4828931679074593
Energy: 0.4803145302723483
Energy: 0.5213585810537644
Energy: 0.5105628521771766
Energy: 0.5255701456019299
Energy: 0.47580288304315244
Energy: 0.474133690369457
Energy: 0.5928126653243957
Energy: 0.510520788234349
Energy: 0.5257004277538935
Energy: 0.47976211615819864
Energy: 0.5540298971612487
Energy: 0.5970922469709067
Energy: 0.5103547983179756
Energy: 0.5034286662803406
Energy: 0.5964316653945465
Energy: 0.59274831755962
Energy: 0.5977276530700226
Energy: 0.5100577485133592
Energy: 0.4985862237592893
Energy: 0.614808613421438
Energy: 0.5779838240899041
Energy: 0.5021993819214837
Energy: 0.510984852613866
Energy: 0.5589506049159647
Energy: 0.5727445362911543
Energy: 0.5970249564384915
Energy: 0.5037457017299222
Energy: 0.5101831750675795
Energy: 0.5579038186914106
Energy: 0.5721571605815708
Energy: 0.4795461560269859
Energy: 0.5010316030448101
Energy: 0.5099449441916869
Energy: 0.5976544623912182
Energy: 0.4791902363007852
Energy: 0.4794223639366344
Energy: 0.5237471440586242
Energy: 0.5098066680508592
Energy: 0.5237659067646171
Energy: 0.47880219784774963
Energy: 0.483592516028927
Energy: 0.5073741136867352
Energy: 0.5746184879190841
Energy: 0.6048941336981638
Energy: 0.4991904705698963
Energy: 0.4839946781928308
Energy: 0.5068974595727275
Energy: 0.5750841984098666
Energy: 0.5387958119048097
Energy: 0.4988698334896501
Energy: 0.5225288681383281
Energy: 0.5171070196163242
Energy: 0.6690173256427181
Energy: 0.5540998988279806
Energy: 0.5180358915678543
Energy: 0.5280181845873121
Energy: 0.5112303246995461
Energy: 0.6682180527971932
Energy: 0.576971968439921
Energy: 0.5178229351465167
Energy: 0.49396999939007297
Energy: 0.48235552860289593
Energy: 0.5315574315527688
Energy: 0.5788966530622974
Energy: 0.5231483239941365
Energy: 0.4944888537840146
Energy: 0.4813609328277635
Energy: 0.5880169830870631
Energy: 0.5780225723264193
Energy: 0.5240921991943766
Energy: 0.5268260435209585
Energy: 0.5630675713483673
Energy: 0.5270073118907631
Energy: 0.5364800449601327
Energy: 0.5245743030505448
Energy: 0.5270769942332445
Energy: 0.5231015877736265
Energy: 0.5301888664342788
Energy: 0.534840983836995
Energy: 0.5281839214806563
Energy: 0.4899158167348201
Energy: 0.5944227573577009
Energy: 0.4798296679062963
Energy: 0.526391172132582
Energy: 0.6281356951903748
Energy: 0.4897857784340098
Energy: 0.5925052224679729
Energy: 0.48008521683133965
Energy: 0.5207216519784863
Energy: 0.6288306303749654
Energy: 0.4787026530232188
Energy: 0.48190894149452396
Energy: 0.48419820219364623
Energy: 0.5044272984476709
Energy: 0.5737545702377517
Energy: 0.47800100375459564
Energy: 0.4844547168436461
Energy: 0.48315058958102064
Energy: 0.5051305749213412
Energy: 0.547658283749167
Energy: 0.47851614955633226
Energy: 0.47931758927761214
Energy: 0.478763721558741
Energy: 0.5187784697217571
Energy: 0.5026995676244744
Energy: 0.48680737323789514
Energy: 0.48086853894246695
Energy: 0.47850773014039105
Energy: 0.49807034221506863
Energy: 0.5028696432766555
Energy: 0.47979180582107345
Energy: 0.5380362455591249
Energy: 0.5038997188681946
Energy: 0.5941914169889994
Energy: 0.5540201000793317
Energy: 0.47975679736246984
Energy: 0.5419299687188723
Energy: 0.5028904633898643
Energy: 0.5938051168122931
Energy: 0.5547668026439345
Energy: 0.5741694788573289
Energy: 0.5619429099992026
Energy: 0.5364394730201076
Energy: 0.5377677166253005
Energy: 0.561111496811027
Energy: 0.5488092632951209
Energy: 0.5618382635390177
Energy: 0.5367795984730012
Energy: 0.5268969325478757
Energy: 0.5336276379762049
Energy: 0.5830459001152501
Energy: 0.512483582991331
Energy: 0.5238326857771228
Energy: 0.5288215269602538
Energy: 0.5783293738317155
Energy: 0.5969009364731422
Energy: 0.5263631356556353
Energy: 0.5217550455909385
Energy: 0.5309864923170979
Energy: 0.5753869931136243
Energy: 0.6254412177210686
Energy: 0.5108633244655169
Energy: 0.532355504136812
Energy: 0.5249142795500642
Energy: 0.5110477797551602
Energy: 0.6249480556745142
Energy: 0.5106871496581658
Energy: 0.5307814067810592
Energy: 0.5264756370083951
Energy: 0.5280337890155357

minimum gb energy = 0.474133690369457 eV
minimum distance =  2.60171362887415 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

Energy: 0.6083290314154051
Energy: 0.5182931187889293
Energy: 0.5163949953359205
Energy: 0.47927309541975205
Energy: 0.4642380627625998
Energy: 0.6005794197490878
Energy: 0.4801092444868986
Energy: 0.49553218342376093
Energy: 0.4792618894822735
Energy: 0.6255446230265619
Energy: 0.5738628158681762
Energy: 0.5199864473813135
Energy: 0.4764544539993419
Energy: 0.47662783806006664
Energy: 0.4803343390969817
Energy: 0.5308602196328496
Energy: 0.5192854724791609
Energy: 0.4769624843294819
Energy: 0.4790719244546659
Energy: 0.4728405221499722
Energy: 0.5607121448278083
Energy: 0.5173036696421015
Energy: 0.48013696822538954
Energy: 0.4774855572904015
Energy: 0.5468164717844408
Energy: 0.5602745170550824
Energy: 0.5169546563407682
Energy: 0.4800260255497615
Energy: 0.4763226240556775
Energy: 0.5465085370304777
Energy: 0.5237431691766813
Energy: 0.4782717000284926
Energy: 0.6045969584594683
Energy: 0.5366066960170094
Energy: 0.5465156870484726
Energy: 0.5653263792951772
Energy: 0.5155245013333658
Energy: 0.6037830592215646
Energy: 0.5361867434722013
Energy: 0.5464526316008755
Energy: 0.5353730437716776
Energy: 0.6035698915907051
Energy: 0.6047434818605368
Energy: 0.4841872521211528
Energy: 0.48090697818160744
Energy: 0.5334604977372512
Energy: 0.603191286686515
Energy: 0.6048562245558418
Energy: 0.4798538663863263
Energy: 0.4822187725598914
Energy: 0.5204713928183478
Energy: 0.5495917487936303
Energy: 0.4769277718668664
Energy: 0.4762235497862639
Energy: 0.4809530979707191
Energy: 0.5204188234879413
Energy: 0.5166469779238256
Energy: 0.4767110959041608
Energy: 0.4767249348895031
Energy: 0.4803404233269205
Energy: 0.5122399391756354
Energy: 0.6050697350688995
Energy: 0.5175537233787328
Energy: 0.4764007936459793
Energy: 0.47769056164120094
Energy: 0.5746237651694603
Energy: 0.6065471680861526
Energy: 0.5173866643007273
Energy: 0.4764048098759461
Energy: 0.5232436583812721
Energy: 0.5285758960523547
Energy: 0.4940159897700014
Energy: 0.5329025357277981
Energy: 0.48719999446035117
Energy: 0.5185230797753844
Energy: 0.5287985594979702
Energy: 0.509704392413396
Energy: 0.5339204790856535
Energy: 0.48719286446378823
Energy: 0.5182284851309712
Energy: 0.49558300802855804
Energy: 0.5566746931877927
Energy: 0.5554208572604065
Energy: 0.5494704565108953
Energy: 0.5170197111893835
Energy: 0.5160300593802772
Energy: 0.5562760940272109
Energy: 0.5572477404288875
Energy: 0.49101184090335265
Energy: 0.5236342517815306
Energy: 0.47520854404377005
Energy: 0.5359087067300101
Energy: 0.5530256728746349
Energy: 0.4809865687201833
Energy: 0.5502562952914319
Energy: 0.5489325180088817
Energy: 0.5318804708363697
Energy: 0.5688555913461912
Energy: 0.49609662419081163
Energy: 0.5501022869689067
Energy: 0.47628843745982474
Energy: 0.47940344393850726
Energy: 0.6010448068725186
Energy: 0.6016946175327407
Energy: 0.4953417837280673
Energy: 0.47618869003531444
Energy: 0.47961616712078814
Energy: 0.6011030014817091
Energy: 0.6019268696001923
Energy: 0.5160333278853557
Energy: 0.46248487382633924
Energy: 0.4797253670419087
Energy: 0.4802132340024163
Energy: 0.5183459407307736
Energy: 0.5192081247986445
Energy: 0.46293717768440834
Energy: 0.4798204074754116
Energy: 0.48016013200904617
Energy: 0.5180038004368834
Energy: 0.4801801674361134
Energy: 0.47985250831130594
Energy: 0.5212179787147345
Energy: 0.5467316211819083
Energy: 0.4984826556880297
Energy: 0.5181478509559798
Energy: 0.4798038931412969
Energy: 0.5234738107175492
Energy: 0.5449621084897728
Energy: 0.4984457667962908
Energy: 0.4816982287205595
Energy: 0.6259435243922505
Energy: 0.642692912305988
Energy: 0.5988064771628061
Energy: 0.5256435638318759
Energy: 0.5492795743794877
Energy: 0.6268438983567646
Energy: 0.5463265602998897
Energy: 0.5986502504924823
Energy: 0.5240201548678851
Energy: 0.6025811780686853
Energy: 0.46285384954213926
Energy: 0.47988412610316944
Energy: 0.5212837543311813
Energy: 0.534190755965056
Energy: 0.6023173665482934
Energy: 0.524849939853093
Energy: 0.47998033576536786
Energy: 0.5206018246566954
Energy: 0.5342266156873973
Energy: 0.602402815552684
Energy: 0.47629008245350346
Energy: 0.4769562175812286
Energy: 0.5184036244624493
Energy: 0.5546544303931542
Energy: 0.4806766547028823
Energy: 0.4762638305636678
Energy: 0.4762195570928078
Energy: 0.5193742220347749
Energy: 0.5562976287220815
Energy: 0.5399826573952378
Energy: 0.5174451762037582
Energy: 0.4762459432319101
Energy: 0.4944683356461388
Energy: 0.6171703893718509
Energy: 0.5747639882482323
Energy: 0.4793308314907002
Energy: 0.476037213261453
Energy: 0.5190194084061925
Energy: 0.5449688506027015
Energy: 0.5787935669756505
Energy: 0.5373388861222032
Energy: 0.48945890245972784
Energy: 0.5340198892663962
Energy: 0.5137501769035
Energy: 0.5568613945533296
Energy: 0.4870848184171249
Energy: 0.4872070271600066
Energy: 0.528930223036517
Energy: 0.49563543571911517
Energy: 0.5574380954861764
Energy: 0.5184759453544179
Energy: 0.5108870466780551
Energy: 0.5238953512895637
Energy: 0.5500363320224535
Energy: 0.5528120520094126
Energy: 0.5292709387376289
Energy: 0.511122971549551
Energy: 0.5460784288511604
Energy: 0.5492796034199025
Energy: 0.5561107252721811
Energy: 0.4882939925929803
Energy: 0.5086635477510099
Energy: 0.549075194140013
Energy: 0.5511918866724399
Energy: 0.5560517814104258
Energy: 0.48820540687376585
Energy: 0.5290356035183381
Energy: 0.5524649232147848
Energy: 0.5516060928754325
Energy: 0.5553997019844269
Energy: 0.602014421125347
Energy: 0.518347151254506
Energy: 0.4764547814703421
Energy: 0.4791841342193589
Energy: 0.4624058858622331
Energy: 0.6006760241346265
Energy: 0.4809410412798308
Energy: 0.4763734020292524
Energy: 0.47902295919787313
Energy: 0.6256134974894405
Energy: 0.5359833910541432
Energy: 0.5185181240734487
Energy: 0.48023719608619836
Energy: 0.4759714985435172
Energy: 0.48381177252341107
Energy: 0.55665676095451
Energy: 0.5193898299928303
Energy: 0.4800663365668043
Energy: 0.4762110978632225
Energy: 0.4818597624558944
Energy: 0.587103809236908
Energy: 0.5186004609143239
Energy: 0.480070159904192
Energy: 0.5127528517525171
Energy: 0.546936927519068
Energy: 0.5360120034166723
Energy: 0.5179476462787027
Energy: 0.4800052684776223
Energy: 0.5644327381028283
Energy: 0.5468466196890113
Energy: 0.5051376645466839
Energy: 0.5342105704567025
Energy: 0.6106350982785336
Energy: 0.536477949161183
Energy: 0.5467134437712386
Energy: 0.5051126461964502
Energy: 0.6997860634219615
Energy: 0.6104118678389483
Energy: 0.5354298273449702
Energy: 0.5465927500937685
Energy: 0.5343044728498204
Energy: 0.6038426667495428
Energy: 0.596073133425727
Energy: 0.4769770581304592
Energy: 0.4808625909446532
Energy: 0.5353397957429237
Energy: 0.602991894770892
Energy: 0.5972502377094332
Energy: 0.4774839074638797
Energy: 0.48199531637730625
Energy: 0.5205080025091695
Energy: 0.5233269934146628
Energy: 0.4803789316250894
Energy: 0.47689104991507947
Energy: 0.47992781563410675
Energy: 0.5203046467201324
Energy: 0.47950993515260154
Energy: 0.4800377799236749
Energy: 0.4773046020518887
Energy: 0.48009103338126186
Energy: 0.5757569597948357
Energy: 0.617302701239866
Energy: 0.5174083705440465
Energy: 0.4764489610179987
Energy: 0.5229944705309552
Energy: 0.5747851695006061
Energy: 0.6170316130504899
Energy: 0.5173985074696206
Energy: 0.4763865873052514
Energy: 0.49486647706342096
Energy: 0.528708069642388
Energy: 0.5563837412878498
Energy: 0.558406625284281
Energy: 0.4898364984797377
Energy: 0.4907805768819544
Energy: 0.5307954286457724
Energy: 0.554354124280085
Energy: 0.5329630587413592
Energy: 0.48816323282582846
Energy: 0.5356866625918372
Energy: 0.5248985090388968
Energy: 0.5573155957060641
Energy: 0.5553735171815037
Energy: 0.5484906390250719
Energy: 0.5170484258078357
Energy: 0.5473650540321264
Energy: 0.5567754674737007
Energy: 0.5563157247239
Energy: 0.496731247575636
Energy: 0.5252748008904778
Energy: 0.5479955739648309
Energy: 0.4763868781565584
Energy: 0.6268206837998608
Energy: 0.503724400895909
Energy: 0.5505172662812211
Energy: 0.5483408067029577
Energy: 0.5336758433391412
Energy: 0.566358652057649
Energy: 0.5395525368871505
Energy: 0.5508645817836487
Energy: 0.4758942306758682
Energy: 0.47924691754167914
Energy: 0.6007929902544744
Energy: 0.6021474006379568
Energy: 0.5227108008090937
Energy: 0.4761415278308563
Energy: 0.47928554092272685
Energy: 0.6004317146429243
Energy: 0.6021809689173978
Energy: 0.475988001578593
Energy: 0.4775866630628476
Energy: 0.4769155740236323
Energy: 0.48152751596216825
Energy: 0.49846717708359795
Energy: 0.5213823266265357
Energy: 0.4774897832023808
Energy: 0.47712055954072863
Energy: 0.4972228401332541
Energy: 0.5182663317433522
Energy: 0.47986382097625657
Energy: 0.4801508943420673
Energy: 0.5466953199806429
Energy: 0.5452893491692311
Energy: 0.4984366956833898
Energy: 0.5193070505037836
Energy: 0.4953244813473708
Energy: 0.5465449190047585
Energy: 0.5450373708608343
Energy: 0.49841928411968367
Energy: 0.48073343760132486
Energy: 0.5909226436648873
Energy: 0.6084480969029529
Energy: 0.5043252160282994
Energy: 0.5051579181026533
Energy: 0.602659304711875
Energy: 0.6276802080677334
Energy: 0.6066695559032019
Energy: 0.5043828327858362
Energy: 0.4832524008632999
Energy: 0.602756169749704
Energy: 0.5679700714200112
Energy: 0.47998941969507825
Energy: 0.5206512610750575
Energy: 0.5346665914854326
Energy: 0.603791268701028
Energy: 0.4761449203313989
Energy: 0.48101805400591335
Energy: 0.5213572085636848
Energy: 0.5347481588320124
Energy: 0.5532869210370579
Energy: 0.47636396236244405
Energy: 0.4775683327624687
Energy: 0.48112477781367313
Energy: 0.5549467945466267
Energy: 0.5333370067439204
Energy: 0.47593844509516053
Energy: 0.47734594895589166
Energy: 0.5187020503359387
Energy: 0.5275395873379022
Energy: 0.4804353843303809
Energy: 0.479135932773632
Energy: 0.5107134630362415
Energy: 0.5172756078210071
Energy: 0.6173272963389458
Energy: 0.5748911191301694
Energy: 0.47698785730406407
Energy: 0.5119045210055476
Energy: 0.5175333369815427
Energy: 0.6172254874637525
Energy: 0.5747675338959493
Energy: 0.5354078584928778
Energy: 0.4882456802674805
Energy: 0.5334013834133684
Energy: 0.49691973184605065
Energy: 0.5547308991669552
Energy: 0.48906216706626765
Energy: 0.48917221385407583
Energy: 0.5327553341823075
Energy: 0.5161230140479447
Energy: 0.5555938070850674
Energy: 0.5282085645799975
Energy: 0.5112382419133215
Energy: 0.5249515849571262
Energy: 0.5502660439222709
Energy: 0.5532497375020995
Energy: 0.5692605951374683
Energy: 0.511154382699563
Energy: 0.5247862989880739
Energy: 0.5490602256616219
Energy: 0.5526855193856589
Energy: 0.6013761025078379
Energy: 0.495724955255715
Energy: 0.5515338516622111
Energy: 0.549676618553587
Energy: 0.5169828104389687
Energy: 0.6015117764270662
Energy: 0.5174370020255955
Energy: 0.5508744177528893
Energy: 0.5490397408299914
Energy: 0.5009671918646581

minimum gb energy = 0.4624058858622331 eV
minimum distance =  2.60122974619338 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.4517391950928592
Energy: 0.556487299938573
Energy: 0.523293622933895
Energy: 0.6019490463540059
Energy: 0.5330365434263657
Energy: 0.45257600352979527
Energy: 0.5562101250136914
Energy: 0.523578449157537
Energy: 0.6014188066590285
Energy: 0.45283374830789835
Energy: 0.5739071733620861
Energy: 0.5292546051468909
Energy: 0.5293459734578791
Energy: 0.601432581674353
Energy: 0.6008720828250089
Energy: 0.5742646317183537
Energy: 0.5290386309763487
Energy: 0.5347613526865072
Energy: 0.6025284952774661
Energy: 0.6008201912337507
Energy: 0.5564143891604841
Energy: 0.5296462586492677
Energy: 0.5286559936319615
Energy: 0.5233201280362436
Energy: 0.5752296999825706
Energy: 0.5565320863907076
Energy: 0.5296662319708879
Energy: 0.5287542626388141
Energy: 0.5230237864024112
Energy: 0.5247112565110672
Energy: 0.5756866725108993
Energy: 0.45249211161476605
Energy: 0.452433200196634
Energy: 0.6011022038557413
Energy: 0.5240066064163581
Energy: 0.5758981299351786
Energy: 0.45266766111364953
Energy: 0.4523846215284639
Energy: 0.5561618408402631
Energy: 0.525826059272325
Energy: 0.6013642126390941
Energy: 0.534306003689163
Energy: 0.4522569825452832
Energy: 0.4658684387235587
Energy: 0.5294730526901191
Energy: 0.6028885542413184
Energy: 0.452224796722173
Energy: 0.4524612527935756
Energy: 0.46651890866538953
Energy: 0.5296899154396799
Energy: 0.6012749475431729
Energy: 0.5230273804731815
Energy: 0.5563254011414278
Energy: 0.5296580347199747
Energy: 0.5940440979099123
Energy: 0.6014032074380451
Energy: 0.5229082470873379
Energy: 0.5558101407029074
Energy: 0.5290137527952782
Energy: 0.5958660356949947
Energy: 0.5762448050250298
Energy: 0.45833328729628703
Energy: 0.5564345995901585
Energy: 0.5295797933620119
Energy: 0.46602030587123855
Energy: 0.5758633432264522
Energy: 0.4574651268964706
Energy: 0.5561372993035913
Energy: 0.5296498777239541
Energy: 0.46559360325947763
Energy: 0.5564887635305319
Energy: 0.5748861493099612
Energy: 0.5233247908000541
Energy: 0.4520365164494783
Energy: 0.5352471660681563
Energy: 0.5564294298410596
Energy: 0.5758208106364188
Energy: 0.5228445491338599
Energy: 0.45206405768654495
Energy: 0.5328723673674431
Energy: 0.5292392751365137
Energy: 0.5337070623060461
Energy: 0.6012925618592155
Energy: 0.4524140270769533
Energy: 0.5750089662488166
Energy: 0.5293190233838104
Energy: 0.6021547057257624
Energy: 0.6011923581675302
Energy: 0.452772782178501
Energy: 0.5764860470228376
Energy: 0.5292884455072107
Energy: 0.46702793910166307
Energy: 0.57595432697393
Energy: 0.5565430432296421
Energy: 0.5558727937511834
Energy: 0.5295245371361188
Energy: 0.46706605721422867
Energy: 0.576169567237409
Energy: 0.5565851302849107
Energy: 0.529828727851836
Energy: 0.45266524150228227
Energy: 0.5565667685777755
Energy: 0.5565781132118321
Energy: 0.5564605090344543
Energy: 0.5763037635561201
Energy: 0.4524038343980472
Energy: 0.5565121630508315
Energy: 0.5260894943404781
Energy: 0.5562123497738857
Energy: 0.5758881119453101
Energy: 0.4518638151999902
Energy: 0.5559691357874107
Energy: 0.5232397932179402
Energy: 0.6016292625276234
Energy: 0.5329607315072488
Energy: 0.45265632989310817
Energy: 0.5561901331775162
Energy: 0.5226410342659598
Energy: 0.601643542692629
Energy: 0.5347532106002656
Energy: 0.5739204810178816
Energy: 0.5292985385032656
Energy: 0.5293567335442458
Energy: 0.601620016529503
Energy: 0.6007564205710256
Energy: 0.5743924980875303
Energy: 0.5290512988202408
Energy: 0.5342181429519162
Energy: 0.6025522357289504
Energy: 0.6007657842424721
Energy: 0.5562516895543125
Energy: 0.5297212152355774
Energy: 0.5287258646472324
Energy: 0.5232265607200319
Energy: 0.57525777231746
Energy: 0.5565064476187764
Energy: 0.5297120227604105
Energy: 0.5288786785946968
Energy: 0.5238498501380042
Energy: 0.5250199237082507
Energy: 0.5242799333655542
Energy: 0.45255992968426556
Energy: 0.4524543896042866
Energy: 0.6010150606712727
Energy: 0.5240767411265447
Energy: 0.5755572988950245
Energy: 0.45249085952648904
Energy: 0.4523360574388133
Energy: 0.5560041350255988
Energy: 0.5251258669529595
Energy: 0.6015085206351641
Energy: 0.534665791473456
Energy: 0.45225789486039847
Energy: 0.4665614573074254
Energy: 0.5292522665480773
Energy: 0.6024508571955288
Energy: 0.45229676175125916
Energy: 0.45251735685624167
Energy: 0.4663539156231489
Energy: 0.5295174485918501
Energy: 0.6012696729080698
Energy: 0.5229932836509967
Energy: 0.5562697788563077
Energy: 0.5298680251138844
Energy: 0.5340172841129761
Energy: 0.601484010953493
Energy: 0.5225509268743092
Energy: 0.5559644506655035
Energy: 0.5290252669593112
Energy: 0.5937535971309086
Energy: 0.556484386924002
Energy: 0.4584630477164108
Energy: 0.5564542432290459
Energy: 0.5298565099089902
Energy: 0.46595550524873214
Energy: 0.5561969309074939
Energy: 0.4574876733044757
Energy: 0.5565918349829697
Energy: 0.5294329580108076
Energy: 0.4656414790503084
Energy: 0.556343671415757
Energy: 0.5749911250929041
Energy: 0.5759092628984371
Energy: 0.4523262629267969
Energy: 0.534917632097355
Energy: 0.5565747599369154
Energy: 0.5753214505421591
Energy: 0.5234018173210648
Energy: 0.45230745270265715
Energy: 0.5328810597462521
Energy: 0.528917174724526
Energy: 0.5941641411854132
Energy: 0.6016014218861256
Energy: 0.4524420159502984
Energy: 0.5761542063104279
Energy: 0.5293854533453538
Energy: 0.6017620979271994
Energy: 0.6014586073236192
Energy: 0.4525928326385385
Energy: 0.5295105780207661
Energy: 0.529832776747509
Energy: 0.46637909875961486
Energy: 0.575598235408767
Energy: 0.5565287495251577
Energy: 0.5557952904607554
Energy: 0.528957769015398
Energy: 0.466633046861517
Energy: 0.5751359556172333
Energy: 0.5566141601773434
Energy: 0.5294727738896646
Energy: 0.4525160955979114
Energy: 0.556587226110116
Energy: 0.5565841696499952
Energy: 0.5564057606573063
Energy: 0.578409415478195
Energy: 0.45256238162367307
Energy: 0.5568001936869402
Energy: 0.525962453362595
Energy: 0.5562441142412545
Energy: 0.5776154624911995

minimum gb energy = 0.4517391950928592 eV
minimum distance =  2.60635170046698 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 0.5483482340272555
Energy: 0.6041109568131618
Energy: 0.5602785978474315
Energy: 0.5300990177763072
Energy: 0.5516306080378643
Energy: 0.5241997800985951
Energy: 0.5743270714814647
Energy: 0.5406404224595767
Energy: 0.5788417568953897
Energy: 0.5471439280320619
Energy: 0.5295397068225758
Energy: 0.5316010761923992
Energy: 0.5306508252874254
Energy: 0.5292097327039299
Energy: 0.5739817199372701
Energy: 0.5915771986016916
Energy: 0.5627799010056961
Energy: 0.5290499488921588
Energy: 0.5626897319133176
Energy: 0.5691976345842141
Energy: 0.5891700596797406
Energy: 0.5755957772357378
Energy: 0.5299464283741504
Energy: 0.5420307737597482
Energy: 0.5676803417701509
Energy: 0.5852989690755841
Energy: 0.5942158041618831
Energy: 0.5597941626960768
Energy: 0.5320797045412887
Energy: 0.5555193838864254
Energy: 0.5634884513146942
Energy: 0.5037470712390818
Energy: 0.5813010216198906
Energy: 0.5965293046587885
Energy: 0.5627275281462542
Energy: 0.5628093421561128
Energy: 0.5044553647565445
Energy: 0.5777973400283807
Energy: 0.5681853751563963
Energy: 0.5544219563679474
Energy: 0.5954235001717483
Energy: 0.5783453170719441
Energy: 0.5364983860745836
Energy: 0.5586217120268903
Energy: 0.5823352537351559
Energy: 0.59793481589531
Energy: 0.5781927260932107
Energy: 0.5669001945640285
Energy: 0.5447671659192996
Energy: 0.5538266076809748
Energy: 0.5799700252910653
Energy: 0.5069890558060983
Energy: 0.5165489159124931
Energy: 0.6027613866602369
Energy: 0.603960078402873
Energy: 0.5740640458203767
Energy: 0.506082786797869
Energy: 0.5416557146974604
Energy: 0.6091196080175728
Energy: 0.5799902407593451
Energy: 0.5088825886397765
Energy: 0.5076134979895551
Energy: 0.5144748333444963
Energy: 0.6094903324102003
Energy: 0.5663430594754965
Energy: 0.506180133967829
Energy: 0.5082115423960365
Energy: 0.5150079182062081
Energy: 0.6401107992556179
Energy: 0.5669145124125984
Energy: 0.5529581618266187
Energy: 0.5075128782110493
Energy: 0.506347145732463
Energy: 0.5329180218620369
Energy: 0.5450236952532813
Energy: 0.5493307146458641
Energy: 0.5045448544043056
Energy: 0.5098060824083643
Energy: 0.5678624328166179
Energy: 0.5936656831561674
Energy: 0.5376376634618311
Energy: 0.5977936533640148
Energy: 0.5909481518664353
Energy: 0.5571666398603119
Energy: 0.5143033799026504
Energy: 0.5376511150529787
Energy: 0.62029530955721
Energy: 0.5915159963085871
Energy: 0.5322604381973911
Energy: 0.5146260108311342
Energy: 0.5639483382360146
Energy: 0.5479044186653272
Energy: 0.5215661140805254
Energy: 0.5116772876166913
Energy: 0.5317085378540712
Energy: 0.5494519299284378
Energy: 0.5156899851566884
Energy: 0.5117274460379995
Energy: 0.5159232965492424
Energy: 0.5398330845214349
Energy: 0.5201501923221657
Energy: 0.5744036862487772
Energy: 0.5272970414141405
Energy: 0.5129809004562402
Energy: 0.5122462625981524
Energy: 0.5130864067604558
Energy: 0.5774004242570363
Energy: 0.5278204911480397
Energy: 0.5125600923203603
Energy: 0.5172738870307738
Energy: 0.5730725192815856
Energy: 0.5383482518979064
Energy: 0.5177201970334785
Energy: 0.5483650560835064
Energy: 0.5357546817595109
Energy: 0.5737249159253112
Energy: 0.5434169157126706
Energy: 0.5177549359765758
Energy: 0.5561542664522832
Energy: 0.5255763397886709
Energy: 0.5825316597587648
Energy: 0.5873908602248749
Energy: 0.5259866705115116
Energy: 0.5273023402378146
Energy: 0.5763329540424887
Energy: 0.5700366623333784
Energy: 0.5256311994407107
Energy: 0.5149873803551915
Energy: 0.515361732170289
Energy: 0.5691915250806455
Energy: 0.5293510274561618
Energy: 0.5354149324938745
Energy: 0.5670649636179294
Energy: 0.5589690746940373
Energy: 0.535923224252598
Energy: 0.5298887541671067
Energy: 0.5233317040491926
Energy: 0.5276617365104329
Energy: 0.5412251107967498
Energy: 0.5496768498383918
Energy: 0.5201688909617042
Energy: 0.5665278748568782
Energy: 0.5630840520678803
Energy: 0.5897229116734208
Energy: 0.5781358144045093
Energy: 0.5146567106286039
Energy: 0.5705203577565093
Energy: 0.5642996331211554
Energy: 0.6000332790472932
Energy: 0.5565990279892985
Energy: 0.598090815661487
Energy: 0.5641321913650799
Energy: 0.5650607605054913
Energy: 0.5672445953513399
Energy: 0.5132214785122896
Energy: 0.5941181616243949
Energy: 0.561504829169422
Energy: 0.5668189912203943
Energy: 0.5701165787889761
Energy: 0.5097642693621874
Energy: 0.5518378784944069
Energy: 0.5699847999603628
Energy: 0.5962666292033609
Energy: 0.600772792902602
Energy: 0.5484821191218173
Energy: 0.5600461397308671
Energy: 0.5692833083832388
Energy: 0.5973791197562203
Energy: 0.5993446873983838
Energy: 0.5334907701207899
Energy: 0.6194068108396106
Energy: 0.5982577914301405
Energy: 0.6028333296607004
Energy: 0.5090888691746455
Energy: 0.514950501199009
Energy: 0.5693787186155327
Energy: 0.5979928105481129
Energy: 0.6031455982561225
Energy: 0.5152402689891609
Energy: 0.5137450141216604
Energy: 0.5117864724506416
Energy: 0.6104445291976999
Energy: 0.5159282691105312
Energy: 0.5109457090745742
Energy: 0.5085872727366072
Energy: 0.5130344807622582
Energy: 0.5843129586346547
Energy: 0.5063012967168872
Energy: 0.5087374698757745
Energy: 0.5132259880997037
Energy: 0.5313882189066955
Energy: 0.5599243012101267
Energy: 0.5885412091441602
Energy: 0.5097613845145066
Energy: 0.5098938748606127
Energy: 0.5489717259244614
Energy: 0.5604326994836024
Energy: 0.588401997296101
Energy: 0.5086708685394059
Energy: 0.5095356104257587
Energy: 0.5971807356322477
Energy: 0.5247297636203221
Energy: 0.5524495883370687
Energy: 0.5408387036960042
Energy: 0.5488123684057589
Energy: 0.5910847307556718
Energy: 0.5248463615705932
Energy: 0.5519811089403897
Energy: 0.584159249347565
Energy: 0.5610477248793748
Energy: 0.5105045851255423
Energy: 0.5155581194721832
Energy: 0.587528744346715
Energy: 0.6209346164510021
Energy: 0.5447722378510967
Energy: 0.5103829203341501
Energy: 0.5140262257532555
Energy: 0.5899694557136007
Energy: 0.5982313557413141
Energy: 0.49976137956081856
Energy: 0.5256353220164675
Energy: 0.5157490064271125
Energy: 0.5116228628074404
Energy: 0.5736768077203985
Energy: 0.5184072655206002
Energy: 0.5258678097058429
Energy: 0.5149526672635777
Energy: 0.5443042322316018
Energy: 0.5775565221988048
Energy: 0.5124503183196321
Energy: 0.5264493598203264
Energy: 0.5638635811027093
Energy: 0.5703387015417779
Energy: 0.5707505406438771
Energy: 0.5871270481451718
Energy: 0.5221923447112745
Energy: 0.5540763523641464
Energy: 0.5752992130760947
Energy: 0.551332946573211
Energy: 0.5837749489492707
Energy: 0.5266690156788101
Energy: 0.5784689786251208
Energy: 0.5451970541354204
Energy: 0.5918385142643839
Energy: 0.5605793774201813
Energy: 0.5263557693797062
Energy: 0.5778029887656634
Energy: 0.5416805642567968
Energy: 0.5963599739340582
Energy: 0.5340181408969198
Energy: 0.5367747228579348
Energy: 0.5468849034540008
Energy: 0.5316126037162648
Energy: 0.5505395478960264
Energy: 0.5819894964067437
Energy: 0.5377013329848829
Energy: 0.5418884527787017
Energy: 0.5306807732266525
Energy: 0.5519805990083286
Energy: 0.590002271915096
Energy: 0.586129847428104
Energy: 0.5753832926144237
Energy: 0.5421005156046168
Energy: 0.5368499207830364
Energy: 0.5621625947111261
Energy: 0.5830854779420995
Energy: 0.5721454721023216
Energy: 0.5429307150255482
Energy: 0.5515866362182368
Energy: 0.5614348759531782
Energy: 0.560044481901619
Energy: 0.5704040316163003
Energy: 0.5808381005749678
Energy: 0.5874228874372516
Energy: 0.5626075554096105
Energy: 0.5603761592705818
Energy: 0.5717106225059749
Energy: 0.579776248198576
Energy: 0.5739882553734152
Energy: 0.5693020619375259
Energy: 0.5921235729973995
Energy: 0.5798542732532282
Energy: 0.5380007735828192
Energy: 0.6001827800170976
Energy: 0.5579853376282424
Energy: 0.5981329819818965
Energy: 0.5593406057648391
Energy: 0.5604429832044802
Energy: 0.5981415314211438
Energy: 0.5416403871167285
Energy: 0.5874341405939066
Energy: 0.5116291242110049
Energy: 0.511819027755161
Energy: 0.6027428301197306
Energy: 0.5795374479976745
Energy: 0.5976854197051594
Energy: 0.5143536695249855
Energy: 0.5156845526672633
Energy: 0.6116848450529108
Energy: 0.5787675776115115
Energy: 0.5091162017690636
Energy: 0.5118226061564279
Energy: 0.5411533620210095
Energy: 0.6338922681813023
Energy: 0.5551824805026405
Energy: 0.5094908037879073
Energy: 0.507051800987655
Energy: 0.5433204645960408
Energy: 0.6314339612326771
Energy: 0.5462601802289945
Energy: 0.5338212756140107
Energy: 0.5096783605325089
Energy: 0.5091446860112502
Energy: 0.5470093900339768
Energy: 0.5994028564086398
Energy: 0.5157831331271365
Energy: 0.5058244223048239
Energy: 0.5101019609040879
Energy: 0.5414487998506253
Energy: 0.5986143148760772
Energy: 0.555204192673379
Energy: 0.548134631980675
Energy: 0.5906403647578972
Energy: 0.5603154422868284
Energy: 0.553086151212223
Energy: 0.5370961297355028
Energy: 0.5496439845369572
Energy: 0.5911797624633726
Energy: 0.5596622150829472
Energy: 0.5772111850055125
Energy: 0.5492184618732705
Energy: 0.5950518935633914
Energy: 0.5239789324929509
Energy: 0.5080610151740996
Energy: 0.5184560894580715
Energy: 0.5491307087012522
Energy: 0.5990334093053468
Energy: 0.512788168590948
Energy: 0.5131663131371196
Energy: 0.5885517218755317
Energy: 0.5919105813058524
Energy: 0.603270976507744
Energy: 0.5226190171664569
Energy: 0.509616290576597
Energy: 0.5184279561690571
Energy: 0.5187776436798527
Energy: 0.6050726286556897
Energy: 0.525742990144899
Energy: 0.5093505491325556
Energy: 0.5134399962240981
Energy: 0.5732652878332863
Energy: 0.5408565736221509
Energy: 0.529611294575035
Energy: 0.4969601242711177
Energy: 0.5223821345585496
Energy: 0.5736490613786897
Energy: 0.5780412695192321
Energy: 0.5294138558402081
Energy: 0.4958311299532944
Energy: 0.5411518478893252
Energy: 0.5200462548895576
Energy: 0.5811236230554437
Energy: 0.5158894789518387
Energy: 0.5159128739990765
Energy: 0.5700163871705924
Energy: 0.5328797699671785
Energy: 0.5809441511432811
Energy: 0.5258376152458889
Energy: 0.5370771934942621
Energy: 0.577921748771545
Energy: 0.5275256566661239
Energy: 0.522596203797523
Energy: 0.5776154591299363
Energy: 0.5283827597778975
Energy: 0.5204316332787462
Energy: 0.5293177055696203
Energy: 0.534811476431304
Energy: 0.5267762753222118
Energy: 0.5362918161610634
Energy: 0.5371053918381312
Energy: 0.5217577976795446
Energy: 0.5446238429761994
Energy: 0.5598693974611837
Energy: 0.589909109863933
Energy: 0.5811442703614442
Energy: 0.5218158889601011
Energy: 0.5401237489492323
Energy: 0.561667257886942
Energy: 0.5853123256093771
Energy: 0.527902962892752
Energy: 0.593396431207979
Energy: 0.565298191443326
Energy: 0.5700248057301486
Energy: 0.5821468991765619
Energy: 0.5108191116083636
Energy: 0.5993563911809762
Energy: 0.5641018435047157
Energy: 0.5696615147931972
Energy: 0.5858193688832302
Energy: 0.5008167328002722
Energy: 0.5782447823434488
Energy: 0.5757558983224005
Energy: 0.5635985348490642
Energy: 0.5999826785544315
Energy: 0.5379772874955125
Energy: 0.5779989792751046
Energy: 0.5511127453968934
Energy: 0.6088804223454322
Energy: 0.6006008438346871
Energy: 0.5316153648766792
Energy: 0.5946692427714418
Energy: 0.6032944638715201
Energy: 0.6000201712134103
Energy: 0.6021616201103511
Energy: 0.5100674489968342
Energy: 0.5758657257062105
Energy: 0.6022162130562989
Energy: 0.60035347199249
Energy: 0.596241864677349
Energy: 0.5131998551454742
Energy: 0.5123854844619141
Energy: 0.6012531561625896
Energy: 0.5247311370910958
Energy: 0.5078800240941473
Energy: 0.5089526120223251
Energy: 0.5092524897558561
Energy: 0.5955700998538793
Energy: 0.5158537818301285
Energy: 0.5081479829846913
Energy: 0.5119673287052366
Energy: 0.5110386823462465
Energy: 0.5602321405463497
Energy: 0.580648470969908
Energy: 0.5118769978087535
Energy: 0.5067523039347032
Energy: 0.5618050109126566
Energy: 0.5561480321409678
Energy: 0.5962205004747319
Energy: 0.511692473203232
Energy: 0.5074956259591872
Energy: 0.58813494201889
Energy: 0.5413685918116645
Energy: 0.5067137378799205
Energy: 0.5453726993649813
Energy: 0.5949623211251441
Energy: 0.5935659730510073
Energy: 0.5509786610337204
Energy: 0.5074205370639835
Energy: 0.555374444931317
Energy: 0.583163617990513
Energy: 0.5039829960245376
Energy: 0.5050656768514664
Energy: 0.5921375555275579
Energy: 0.5971576112723206
Energy: 0.5441238925812869
Energy: 0.5130044976050272
Energy: 0.5088664977467358
Energy: 0.5847240815743546
Energy: 0.6042625435583852
Energy: 0.5443538329544935
Energy: 0.5267214612147662
Energy: 0.5070377266849059
Energy: 0.509391702050109
Energy: 0.5646773336712422
Energy: 0.5232087139821628
Energy: 0.5087471100130735
Energy: 0.5157513619720777
Energy: 0.5148703551170771
Energy: 0.5751818395217226
Energy: 0.524552814853929
Energy: 0.5246055901151003
Energy: 0.512060654037237
Energy: 0.5779365817853044
Energy: 0.5688575508309571
Energy: 0.596829029739815
Energy: 0.5212125901249873
Energy: 0.5840491284581321
Energy: 0.5766612433382701
Energy: 0.5640427962716079
Energy: 0.5982846821898807
Energy: 0.5632447580303951
Energy: 0.5998179041944198
Energy: 0.5683765592003057
Energy: 0.5238006519134014
Energy: 0.6112333162397707
Energy: 0.5285324450755536
Energy: 0.5752756219703921
Energy: 0.5340451319623454
Energy: 0.5317412444691835
Energy: 0.6037490557770739

minimum gb energy = 0.4958311299532944 eV
minimum distance =  2.55728111195784 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 0.6539445972993975
Energy: 0.555781047181693
Energy: 0.5657341023883028
Energy: 0.58360494200467
Energy: 0.5211118042894454
Energy: 0.6524398953497458
Energy: 0.5556786513396262
Energy: 0.5307910797842094
Energy: 0.5841029165265795
Energy: 0.543690818907359
Energy: 0.5400498696973649
Energy: 0.5721688558891013
Energy: 0.5606859807858126
Energy: 0.5664179390526776
Energy: 0.5741369559761903
Energy: 0.5389696289901725
Energy: 0.5708163941234828
Energy: 0.5618004646757988
Energy: 0.578941593682192
Energy: 0.5753447734367699
Energy: 0.5333370942206355
Energy: 0.5674369680435074
Energy: 0.5799452361319476
Energy: 0.5166466561591648
Energy: 0.5330091317664987
Energy: 0.5337869359689811
Energy: 0.5801275815690138
Energy: 0.5705145973335352
Energy: 0.533698208659235
Energy: 0.5345969764243705
Energy: 0.5336583827928161
Energy: 0.5199551665123413
Energy: 0.6489765563700441
Energy: 0.5438075810160193
Energy: 0.5297039155381146
Energy: 0.53392407173118
Energy: 0.5378519268828351
Energy: 0.6479120041472289
Energy: 0.5586536813045666
Energy: 0.5293527680023573
Energy: 0.5253965417212846
Energy: 0.5590444352205668
Energy: 0.5979079783697921
Energy: 0.5362497671481566
Energy: 0.4847807502637248
Energy: 0.5258617769000599
Energy: 0.5604648568325135
Energy: 0.5963874995370472
Energy: 0.5369249212972083
Energy: 0.48617950707922314
Energy: 0.5483535217256265
Energy: 0.5153967309087707
Energy: 0.532011869967385
Energy: 0.5277927960851319
Energy: 0.6518958405981186
Energy: 0.5490154198672351
Energy: 0.49703828460745747
Energy: 0.5437443100715256
Energy: 0.5271982297143898
Energy: 0.6546362251503475
Energy: 0.5390554005444211
Energy: 0.5282072324015978
Energy: 0.5343252770705245
Energy: 0.5452246712421976
Energy: 0.5735477800905685
Energy: 0.5322766374764824
Energy: 0.5365013961535635
Energy: 0.5342327105175161
Energy: 0.5556050166880201
Energy: 0.5734121076839538
Energy: 0.5741090881108482
Energy: 0.5321943796570998
Energy: 0.4966007269357222
Energy: 0.6091544102757713
Energy: 0.571479572794275
Energy: 0.5444282410145604
Energy: 0.5354396039473961
Energy: 0.5417718641270406
Energy: 0.6099890999641282
Energy: 0.5713761657667592
Energy: 0.5167182336367117
Energy: 0.649492945918074
Energy: 0.5603213206605648
Energy: 0.5728564587052338
Energy: 0.513562145694534
Energy: 0.525583832804607
Energy: 0.6699254773138781
Energy: 0.5628812478644752
Energy: 0.5794849070850191
Energy: 0.5146209529474373
Energy: 0.5552349561509606
Energy: 0.5826027369665021
Energy: 0.5547938229571193
Energy: 0.5700779557667305
Energy: 0.5615560479803828
Energy: 0.5817134005724016
Energy: 0.609802957151654
Energy: 0.5553240701813728
Energy: 0.6122773139001928
Energy: 0.5609523706174484
Energy: 0.49931439958684987
Energy: 0.503097330455264
Energy: 0.5582294492686903
Energy: 0.5944933349013808
Energy: 0.5861948501518573
Energy: 0.5000590074359799
Energy: 0.5052611839026385
Energy: 0.5573488862940498
Energy: 0.6373948858434826
Energy: 0.5134012001579128
Energy: 0.5023008217844525
Energy: 0.5036061336952404
Energy: 0.5097367599639309
Energy: 0.5576892010460998
Energy: 0.5040147790298017
Energy: 0.5028237891010922
Energy: 0.5051689338031409
Energy: 0.558462507074425
Energy: 0.5587268480635542
Energy: 0.5042615506435262
Energy: 0.5026406301298113
Energy: 0.49692962960702325
Energy: 0.6060805359330005
Energy: 0.5739001387728194
Energy: 0.5590592142404983
Energy: 0.5047991332753335
Energy: 0.5412203573898622
Energy: 0.6061399763063923
Energy: 0.5744059959096336
Energy: 0.559130423493985
Energy: 0.575851907680031
Energy: 0.5564846616075312
Energy: 0.5488803406419834
Energy: 0.5098548560236741
Energy: 0.5102579099263794
Energy: 0.6998872782232882
Energy: 0.5564500594934831
Energy: 0.5495840868219892
Energy: 0.5114295432535112
Energy: 0.546714682295671

minimum gb energy = 0.4847807502637248 eV
minimum distance =  2.56897455672816 Angstroms
sigma value = 33