Model name: model_name=EAM_Dynamo_WilliamsMishinHamilton_2006_CuAg__MO_128703483589_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.090000152587891
cohesive_energy=2.8502240916688235
mass=107.8682
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=[9.0063155127042e-20, 1.41939231271011e-19, 1.85921383139262e-19, 2.23405907668326e-19, 2.5508254189914e-19, 2.82200983606224e-19, 3.0565204299808196e-19, 3.2606857984514394e-19, 3.43984118966532e-19, 3.59948206947708e-19, 3.7441906630599593e-19, 3.8765464747947e-19, 3.9969340270734597e-19, 4.1048726669060393e-19, 4.2000740024983197e-19, 4.2827783603453994e-19, 4.353514458736499e-19, 4.41297123362424e-19, 4.46180557742856e-19, 4.500642339036719e-19, 4.53001023673794e-19, 4.5504219670551e-19, 4.562326139445719e-19, 4.5662034069e-19, 4.562053769417939e-19, 4.5486595727577e-19, 4.52443466205162e-19, 4.487087924713079e-19, 4.43227746206394e-19, 4.35353048050284e-19, 4.24341288044802e-19, 4.09365743046804e-19, 3.8948273101886394e-19, 3.6365724585541793e-19, 3.3076936608929996e-19, 2.89564587416088e-19, 2.3853205726991996e-19, 1.7581805728525798e-19, 9.903967015435379e-20, 5.08019769285354e-21, -1.0986189266403358e-19, -2.50086955154328e-19, -4.20476838003594e-19, -6.270839236644299e-19, -8.78332456878408e-19, -1.1864694758358239e-18, -1.56865909881672e-18, -2.05057780855758e-18, -2.6737123668191994e-18, -3.50346362380146e-18, -4.63532130689076e-18, -6.1684601497317e-18, -8.0498961710379e-18, -1.176797135496366e-17]
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: -2.61527481303092e-08 eV

========================================
theta = 0.0
========================================

Energy: 0.00971527300288147
Energy: 0.07053838797057586
Energy: 0.07197102791010768
Energy: 0.07183890060114577
Energy: 0.01225264535955033
Energy: 0.010643860793583941
Energy: 0.07036083571631747
Energy: 0.07218854631982193
Energy: 0.07135768439232054
Energy: 0.011700011240651549
Energy: 0.07062286301371727
Energy: 0.07041312406555873
Energy: 0.07060471686197033
Energy: 0.07189181662210295
Energy: 0.07205527560573932
Energy: 0.07080293337528931
Energy: 0.07038073642000232
Energy: 0.07044903005718281
Energy: 0.07192995952640864
Energy: 0.07181954370294137
Energy: 0.07219958667612836
Energy: 0.012199404516604537
Energy: 0.010044362577773294
Energy: 0.07079751636729782
Energy: 0.07127670549272047
Energy: 0.07218877688203278
Energy: 0.01181505850269087
Energy: 0.009927561937680261
Energy: 0.07063112485631758
Energy: 0.07190939184109363
Energy: 0.07156708068761061
Energy: 0.01066992611925319
Energy: 0.010589478281513017
Energy: 0.07024592396880056
Energy: 0.07064906069905826
Energy: 0.07225380562644479
Energy: 0.010870203078472576
Energy: 0.010158562983700532
Energy: 0.07065689159444549
Energy: 0.07043422974324184
Energy: 0.07130653096340327
Energy: 0.07120329869058215
Energy: 0.07252326026454073
Energy: 0.01091377791736477
Energy: 0.010090183078286364
Energy: 0.07089947444426964
Energy: 0.07164497303945357
Energy: 0.07261785072082441
Energy: 0.011669434305813289
Energy: 0.07083474115174555
Energy: 0.07264617993179477
Energy: 0.07071014932013486
Energy: 0.07134812501919142
Energy: 0.010424182157453063
Energy: 0.010033461625675704
Energy: 0.07055359729783749
Energy: 0.07033428874777581
Energy: 0.07162498562055615
Energy: 0.010848872867224295
Energy: 0.010183382775913116
Energy: 0.010098321932115956
Energy: 0.07267933496482146
Energy: 0.07127272243282334
Energy: 0.07116456204597088
Energy: 0.07306207131902183
Energy: 0.010128631592111106
Energy: 0.07301407195751779
Energy: 0.07122610706084855
Energy: 0.07139828954538696
Energy: 0.07260431230047051

minimum gb energy = 0.00971527300288147 eV
minimum distance =  2.85134447709846 Angstroms
sigma value = 3


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

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Energy: 0.588344470127286
Energy: 0.6220806543868915
Energy: 0.589602841407822
Energy: 0.6031104033746837
Energy: 0.6275692312671838
Energy: 0.5912523992504598
Energy: 0.603450392636147
Energy: 0.6023680225195003
Energy: 0.6268969757909021
Energy: 0.5954455848608674
Energy: 0.7067086053411521
Energy: 0.5899703310890767
Energy: 0.5382276196923451
Energy: 0.5132398433368274
Energy: 0.5131799083239231
Energy: 0.6820981111630177
Energy: 0.6225212838817615
Energy: 0.5363863458410983
Energy: 0.5903600411429818
Energy: 0.5145017205870097
Energy: 0.7103037605716299
Energy: 0.5548815754564984
Energy: 0.5128686429652922
Energy: 0.5305913913629334
Energy: 0.5111808457791625
Energy: 0.5519843434274012
Energy: 0.552917340640184
Energy: 0.5852894275312857
Energy: 0.5840534996067656
Energy: 0.5844306151205638
Energy: 0.6538113345932096
Energy: 0.6811890994240034
Energy: 0.5110902762070851
Energy: 0.5262950051203358
Energy: 0.5122630228031289
Energy: 0.6243447489391107
Energy: 0.6772291002629003
Energy: 0.5874339477888748
Energy: 0.5843082597174881
Energy: 0.7581919608914935
Energy: 0.6269560088271846
Energy: 0.666556439262743
Energy: 0.6666049645949108
Energy: 0.579644413600257
Energy: 0.7293815212060469
Energy: 0.626082657033335
Energy: 0.6329630611813086
Energy: 0.7374247546040316
Energy: 0.5349375122305033
Energy: 0.6213880890151072
Energy: 0.6275396796540018
Energy: 0.6316060365214665
Energy: 0.5697148737348412
Energy: 0.7099898713255243
Energy: 0.621696241631852
Energy: 0.6264956005072205
Energy: 0.6430117421549316
Energy: 0.5680974509226705
Energy: 0.6796981597054121
Energy: 0.6976106725989859
Energy: 0.6727493048546932
Energy: 0.5742507269625707
Energy: 0.5732399523885839
Energy: 0.6558124311089071
Energy: 0.6542885838832865
Energy: 0.6895684170156402
Energy: 0.6025785718269503
Energy: 0.5748141593224979
Energy: 0.6537901748316259
Energy: 0.6545135205443984
Energy: 0.6528891958970703
Energy: 0.6467578720779794
Energy: 0.645677699012053
Energy: 0.6159952138938255
Energy: 0.653655755723558
Energy: 0.6498304139200857
Energy: 0.6479645836551423
Energy: 0.6043168904505993
Energy: 0.6538333369348831
Energy: 0.7016973469964722
Energy: 0.6178656757110755
Energy: 0.525693868489234
Energy: 0.7265951158259694
Energy: 0.6543348106773079
Energy: 0.7025724642936302
Energy: 0.47277418887451644
Energy: 0.5177010226025566
Energy: 0.659342105493615
Energy: 0.653883776811287
Energy: 0.6737043568114877
Energy: 0.5986405343612315
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Energy: 0.5958077218392038
Energy: 0.6563316008245895
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Energy: 0.6817343112469467
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Energy: 0.5858110089588339
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Energy: 0.5973007445036788
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Energy: 0.5752974945234316
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Energy: 0.6538943780631076
Energy: 0.6564657788870766
Energy: 0.4707848381598266
Energy: 0.47174563118171525
Energy: 0.699551526718682
Energy: 0.6233319338445049
Energy: 0.6592470969468649
Energy: 0.5339743586423502
Energy: 0.5773779753587925
Energy: 0.6982327039140669
Energy: 0.6243212361535452
Energy: 0.7058154008557626
Energy: 0.7924583741911685
Energy: 0.6234226686372218
Energy: 0.6495462872869548
Energy: 0.65097944601866
Energy: 0.6488662032295553
Energy: 0.6539429466058843
Energy: 0.6532663041210045
Energy: 0.6519477128575714
Energy: 0.6221571386367415
Energy: 0.6211562188679108
Energy: 0.47047279403750364
Energy: 0.7317719041067009
Energy: 0.625638477916993
Energy: 0.6995593125646323
Energy: 0.47167424031402383
Energy: 0.5155166322828991
Energy: 0.6334449202826732
Energy: 0.6229821544510681
Energy: 0.5870974065487014
Energy: 0.47112945857329264
Energy: 0.47020396467754494
Energy: 0.5532964087936156
Energy: 0.5487213917917803
Energy: 0.5715449274559986
Energy: 0.5710466897845154
Energy: 0.5197756257279691
Energy: 0.553223849184029
Energy: 0.5523307956705519
Energy: 0.5521530503145725
Energy: 0.47039543924924637
Energy: 0.4929290106550566
Energy: 0.5538128272747151
Energy: 0.684815926463701
Energy: 0.5473024885491954
Energy: 0.5365121267756885
Energy: 0.5686637184181346
Energy: 0.5520202379046246
Energy: 0.5540028041454909
Energy: 0.49102322558157135
Energy: 0.5569429417862712
Energy: 0.6585938591330418
Energy: 0.6392709091179224
Energy: 0.6768932453419065
Energy: 0.7024796539577504
Energy: 0.5761563582097108
Energy: 0.7174914065099867
Energy: 0.6157808643623179
Energy: 0.6402018091723554
Energy: 0.5693116508739022
Energy: 0.4713187454610717
Energy: 0.6571041205685271
Energy: 0.6275319347189553
Energy: 0.6285038138821071
Energy: 0.5692428852408988
Energy: 0.6155250744076889
Energy: 0.6537713834380239
Energy: 0.6579919359392469
Energy: 0.6821966562610446
Energy: 0.6152315797551022
Energy: 0.6777335504593841
Energy: 0.6986778061719228
Energy: 0.6982833345515352
Energy: 0.6050604674805131
Energy: 0.5727582096753411
Energy: 0.5517692101055807
Energy: 0.6546001341541489
Energy: 0.6976818821368358
Energy: 0.641906120988983
Energy: 0.5729401557582411
Energy: 0.6685100784002114
Energy: 0.6514765622340923
Energy: 0.658745405717906
Energy: 0.5308258604099964
Energy: 0.5631903243185726
Energy: 0.6536443338536775
Energy: 0.6544516989621975
Energy: 0.6176868704845883
Energy: 0.5912352051238807
Energy: 0.6782377805019645
Energy: 0.6524807659914595
Energy: 0.6995837299534265
Energy: 0.5859223213720607
Energy: 0.5183171853041895
Energy: 0.6794019616594934
Energy: 0.5713538618189935
Energy: 0.7017195933308988
Energy: 0.587191703083385
Energy: 0.5177750572831784
Energy: 0.5603878440697271
Energy: 0.6173853123818396
Energy: 0.5826436542336664
Energy: 0.6057906129661977
Energy: 0.5698261445561773
Energy: 0.6126887469184654
Energy: 0.6251886746728987
Energy: 0.5663612349410012
Energy: 0.5327038103559628
Energy: 0.5719773112308962
Energy: 0.5776191021046746
Energy: 0.552556516415208
Energy: 0.5651191784249235
Energy: 0.5334663746584957
Energy: 0.5770308330231583
Energy: 0.5683292383651479
Energy: 0.5548078950544214
Energy: 0.5426130381938719
Energy: 0.5730841700458565
Energy: 0.5699628232769398
Energy: 0.5895399213851297
Energy: 0.5545132082325841
Energy: 0.7148551289269813
Energy: 0.5260076801675081
Energy: 0.5742192548177417
Energy: 0.6422659981111584
Energy: 0.618097389532912
Energy: 0.5152166773489866
Energy: 0.513051896545698
Energy: 0.5754001694073034
Energy: 0.7095004436283433
Energy: 0.6220436333543736
Energy: 0.6972102850497339
Energy: 0.6171969420053984
Energy: 0.6911296934362318
Energy: 0.6582951263675466
Energy: 0.6573898384774979
Energy: 0.6443560515631159
Energy: 0.5885489204507416
Energy: 0.5945561314690083
Energy: 0.6259541416284752
Energy: 0.6559758016454763
Energy: 0.593663268254306
Energy: 0.5873117775397401
Energy: 0.6708887881008161
Energy: 0.6020472546349759
Energy: 0.7310149274395243
Energy: 0.5124472776730051
Energy: 0.5133903648861612
Energy: 0.6521791447430406
Energy: 0.5924238385505455
Energy: 0.6567949469290747
Energy: 0.625623012026116
Energy: 0.5890891212815899
Energy: 0.6230113479570039
Energy: 0.5903520455526681
Energy: 0.6032755269211219
Energy: 0.6014819399116982
Energy: 0.590444279013161
Energy: 0.6030158227278737
Energy: 0.6032383144929221
Energy: 0.6417326272824525

minimum gb energy = 0.47020396467754494 eV
minimum distance =  2.60711330810875 Angstroms
sigma value = 75


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

Energy: 1.29229387725439
Energy: 0.6714872031819643
Energy: 0.5704069708723865
Energy: 0.5829114886063823
Energy: 0.6727748684560961
Energy: 0.5775159991442894
Energy: 0.6731417584514569
Energy: 0.5717137532370015
Energy: 0.5800821166105501
Energy: 0.6702340108691426
Energy: 0.6022574672520062
Energy: 0.601630706722513
Energy: 0.5722122221389015
Energy: 0.5804336659160215
Energy: 0.5774694712581708
Energy: 0.6395069906377796
Energy: 0.5784689930073891
Energy: 0.5705528396752914
Energy: 0.583698385391438
Energy: 0.5969507488853352
Energy: 0.6057270830240333
Energy: 0.7543758439748495
Energy: 0.5653340617965837
Energy: 0.582026783746491
Energy: 0.6321718772997137
Energy: 0.610104133169818
Energy: 0.572690289370063
Energy: 0.5950034963397561
Energy: 0.5887911551443832
Energy: 0.5591191845198716
Energy: 0.6283047400758013
Energy: 0.5944686950351655
Energy: 0.6011103499852346
Energy: 0.5927845898048968
Energy: 0.5594220211941902
Energy: 0.6125236069004999
Energy: 0.571166187029228
Energy: 0.578943206101311
Energy: 0.5763311047745534
Energy: 0.6336412243602378
Energy: 0.5997235000666149
Energy: 0.5857922125805838
Energy: 0.6907606393171591
Energy: 0.608816258201843
Energy: 0.5684296700943431
Energy: 0.5893651364867369
Energy: 0.5923507390259299
Energy: 0.689858687236288
Energy: 0.602071269207085
Energy: 0.5718820740402571
Energy: 0.5877349700372839
Energy: 0.5877131810585075
Energy: 0.6858672749943244
Energy: 0.5955823581483711
Energy: 0.5989271742380022
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Energy: 0.5778639699214653
Energy: 0.5725451301456487
Energy: 0.6031263169094386
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Energy: 0.5893334812658709
Energy: 0.6046030072972618
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Energy: 0.6425056691572678
Energy: 0.7467715270181265
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Energy: 0.6793960007499196
Energy: 0.7568242663928202
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Energy: 0.5848380940191081
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Energy: 0.6071851035993117
Energy: 0.5985378420590172
Energy: 0.608608995107204
Energy: 0.5994921856718165
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Energy: 0.6047313579245778
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Energy: 0.57831952524098
Energy: 0.5933637350416768
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Energy: 0.6371036164855924
Energy: 0.6899002402944892
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Energy: 0.5867058701650578
Energy: 0.6719569807895868
Energy: 0.5792096981212277
Energy: 0.6863050056719131
Energy: 0.5927990617480475
Energy: 0.5910954302774228
Energy: 0.6155230900256428
Energy: 0.6086752207529281
Energy: 0.5926413646949487
Energy: 0.615180556773743
Energy: 0.6074709920182009
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Energy: 0.5812841146749693
Energy: 0.6020053895279571
Energy: 0.6115896377928617
Energy: 0.6977528160812786
Energy: 0.5909850277432002
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Energy: 0.6960349371553082
Energy: 0.5796021124923859
Energy: 0.6883059889332771
Energy: 0.5790282056874837
Energy: 0.5781602245039755
Energy: 0.6855024687997544
Energy: 0.5983566227656119
Energy: 0.5990128826904818
Energy: 0.5867964748749058
Energy: 0.5928151428085432
Energy: 0.5781543153279173
Energy: 0.5990314653872324
Energy: 0.5991036159393114
Energy: 0.5660785897320528
Energy: 0.5920372335508212
Energy: 0.5794848506933608
Energy: 0.5897050938923222
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Energy: 0.5963144532018211
Energy: 0.5548726767472645
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Energy: 0.6003090712754473
Energy: 0.5548519716136006
Energy: 0.6693787887795187
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Energy: 0.6493174069281556
Energy: 0.6516896950837232
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Energy: 0.6746136019398555
Energy: 0.6667257818877308
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Energy: 0.6447609197179789
Energy: 0.5874587101881668
Energy: 0.6067909638585577
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minimum gb energy = 0.554227890883697 eV
minimum distance =  2.65212496383479 Angstroms
sigma value = 105


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

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Energy: 0.6257910054381394
Energy: 0.6259189195909879
Energy: 0.6836221321907483
Energy: 0.6508604415724217
Energy: 0.6850808503055241
Energy: 0.6359768708667387
Energy: 0.6262704114600838
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Energy: 0.6514674683502629
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Energy: 0.6463862854606838
Energy: 0.6471013855807203
Energy: 0.6429655967316305
Energy: 0.661974339863368
Energy: 0.6503109988794332
Energy: 0.6286442286016134
Energy: 0.646889998373076
Energy: 0.6405677678637491
Energy: 0.6550917279348523
Energy: 0.6550926992544702
Energy: 0.6574787877661675
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Energy: 0.6461864921211895
Energy: 0.6572128495608526
Energy: 0.6551290091404774
Energy: 0.6533364087811676
Energy: 0.655833392167893
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Energy: 0.6535626325167193
Energy: 0.6505532088257705
Energy: 0.6499891515356542
Energy: 0.630106392623449
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Energy: 0.6557647120942216
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Energy: 0.6272008775971033
Energy: 0.6662790892868663
Energy: 0.6232512593780876
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Energy: 0.6228653800669941
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Energy: 0.6543156549244435
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Energy: 0.6520742514099521
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Energy: 0.6520561538259746
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Energy: 0.6518722572715425
Energy: 0.6520474156100025
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Energy: 0.6760631357989997
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Energy: 0.64918798978796
Energy: 0.626558255761917
Energy: 0.6522294394242517
Energy: 0.6661446153180505
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Energy: 0.6416209309836608
Energy: 0.6991592063302395
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Energy: 0.6420230212553483
Energy: 0.6966720039262843
Energy: 0.6291909138121494
Energy: 0.6973925826073142
Energy: 0.6604125732279553
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Energy: 0.6292546036584497
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Energy: 0.6748141760593286
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Energy: 0.6634988309907084
Energy: 0.6540774356165716
Energy: 0.6311780212140564
Energy: 0.6410889239787636
Energy: 0.6567652573872724
Energy: 0.6666978851224233
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Energy: 0.6567543974832916
Energy: 0.6566809664783452
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Energy: 0.6251388045056657
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Energy: 0.653706250409521
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Energy: 0.6380543846945417
Energy: 0.6302098483673368
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Energy: 0.6580453785049635
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Energy: 0.626697613267478
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Energy: 0.658376292124665
Energy: 0.6703324679172029
Energy: 0.6394503113187783
Energy: 0.6487807254906954
Energy: 0.6160114647286108
Energy: 0.6315272320527319
Energy: 0.6242227812163076
Energy: 0.639549848798391
Energy: 0.6514444907574065
Energy: 0.6288585421157953
Energy: 0.6306580773081485
Energy: 0.6636102883367623
Energy: 0.629524047523317
Energy: 0.6879126634671558
Energy: 0.6386031704916139
Energy: 0.6616838269666474
Energy: 0.6438823409891146
Energy: 0.6292018510959383
Energy: 0.6181208474092358
Energy: 0.687116234582687
Energy: 0.6551856417626254
Energy: 0.6580713352663426
Energy: 0.6303168931630846
Energy: 0.6163072131275781
Energy: 0.6504553090838822
Energy: 0.6578604893301078
Energy: 0.6569563988987347
Energy: 0.630016716944885
Energy: 0.6163401776653289
Energy: 0.6589431782936669
Energy: 0.640882007678267
Energy: 0.6340315515817144
Energy: 0.6266423702553328
Energy: 0.6251876778762075
Energy: 0.6310103418385434
Energy: 0.6574337032312486
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Energy: 0.626553389784188
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Energy: 0.630856785109925
Energy: 0.6568839460972689
Energy: 0.6504967041925073
Energy: 0.6311690322024394
Energy: 0.6275530329332049
Energy: 0.6315109716099724
Energy: 0.6283435978673545
Energy: 0.6505985037912838
Energy: 0.6228969412500922
Energy: 0.6275704338685006
Energy: 0.6315054110030703
Energy: 0.6405084270342707
Energy: 0.6876389599725138
Energy: 0.6453640191205658
Energy: 0.6466854467611265
Energy: 0.6480838255206285
Energy: 0.6588129218595977
Energy: 0.6878513804050398
Energy: 0.641655027639543
Energy: 0.6387359601517739
Energy: 0.6484328239190431
Energy: 0.6547403846390374
Energy: 0.6461492102352151
Energy: 0.6535405544875004
Energy: 0.6510618540283997
Energy: 0.6151765349421627
Energy: 0.6335692922171106
Energy: 0.6233672951873396
Energy: 0.6537387749086753
Energy: 0.651346288859241
Energy: 0.6159224827507974
Energy: 0.6850254497687617
Energy: 0.6691700272843928
Energy: 0.6502661127019645
Energy: 0.6533278869287498
Energy: 0.6270488318932927
Energy: 0.6605371267151582
Energy: 0.6082218438333572
Energy: 0.6504900515224784
Energy: 0.653331788417056
Energy: 0.640772446768758
Energy: 0.6685296111308587
Energy: 0.6548585410097887
Energy: 0.6454156557482857
Energy: 0.6453863115047382
Energy: 0.6437811393501559
Energy: 0.6714867293767147
Energy: 0.6547523323380606
Energy: 0.6507983259421971
Energy: 0.6460055325082354
Energy: 0.6430079082083774
Energy: 0.6715336221191469
Energy: 0.6704048639124045
Energy: 0.6506500396950721
Energy: 0.646312730894307
Energy: 0.6495812225337461
Energy: 0.6508838700555348
Energy: 0.6510925913738945
Energy: 0.6526857838402613
Energy: 0.6332381258711939
Energy: 0.6498064632564042
Energy: 0.6536751709103574
Energy: 0.6526789049708561
Energy: 0.6666197060568637
Energy: 0.6690157958933972
Energy: 0.6446674936706122
Energy: 0.6519757226546599
Energy: 0.6447819458592877
Energy: 0.6637906292526383
Energy: 0.6687527324602491
Energy: 0.6473533362261022
Energy: 0.6351487463618981
Energy: 0.6721510328939335
Energy: 0.6244568705224458
Energy: 0.6538437160295365
Energy: 0.6427964605672545
Energy: 0.6352734605813084
Energy: 0.6449185210507066
Energy: 0.6104307146125635
Energy: 0.6528904117100356
Energy: 0.6469134178403052
Energy: 0.6419803995888346
Energy: 0.6274315654267583
Energy: 0.6246613700443141
Energy: 0.655175151085879
Energy: 0.6479556574341453
Energy: 0.6092577909147266
Energy: 0.6473596548104058
Energy: 0.6277378479107738
Energy: 0.6527954042580103
Energy: 0.6513898739818839
Energy: 0.6606227958168892
Energy: 0.6841742693482445
Energy: 0.6536041485407228
Energy: 0.6551272915364289
Energy: 0.6515818788898355
Energy: 0.6965935689575252
Energy: 0.630210942123412
Energy: 0.6534375302942814
Energy: 0.6655563877305076
Energy: 0.6516889667457857
Energy: 0.6923267868371683
Energy: 0.652837780265323
Energy: 0.6337931037609684
Energy: 0.6200774179600754
Energy: 0.6100673998694536
Energy: 0.6484107421255266
Energy: 0.6155879516526406
Energy: 0.633028975464706
Energy: 0.6217809253756076
Energy: 0.6156618744095389
Energy: 0.6515737391097278
Energy: 0.635753739187828
Energy: 0.6143091535111164
Energy: 0.6144878662743037
Energy: 0.614000864571286
Energy: 0.6143264169500378
Energy: 0.6238072299837442
Energy: 0.614348997817639
Energy: 0.6194506061905366
Energy: 0.6137806470296323
Energy: 0.6546701441275361

minimum gb energy = 0.60700408287472 eV
minimum distance =  2.64247546121412 Angstroms
sigma value = 165


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

Energy: 0.816605982531614
Energy: 0.5942429626901937
Energy: 0.5934265829400076
Energy: 0.6217731968689093
Energy: 0.5878492058467261
Energy: 0.8157253669148159
Energy: 0.5937726696200308
Energy: 0.5932410997861071
Energy: 0.6211604307896179
Energy: 0.587637543262175
Energy: 0.616554670036656
Energy: 0.621996868213449
Energy: 0.6156946419494459
Energy: 0.6146671052925244
Energy: 0.6142220656609593
Energy: 0.6170074476907547
Energy: 0.6186302633508224
Energy: 0.6166297437809651
Energy: 0.6154047464886944
Energy: 0.619398303404563
Energy: 0.6179452993905162
Energy: 0.6400376123430459
Energy: 0.5929767310729493
Energy: 0.6191662949687421
Energy: 0.6313953233287043
Energy: 0.6177632263339646
Energy: 0.5944187331498904
Energy: 0.6191944988192863
Energy: 0.6192962586836636
Energy: 0.6305627423881746
Energy: 0.5871394782366156
Energy: 0.620700764510752
Energy: 0.6171238260585784
Energy: 0.618968317148326
Energy: 0.6309428181188906
Energy: 0.6390522388372232
Energy: 0.6187062788983654
Energy: 0.617266219679528
Energy: 0.6190445477293087
Energy: 0.6293744802569372
Energy: 0.6243465735028483
Energy: 0.6218824899191396
Energy: 0.6144303610546346
Energy: 0.614438997958769
Energy: 0.616665459431037
Energy: 0.6204134829233624
Energy: 0.5903039705490111
Energy: 0.6141596908638852
Energy: 0.6159675896234316
Energy: 0.6171036689464875
Energy: 0.6561050871434558
Energy: 0.61678517158247
Energy: 0.5936277249674803
Energy: 0.5896699348379545
Energy: 0.5964894708466558
Energy: 0.6564924764969737
Energy: 0.6166071291060463
Energy: 0.5941178361512179
Energy: 0.5888243666691091
Energy: 0.5966751371269057
Energy: 0.6142674075511445
Energy: 0.6158096257440663
Energy: 0.620905016935039
Energy: 0.5931771160062594
Energy: 0.62108080704375
Energy: 0.6407719265910361
Energy: 0.5935321617714016
Energy: 0.621000681709767
Energy: 0.5926490658333456
Energy: 0.621512666281189
Energy: 0.6311503017767869
Energy: 0.6137663242212341
Energy: 0.6150829609462947
Energy: 0.6144771617377096
Energy: 0.6164373855901828
Energy: 0.591573709727723
Energy: 0.6136200900148921
Energy: 0.6155777180033645
Energy: 0.6146632015669802
Energy: 0.5889867917112385
Energy: 0.592523776246777
Energy: 0.6161926677705236
Energy: 0.5932217225209295
Energy: 0.6146764803404523
Energy: 0.6140846377691672
Energy: 0.5913525051379882
Energy: 0.5966633020196263
Energy: 0.5936326553143547
Energy: 0.6143058891554596
Energy: 0.6300590272669497
Energy: 0.6429588907675649
Energy: 0.6221654089629313
Energy: 0.6192444835575023
Energy: 0.6174250622757703
Energy: 0.6157346935050093
Energy: 0.6420213977775403
Energy: 0.6209249582267965
Energy: 0.6180052283911988
Energy: 0.6175613137033068
Energy: 0.6164754713562088
Energy: 0.617019509556875
Energy: 0.6178243015413739
Energy: 0.6189040648560731
Energy: 0.6189961630514821
Energy: 0.6328188164039901
Energy: 0.6198155583894923
Energy: 0.617439297922717
Energy: 0.6200361920774418
Energy: 0.6399565304308188
Energy: 0.6295228191972243
Energy: 0.6165756778339808
Energy: 0.6141716289579636
Energy: 0.6174367874619991
Energy: 0.6166379863406662
Energy: 0.6275776300591669
Energy: 0.6207148744270353
Energy: 0.6262075940966924
Energy: 0.6173598104951408
Energy: 0.6177734940905212
Energy: 0.6260638877383657
Energy: 0.6657864233215
Energy: 0.5898275413783803
Energy: 0.6147590736487749
Energy: 0.6175952296772481
Energy: 0.592451762610543
Energy: 0.5906449028254706
Energy: 0.6161180399068645
Energy: 0.6147722040527905
Energy: 0.6178169857104601
Energy: 0.5928428760097451
Energy: 0.6152513582468015
Energy: 0.621055893786136
Energy: 0.613910874955743
Energy: 0.5900531888777537
Energy: 0.6145163503823258
Energy: 0.6406261853242234
Energy: 0.6200397894211119
Energy: 0.5958896655832796
Energy: 0.5879545156980973
Energy: 0.6136946497295752
Energy: 0.5883228713809542
Energy: 0.6167113944453652
Energy: 0.6221525091271479
Energy: 0.5937994486664792
Energy: 0.6226133579616936
Energy: 0.6159794021835879
Energy: 0.6157230707391879
Energy: 0.6219929513864549
Energy: 0.5934886639644479
Energy: 0.6223051370728899

minimum gb energy = 0.5871394782366156 eV
minimum distance =  2.67061418562589 Angstroms
sigma value = 41


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

Energy: 0.5585574109832879
Energy: 0.5394644370633445
Energy: 0.5451722295344004
Energy: 0.5347917397765454
Energy: 0.5266671111652766
Energy: 0.5468329997281363
Energy: 0.5520668475977053
Energy: 0.5460950358552354
Energy: 0.5535344770932729
Energy: 0.5448909479412923
Energy: 0.590386288137425
Energy: 0.570504796331884
Energy: 0.5453680019227156
Energy: 0.5503163193150595
Energy: 0.559593646573094
Energy: 0.5725027853007626
Energy: 0.5327485673080187
Energy: 0.5537095841855634
Energy: 0.5666916965594497
Energy: 0.5551253459785244
Energy: 0.542631826383432
Energy: 0.5862963828126272
Energy: 0.5870656105095692
Energy: 0.5588170664092793
Energy: 0.5585291670936823
Energy: 0.5473320093951461
Energy: 0.5429845403922641
Energy: 0.5873160228666866
Energy: 0.5761143813649746
Energy: 0.5650079591867169
Energy: 0.573547891574079
Energy: 0.5689923639756189
Energy: 0.5709344579797799
Energy: 0.5574219057751434
Energy: 0.6231121495375195
Energy: 0.5732120973337941
Energy: 0.579674250503974
Energy: 0.5449701023656075
Energy: 0.5421350594960356
Energy: 0.6242411834292616
Energy: 0.5784119129377552
Energy: 0.5692757978778619
Energy: 0.5702307176557071
Energy: 0.5673327528311842
Energy: 0.5580928381641606
Energy: 0.5637760725704892
Energy: 0.5425879113154065
Energy: 0.5449563049346029
Energy: 0.5725051196535677
Energy: 0.600291270619269
Energy: 0.5620331465970368
Energy: 0.5706185743046058
Energy: 0.5744949322088146
Energy: 0.5437795667879917
Energy: 0.5599148914471291
Energy: 0.5748798848602942
Energy: 0.5598411309268154
Energy: 0.5905654224228309
Energy: 0.5584969222540038
Energy: 0.5582105452545867
Energy: 0.5767223024035075
Energy: 0.5804364031511589
Energy: 0.5712579839119106
Energy: 0.5570631574906213
Energy: 0.5743429780631476
Energy: 0.5908353934357224
Energy: 0.5670651108796388
Energy: 0.572079452599629
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Energy: 0.5544161136553099
Energy: 0.5677761770906395
Energy: 0.5715730821965238
Energy: 0.5670080174472168
Energy: 0.5596321663304699
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Energy: 0.556844534039065
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Energy: 0.5691061912055342
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Energy: 0.570585113105416
Energy: 0.5724986954147462
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Energy: 0.5681034821746048
Energy: 0.5541286597055156
Energy: 0.5693189234380467
Energy: 0.5587758832138517
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Energy: 0.5679490224741048
Energy: 0.5622626601466405
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Energy: 0.55599887120986
Energy: 0.5739889417261616
Energy: 0.5962961827555018
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Energy: 0.5449153411646058
Energy: 0.5587133542851281
Energy: 0.5631825922403939
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Energy: 0.5577940423567869
Energy: 0.5570849666372558
Energy: 0.5598149869971444
Energy: 0.6402970365301249
Energy: 0.5352180929619406
Energy: 0.542390919819998
Energy: 0.5714668515983217
Energy: 0.5707295926257512
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Energy: 0.5602720865898068
Energy: 0.5731899244692096
Energy: 0.5441408576168906
Energy: 0.5413370633249504
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Energy: 0.574425156044113
Energy: 0.565928018771063
Energy: 0.5455035233270815
Energy: 0.5470054718779718
Energy: 0.5732186607018215
Energy: 0.5513498913450114
Energy: 0.555403806870475
Energy: 0.5469363599300808
Energy: 0.5527723113254889
Energy: 0.5720782138971529
Energy: 0.5646831264976113
Energy: 0.5555389117145801
Energy: 0.5482453316658376
Energy: 0.5617862449723166
Energy: 0.5557844105271109
Energy: 0.5597642960024769
Energy: 0.5632821733443801
Energy: 0.5479127551170694
Energy: 0.5384293804905258
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Energy: 0.5602899481422188
Energy: 0.537474653699329
Energy: 0.5371526141631007
Energy: 0.5497648126449889
Energy: 0.5443800798953233
Energy: 0.5699936056607384
Energy: 0.5653322332358436
Energy: 0.6130132428814177
Energy: 0.5679784808725462
Energy: 0.5538863791002173
Energy: 0.5644590855785927
Energy: 0.5603949222919469
Energy: 0.5701336463651434
Energy: 0.5471761388749451
Energy: 0.5522540672686203
Energy: 0.5735621128880621
Energy: 0.5596796905465244
Energy: 0.557392854114398
Energy: 0.5805822481222789
Energy: 0.5536527806648067
Energy: 0.5825166539729408
Energy: 0.5598495458373213
Energy: 0.557024590336426
Energy: 0.5841003208892044
Energy: 0.5595084162539425
Energy: 0.5525061826475669
Energy: 0.5583088188152839
Energy: 0.557881527087859
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Energy: 0.571712598253886
Energy: 0.5675734431135219
Energy: 0.5585198824482545
Energy: 0.5583044420964443
Energy: 0.580193023403564
Energy: 0.551826137517755
Energy: 0.5741080448513867
Energy: 0.6066960059758731
Energy: 0.5979273213391555
Energy: 0.5708709236754664
Energy: 0.5674205334701609
Energy: 0.5766978875446649
Energy: 0.5794590036560028
Energy: 0.5675313667294557
Energy: 0.5811696009013918
Energy: 0.571176671336143
Energy: 0.5732547247297485
Energy: 0.5724822166880674
Energy: 0.5721920798965217
Energy: 0.6204288906185315
Energy: 0.5940544987847302
Energy: 0.5760742529543715
Energy: 0.5721575780779609
Energy: 0.5669613352613375
Energy: 0.6171541611340016
Energy: 0.5747591014813886
Energy: 0.5675071140852149
Energy: 0.5444859385442615
Energy: 0.5681417489473171
Energy: 0.5825525934697114
Energy: 0.5739357750389311
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Energy: 0.5607407146590758
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Energy: 0.5675445926453309
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Energy: 0.5650712911757392
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Energy: 0.5679343779546722
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Energy: 0.5792957583658643
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Energy: 0.5764083423093926
Energy: 0.5846761036442152
Energy: 0.5690782644048983
Energy: 0.5750508082962479
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Energy: 0.5419349320324856
Energy: 0.5718506004214948
Energy: 0.5700313635940379
Energy: 0.5755031123741822
Energy: 0.5651788298420541
Energy: 0.5559771927067448
Energy: 0.5684183104598508
Energy: 0.5447308883206643
Energy: 0.5290998215643103
Energy: 0.5284818954525756
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Energy: 0.5500314138826122
Energy: 0.5594267552854391
Energy: 0.5594568754068922
Energy: 0.5572037205306609
Energy: 0.5272370005716353
Energy: 0.5349409331143414
Energy: 0.5507184266094507
Energy: 0.549935464390648
Energy: 0.5344260855671609
Energy: 0.5426253306368275
Energy: 0.5351517782846857
Energy: 0.5503985650021898
Energy: 0.5433876044266024
Energy: 0.5600375861986304
Energy: 0.5541821457278161
Energy: 0.5480319785989393
Energy: 0.5962539186404023
Energy: 0.5458540716715721
Energy: 0.5445953577439375
Energy: 0.5318071146847891
Energy: 0.5518869399968569
Energy: 0.5605515643948455
Energy: 0.5552036698276336
Energy: 0.5454595107273866
Energy: 0.5622091745685154
Energy: 0.5633486270648456
Energy: 0.5352389653052645
Energy: 0.5475598140435425
Energy: 0.5622691387070298
Energy: 0.5427797337297222
Energy: 0.5455280815620668
Energy: 0.5344471067654918
Energy: 0.5437420496535716
Energy: 0.544362920635384
Energy: 0.5580956513522813

minimum gb energy = 0.5266671111652766 eV
minimum distance =  2.69012910625521 Angstroms
sigma value = 185


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

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Energy: 0.32887156090326064
Energy: 0.3890009471218926
Energy: 0.3567345306650219
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Energy: 0.2939206947707839
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Energy: 0.3012684715606325
Energy: 0.23130926438316057
Energy: 0.3565666593296152
Energy: 0.36671952854326906
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Energy: 0.3461902683076375
Energy: 0.22952638104616493
Energy: 0.3781408791739731
Energy: 0.3920580190969913
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Energy: 0.36169080903449374
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Energy: 0.36540004065705023
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Energy: 0.37712965321950387
Energy: 0.39789477374228294
Energy: 0.4755765261142544
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Energy: 0.23233918701208112
Energy: 0.2999840603107435
Energy: 0.4454397507036878
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Energy: 0.39513273895978496
Energy: 0.3985646852444063
Energy: 0.42525158286854725
Energy: 0.3523929298486373
Energy: 0.39658597854409094
Energy: 0.39760508837902825
Energy: 0.37798929586224705
Energy: 0.34635208970875253
Energy: 0.35631049910205154
Energy: 0.39230467305930167
Energy: 0.37382900208937075
Energy: 0.39489675460505924
Energy: 0.32810634799353944
Energy: 0.27622386941902816
Energy: 0.38961829511584367
Energy: 0.37810217499708887
Energy: 0.38954635504928786
Energy: 0.43251006428914346
Energy: 0.5155677024953754
Energy: 0.39921459144225707
Energy: 0.3819728552603218
Energy: 0.2989835838174719
Energy: 0.40415990218802733
Energy: 0.2355277989229841
Energy: 0.41199561678658575
Energy: 0.3447547435228264
Energy: 0.39011051917909695
Energy: 0.4059850051381484
Energy: 0.3036800836680745
Energy: 0.38312303632698747
Energy: 0.4958558118786328
Energy: 0.4090631793433773
Energy: 0.41565894065814213
Energy: 0.33144730232100283
Energy: 0.35836117364671993
Energy: 0.33706524603523846
Energy: 0.41898762998445604
Energy: 0.40968119365619204
Energy: 0.3461155092905165
Energy: 0.4943694298811624

minimum gb energy = 0.22859010948029118 eV
minimum distance =  2.66702461822427 Angstroms
sigma value = 33


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

Energy: 0.5149482949775369
Energy: 0.48647786052415315
Energy: 0.5190021059560125
Energy: 0.5093091401835943
Energy: 0.4774334498061011
Energy: 0.47535106104738756
Energy: 0.4857351016233216
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Energy: 0.5102234980773698
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Energy: 0.48106859572503247
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Energy: 0.49270722218631363
Energy: 0.4858559386005843
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Energy: 0.49185755527503233
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Energy: 0.5010994368667595
Energy: 0.49213562962760943
Energy: 0.49188776217097996
Energy: 0.5044714700505535
Energy: 0.4835476519420885
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Energy: 0.48343196093990526
Energy: 0.4831421334241959
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Energy: 0.49209555481902933
Energy: 0.49319596725528836
Energy: 0.48967858198387854
Energy: 0.4930785633685686
Energy: 0.4867231800121151
Energy: 0.49257648681037264
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Energy: 0.5138187754803554
Energy: 0.49096235778121944

minimum gb energy = 0.4735603689815142 eV
minimum distance =  2.67452602012518 Angstroms
sigma value = 219


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

Energy: 0.6448663402648603
Energy: 0.6599379330190881
Energy: 0.6420784771682887
Energy: 0.6424550946929817
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Energy: 0.6399981337979144
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Energy: 0.6424089024855397
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Energy: 0.6411110652627999
Energy: 0.6388434900003398
Energy: 0.6440350861307687
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Energy: 0.6401171095921209
Energy: 0.6499356463306475
Energy: 0.6391660437872441
Energy: 0.6634521297503777
Energy: 0.6510947839290048
Energy: 0.6410665261746069
Energy: 0.6358869416119729
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Energy: 0.642477980141618
Energy: 0.6421197079882459
Energy: 0.6372333289070143
Energy: 0.6486764145033345
Energy: 0.6418329160044193
Energy: 0.6429464622879053
Energy: 0.6411184407354845

minimum gb energy = 0.6343476077685499 eV
minimum distance =  2.67603222945802 Angstroms
sigma value = 15


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

Energy: 1.1361347160520063
Energy: 0.7318945728953138
Energy: 0.7375210269633874
Energy: 0.7284468628137301
Energy: 0.7433059120446845
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Energy: 0.7265521029393345
Energy: 0.741555684369164
Energy: 0.7470910692246812
Energy: 0.7477240783765141
Energy: 0.7487502459364039
Energy: 0.7397008248620577
Energy: 0.7379554530633329
Energy: 0.7323745968140576
Energy: 0.731029595623189
Energy: 0.756092016006557
Energy: 0.7320387956613745
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Energy: 0.7595157908378064
Energy: 0.7473707935237599
Energy: 0.7295558574284692
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minimum gb energy = 0.7160089222558937 eV
minimum distance =  2.62088172850718 Angstroms
sigma value = 293


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

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Energy: 0.7580536049680033
Energy: 0.7315249464875045
Energy: 0.7413109342127688
Energy: 0.7400020635509559
Energy: 0.7484879427071024
Energy: 0.758446956829852
Energy: 0.7278780361920474
Energy: 0.7530492084323898
Energy: 0.7398877716456297
Energy: 0.7320936717685549
Energy: 0.746657396662884
Energy: 0.7732873869726233
Energy: 0.7282447513981655
Energy: 0.7452544399347956
Energy: 0.7297912027482666
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Energy: 0.7289837293995567
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Energy: 0.7545907699191459
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Energy: 0.7260913172629202
Energy: 0.7049919085133887
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Energy: 0.7266761232890749
Energy: 0.7367037864576267
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Energy: 0.7438216432846564
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Energy: 0.7280024731034104
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Energy: 0.7202297698308229
Energy: 0.7392547630769966
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Energy: 0.7201675203452546
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Energy: 0.7262622139604178
Energy: 0.7466983900388053
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Energy: 0.7204486500494313
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Energy: 0.7456413206302904
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Energy: 0.7036968414089874
Energy: 0.7370256611399745
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Energy: 0.7356301837749698
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Energy: 0.726147839563351
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Energy: 0.7359810545905746
Energy: 0.7349247414437625
Energy: 0.7416323335290474
Energy: 0.725841792156994
Energy: 0.7154897684269933
Energy: 0.7409775109899398
Energy: 0.732988012217593
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Energy: 0.7640234822820384
Energy: 0.7306343905069727
Energy: 0.7298735012462015
Energy: 0.7473475460198923
Energy: 0.7264158411631743
Energy: 0.7155518037739241
Energy: 0.7617310939925875
Energy: 0.7282014341698317
Energy: 0.7251939092464269
Energy: 0.7453445431423229
Energy: 0.7581259991505422
Energy: 0.7593257978050165
Energy: 0.7279383091154566
Energy: 0.7243303738033116
Energy: 0.7413271399305809
Energy: 0.7129746277083899
Energy: 0.7402784094027788
Energy: 0.7357669660720332
Energy: 0.72709217046656
Energy: 0.7481423292598887
Energy: 0.7266552368358302
Energy: 0.7391539889824387
Energy: 0.7358247945968626
Energy: 0.7253323465363498
Energy: 0.7323117837399764
Energy: 0.7368169810308279
Energy: 0.7413545075812569
Energy: 0.7442172093530274
Energy: 0.737800972491652
Energy: 0.7202724601918162
Energy: 0.7247834071126442
Energy: 0.7266136849546895
Energy: 0.7455817442415792
Energy: 0.7340610624861844
Energy: 0.7202495008488865
Energy: 0.7253093071797401
Energy: 0.7278598436977184
Energy: 0.7671850237006883
Energy: 0.7284217042605011
Energy: 0.7266070559208819
Energy: 0.7376486742304496
Energy: 0.7572572698140615
Energy: 0.7594195931532775
Energy: 0.7660162165704304
Energy: 0.7295685178073288
Energy: 0.7410580409638772
Energy: 0.7336390245921177
Energy: 0.7624773687023735
Energy: 0.770138871404481
Energy: 0.7349721529716957
Energy: 0.739820523300912
Energy: 0.7268924367398826
Energy: 0.7357801938572804
Energy: 0.7765183946474264
Energy: 0.7303298021506331
Energy: 0.7510293305563445
Energy: 0.708562717664286
Energy: 0.7482607315760531
Energy: 0.7328376719388778
Energy: 0.7260912059342751
Energy: 0.7412541785042475
Energy: 0.7277122096034782
Energy: 0.7333824928018808
Energy: 0.729600640335724
Energy: 0.7344515731475769
Energy: 0.7385175155062532

minimum gb energy = 0.7036968414089874 eV
minimum distance =  2.63953234312003 Angstroms
sigma value = 293


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

Energy: 0.6964735889313937
Energy: 0.7084922657056782
Energy: 0.7504605356127868
Energy: 0.7087812539568038
Energy: 0.696501894263572
Energy: 0.6955866284793647
Energy: 0.709322764406225
Energy: 0.7499323246702051
Energy: 0.7088275231813721
Energy: 0.6958561921143043
Energy: 0.7438537617550003
Energy: 0.7041721053424062
Energy: 0.7035190869369967
Energy: 0.7023939637421175
Energy: 0.7039119307907957
Energy: 0.7430646849893059
Energy: 0.7047447997038591
Energy: 0.6963638967964292
Energy: 0.7034467699848587
Energy: 0.7106054129700532
Energy: 0.7039175908506542
Energy: 0.7040205739616999
Energy: 0.7056665510434158
Energy: 0.7115914033157829
Energy: 0.7456763236980991
Energy: 0.7032571430065377
Energy: 0.7033301877982466
Energy: 0.7051227698096265
Energy: 0.7511243363881461
Energy: 0.7451400121600862
Energy: 0.7525789176352451
Energy: 0.6953880895272072
Energy: 0.6951224785941859
Energy: 0.703655185375882
Energy: 0.7530096108340775
Energy: 0.7523498681279778
Energy: 0.6959059400149478
Energy: 0.6954901924427358
Energy: 0.7037912890125695
Energy: 0.6961914707229366
Energy: 0.7041287852405921
Energy: 0.6972813321639141
Energy: 0.6956859645473684
Energy: 0.7073886715196754
Energy: 0.7093473391176188
Energy: 0.703432032121336
Energy: 0.6970760586079023
Energy: 0.695235834124082
Energy: 0.7042779231104302
Energy: 0.7045226201919768
Energy: 0.7042798196522412
Energy: 0.7517106478079358
Energy: 0.7098932369401263
Energy: 0.7044869399729694
Energy: 0.6974142374854795
Energy: 0.7043278062512586
Energy: 0.7502432696759663
Energy: 0.708933150389501
Energy: 0.7061003830136239
Energy: 0.700713749230401
Energy: 0.7551280782415021
Energy: 0.693284054227476
Energy: 0.7066148427406257
Energy: 0.7043810762610885
Energy: 0.7046402736176621
Energy: 0.7111368863607078
Energy: 0.6921928226845898
Energy: 0.7122818071275491
Energy: 0.7045542517785938
Energy: 0.7044694471424179
Energy: 0.7082598102419138
Energy: 0.7435744025001358
Energy: 0.7093201490758483
Energy: 0.6960317614214601
Energy: 0.6986523440832946
Energy: 0.7154219254046729
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Energy: 0.7084108277965697
Energy: 0.697135581764517
Energy: 0.6961241864206759
Energy: 0.7043850567513533
Energy: 0.6951778450422453
Energy: 0.7028583237951133
Energy: 0.6949427524192889
Energy: 0.7436305841808748
Energy: 0.7043232375331266
Energy: 0.703033957896279
Energy: 0.7028843683516085
Energy: 0.6949013146151208
Energy: 0.7485426948967161
Energy: 0.7061671677138555
Energy: 0.7059359139877275
Energy: 0.7437273460782745
Energy: 0.7527999920063627
Energy: 0.7075845074085334
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Energy: 0.7081594722655896
Energy: 0.7447836662937007
Energy: 0.714949551530417
Energy: 0.7040943622424025
Energy: 0.6954600927999607
Energy: 0.711334885644897
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Energy: 0.7105729524102669
Energy: 0.7469602649831786
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Energy: 0.712335272118706
Energy: 0.6918987659531758
Energy: 0.7523011725213141
Energy: 0.7470006130600746
Energy: 0.6964714649432474
Energy: 0.7085775783961431
Energy: 0.7496389764738299
Energy: 0.7087617203300006
Energy: 0.6965523373156708
Energy: 0.6961779092072224
Energy: 0.7090042228826104
Energy: 0.7509485003659604
Energy: 0.7087061806944335
Energy: 0.6960284988734473
Energy: 0.7429332380199952
Energy: 0.7045658817937538
Energy: 0.7032884487830596
Energy: 0.702953220202937
Energy: 0.7038123851107381
Energy: 0.743529819817318
Energy: 0.7043803346203367
Energy: 0.695998064721544
Energy: 0.7034219093656429
Energy: 0.7120183915140864
Energy: 0.7039354547302237
Energy: 0.7041597499595134
Energy: 0.7058866459400551
Energy: 0.7503298031705105
Energy: 0.7455114156420629
Energy: 0.7031234542930075
Energy: 0.7046226105476029
Energy: 0.7048592668298215
Energy: 0.750298038463932
Energy: 0.7448063567888741
Energy: 0.7530735969785056
Energy: 0.6954638351709478
Energy: 0.6950400786904413
Energy: 0.7036808372562415
Energy: 0.7529935810352993
Energy: 0.7524517289282504
Energy: 0.6959446131564333
Energy: 0.6954299321992372
Energy: 0.7036133013149342
Energy: 0.7453786688447821
Energy: 0.7043131938316456
Energy: 0.6974388476991085
Energy: 0.6957457472483892
Energy: 0.7055486898064567
Energy: 0.7096169832484691
Energy: 0.7033667848764779
Energy: 0.695953484940303
Energy: 0.6952593967307487
Energy: 0.7048152022463536
Energy: 0.7044822058647472
Energy: 0.7041734474852089
Energy: 0.751687374963365
Energy: 0.7096288480212377
Energy: 0.7040217542913487
Energy: 0.6966960628959442
Energy: 0.7044336044160031
Energy: 0.7508364099849338
Energy: 0.708959194843914
Energy: 0.704929883484007
Energy: 0.7008909926512775
Energy: 0.7524222226418993
Energy: 0.6931219291095698
Energy: 0.7087083906707712
Energy: 0.7043991166102176
Energy: 0.7054204982106228
Energy: 0.7537692164637164
Energy: 0.6920710434265984
Energy: 0.7126094775665068
Energy: 0.7043496731738009
Energy: 0.7045643229417874
Energy: 0.7160765765152445
Energy: 0.7428322360811395
Energy: 0.7126906285240842
Energy: 0.6958705802336755
Energy: 0.698134000044929
Energy: 0.7250202259275929
Energy: 0.7422248634261404
Energy: 0.7087809739877855
Energy: 0.696657377560931
Energy: 0.6961402587463235
Energy: 0.7046987287387741
Energy: 0.6960980162717817
Energy: 0.7022232778430098
Energy: 0.6949357673923336
Energy: 0.7452852288121226
Energy: 0.7044172461489664
Energy: 0.7030229708515071
Energy: 0.7024055062545875
Energy: 0.6950818030852574
Energy: 0.7053212592863263
Energy: 0.7057579691310645
Energy: 0.7054954760600742
Energy: 0.7425567927888137
Energy: 0.7543060386681161
Energy: 0.7070857672115171
Energy: 0.7083131601155039
Energy: 0.7077393137620841
Energy: 0.7444495901852943
Energy: 0.7162719597576627
Energy: 0.7044519457769862
Energy: 0.6951086528518361
Energy: 0.7111560119963938
Energy: 0.7057825078976128
Energy: 0.7093737899993872
Energy: 0.7457293090733026
Energy: 0.6952652634114842
Energy: 0.7121257860350877
Energy: 0.691676662544324
Energy: 0.7099649464055581
Energy: 0.7459410168991578

minimum gb energy = 0.691676662544324 eV
minimum distance =  2.66963031834211 Angstroms
sigma value = 15


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

Energy: 1.2107988819965534
Energy: 0.7578565092259373
Energy: 0.7393798356391255
Energy: 0.6921139822674938
Energy: 0.7450635453213771
Energy: 0.6966341180975255
Energy: 0.7902909591731032
Energy: 0.7626686894665958
Energy: 0.7019203081880847
Energy: 0.7777769711327964
Energy: 0.6934160279400658
Energy: 0.7495503171713326
Energy: 0.7102819011017812
Energy: 0.711263515600431
Energy: 0.7193849878215333
Energy: 0.6857028345223319
Energy: 0.7601167497619881
Energy: 0.7100703777027796
Energy: 0.7658476354712193
Energy: 0.7333912314342129
Energy: 0.7733701214929436
Energy: 0.7112898387165199
Energy: 0.7654859268612632
Energy: 0.7310937110049821
Energy: 0.699090845089334
Energy: 0.7734265473287916
Energy: 0.7284792811513396
Energy: 0.6911779839165367
Energy: 0.7260412629431491
Energy: 0.7924823175549699
Energy: 0.7276547501821873
Energy: 0.6927498095675522
Energy: 0.7366781443555097
Energy: 0.7772098632992478
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Energy: 0.7313431547863825
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Energy: 0.7935161379604155
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Energy: 0.6921798565546725
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Energy: 0.8594009904979361
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Energy: 0.694996510805301
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Energy: 0.6930597647608796
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Energy: 0.7002274562018866
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Energy: 0.6950647076424915
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Energy: 0.7664051910898555
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Energy: 0.7621966950797555
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Energy: 0.857882017774644
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Energy: 0.6982166186549648
Energy: 0.8622674571588895
Energy: 0.7390954574452473
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Energy: 0.6966082062063679
Energy: 0.737734239931849
Energy: 0.6978848022622542
Energy: 0.7004715780612971
Energy: 0.6983760030016468
Energy: 0.6996685764131664
Energy: 0.7045989017896974
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Energy: 0.6991634122525573
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Energy: 0.698729235917555
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Energy: 0.7019986592250824
Energy: 0.696544577182014
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Energy: 0.6990855997785771
Energy: 0.8066459992638302
Energy: 0.7600031196189875
Energy: 0.6967445614114784
Energy: 0.6859119367103723
Energy: 0.798351229373938
Energy: 0.7985795769999794
Energy: 0.7593442030396266
Energy: 0.6864715008614746
Energy: 0.6877880276529773
Energy: 0.7637561746475381
Energy: 0.739999274864518
Energy: 0.7494650357352814
Energy: 0.7033846480182124
Energy: 0.6987079055390796
Energy: 0.743347262101632
Energy: 0.7405389792112637
Energy: 0.7202753538636231
Energy: 0.7035371386041763
Energy: 0.7012932019226554
Energy: 0.7880557966284542
Energy: 0.7140146098970208
Energy: 0.7622411150541872
Energy: 0.7819661344628478
Energy: 0.7480288264691065
Energy: 0.7559851485117487
Energy: 0.7131045679007812
Energy: 0.7630162977431146
Energy: 0.6752906021281666
Energy: 0.7624453691414038
Energy: 0.7556594593484391
Energy: 0.695041092594144
Energy: 0.7359066378961091
Energy: 0.7951949268645407
Energy: 0.7142636923271235
Energy: 0.745824606504151
Energy: 0.6951328846046316
Energy: 0.748406293386003
Energy: 0.7951904757170657
Energy: 0.7130130834332864
Energy: 0.7501040369469791
Energy: 0.7156381383746092
Energy: 0.7959612970848887
Energy: 0.6996611637242021
Energy: 0.7332818371266798
Energy: 0.7271999476485448
Energy: 0.7810839883126122
Energy: 0.7955155463805975
Energy: 0.6996607797085105
Energy: 0.7334046503187246
Energy: 0.7480768770559658
Energy: 0.6858409257072915
Energy: 0.7358802932285501
Energy: 0.8190929599570271
Energy: 0.7896401896011304
Energy: 0.777126469999855
Energy: 0.6871036319543867
Energy: 0.742706393048285
Energy: 0.8312834972123152
Energy: 0.7765579944978401
Energy: 0.7794246265951663
Energy: 0.7259543219277816
Energy: 0.8450753600474415
Energy: 0.8456956148881076
Energy: 0.7329075220926319
Energy: 0.6930247090848056
Energy: 0.7240565563938813
Energy: 0.8456188288647263
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Energy: 0.731699218480011
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Energy: 0.7043878385506597
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Energy: 0.7008702536679638
Energy: 0.7007821857402508
Energy: 0.7351806303772641
Energy: 0.7002308943541795
Energy: 0.6956166493673062
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Energy: 0.6990106126947883
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Energy: 0.6863337267636218
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Energy: 0.7563518230823394
Energy: 0.7975821933880161
Energy: 0.7656951611125332
Energy: 0.6860144901255375
Energy: 0.6859389848971169
Energy: 0.7569101571180673
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Energy: 0.7001643172532594
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Energy: 0.6862881294514287
Energy: 0.6993837921740996
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Energy: 0.7721143201527563
Energy: 0.7120135987390402
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Energy: 0.7076894881918869
Energy: 0.7184485685524603
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Energy: 0.7134665233856137
Energy: 0.7473836934310389
Energy: 0.6970008480350264
Energy: 0.7329291478852505
Energy: 0.7951970580643688
Energy: 0.7123826548567551
Energy: 0.7637279817997956
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Energy: 0.7970554752239012
Energy: 0.794361005478553
Energy: 0.7136529997266009
Energy: 0.7806622120154225
Energy: 0.7948735630512717
Energy: 0.8013689875364632
Energy: 0.7935812842495906
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Energy: 0.7753178188755102
Energy: 0.7267678658250901
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Energy: 0.7812409268816322
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Energy: 0.7660283617956942
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Energy: 0.84707101942874
Energy: 0.847095513788599
Energy: 0.7276459538615678
Energy: 0.6924169829070203
Energy: 0.7529323059702303
Energy: 0.8473848616561047
Energy: 0.8461685389238749
Energy: 0.744892793073711
Energy: 0.692008691371368
Energy: 0.6938711668496488
Energy: 0.7848179774067441
Energy: 0.6957945301011738
Energy: 0.6934129618272176
Energy: 0.6950986587759161
Energy: 0.6952171512653936
Energy: 0.8080548822066003
Energy: 0.6943384636126996
Energy: 0.6962036611464959
Energy: 0.6953556192670348
Energy: 0.6961138123088841
Energy: 0.776143236875239
Energy: 0.7232107400505591
Energy: 0.691703491053535
Energy: 0.6924764498379485
Energy: 0.729846351998473
Energy: 0.7757317746168534
Energy: 0.7120220713506656
Energy: 0.6918842023094808
Energy: 0.6925311020752186
Energy: 0.7286078909014695
Energy: 0.6925579871007949
Energy: 0.6994048212581012
Energy: 0.6979308176127769
Energy: 0.7171141070555768
Energy: 0.7190935413057319
Energy: 0.6890604093642376
Energy: 0.6969756269770955
Energy: 0.697698920751211
Energy: 0.7311425551023025
Energy: 0.6932873015959164
Energy: 0.6923689846987117
Energy: 0.7284577364201772
Energy: 0.8611141874173368
Energy: 0.6981600038418794
Energy: 0.6857572706434075
Energy: 0.6967071313100326
Energy: 0.7262244262874351
Energy: 0.863614735756054
Energy: 0.6988206113013964
Energy: 0.6958115980163619
Energy: 0.6934926205745418
Energy: 0.6954252097143745
Energy: 0.6929176364427198
Energy: 0.6866870270120918
Energy: 0.6986230383971676
Energy: 0.6977016302693673
Energy: 0.700138228170513
Energy: 0.716506596027543
Energy: 0.6967271916570096
Energy: 0.6932429542804464
Energy: 0.6887643806346362
Energy: 0.7958463044076631
Energy: 0.7942678599775891
Energy: 0.7195710550510966
Energy: 0.6864213456959554
Energy: 0.7351266696622126
Energy: 0.796561983629101
Energy: 0.7661608085130394
Energy: 0.7050413972070352
Energy: 0.6916402473750305
Energy: 0.7523130343403072
Energy: 0.7657217558681259
Energy: 0.6939373964164014
Energy: 0.6759614711937239
Energy: 0.6983570421852778
Energy: 0.7589662518016027
Energy: 0.7986740765728984
Energy: 0.6941230176945997
Energy: 0.6787907076109804

minimum gb energy = 0.6752906021281666 eV
minimum distance =  2.6428283140359 Angstroms
sigma value = 437


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

Energy: 0.9690822125303383
Energy: 0.6786318402807879
Energy: 0.7219121688697485
Energy: 0.6906752899779979
Energy: 0.6530145839021898
Energy: 0.6930896348976834
Energy: 0.6801656696934093
Energy: 0.7216183516145879
Energy: 0.6465627800060546
Energy: 0.6631530893187818
Energy: 0.6412163670671355
Energy: 0.7338081464380792
Energy: 0.6423745737026162
Energy: 0.7746898549458494
Energy: 0.6593186902482588
Energy: 0.6404902511591889
Energy: 0.688190772635902
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Energy: 0.7331081989501583
Energy: 0.6586421907188849
Energy: 0.7108268663413222
Energy: 0.7190136820994577
Energy: 0.7319671452982938
Energy: 0.6604316502030257
Energy: 0.6442551727292158
Energy: 0.7111124362304523
Energy: 0.719924521652044
Energy: 0.7323534084841886
Energy: 0.6595565360496732
Energy: 0.7114903487260101
Energy: 0.6590576398197613
Energy: 0.6615603173685202
Energy: 0.7293231197465642
Energy: 0.7092249435150043
Energy: 0.7113593768460384
Energy: 0.6597261476828276
Energy: 0.6594320319803849
Energy: 0.7297012237926279
Energy: 0.708926563751675
Energy: 0.6409255287726129
Energy: 0.6507636913133197
Energy: 0.681599828958486
Energy: 0.6573833638001624
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Energy: 0.6922628244751463
Energy: 0.6555808875807176
Energy: 0.7352191461476094
Energy: 0.6582446184183465
Energy: 0.6579827165094071
Energy: 0.6379700531754168
Energy: 0.6739400298184419
Energy: 0.6598512563902517
Energy: 0.6393118913799939
Energy: 0.6579460594860932
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Energy: 0.6742317891483856
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Energy: 0.6393674132250879
Energy: 0.6583449964631681
Energy: 0.6894119664022667
Energy: 0.7129885286173352
Energy: 0.7068010844678918
Energy: 0.7084032181752304
Energy: 0.6600835648558603
Energy: 0.6671932747471392
Energy: 0.7108043141941294
Energy: 0.7070209465698063
Energy: 0.7076131073882496
Energy: 0.6602122060357312
Energy: 0.66767459121397
Energy: 0.7185150588307317
Energy: 0.7075161932565259
Energy: 0.6591513614336704
Energy: 0.6574572912055516
Energy: 0.7333603754270338
Energy: 0.718626160092816
Energy: 0.7076758204229255
Energy: 0.6594146500347434
Energy: 0.6573562903975205
Energy: 0.7331996793150686
Energy: 0.6581777435651177
Energy: 0.7284879567783092
Energy: 0.67793604864777
Energy: 0.7325713671112251
Energy: 0.6590642590058076
Energy: 0.6573739122568004
Energy: 0.728505206442754
Energy: 0.6781063555293364
Energy: 0.666730856817509
Energy: 0.6582543281044814
Energy: 0.6414466601449802
Energy: 0.6573470349570559
Energy: 0.6425079689445392
Energy: 0.6407096340646536
Energy: 0.6809131901780954
Energy: 0.7105304627084261
Energy: 0.6609760981507729
Energy: 0.6429834678544684
Energy: 0.6410367505404507
Energy: 0.6799851948957198
Energy: 0.6414498707613573
Energy: 0.63973955179408
Energy: 0.6444253286819814
Energy: 0.6893061289497842
Energy: 0.638801060328549
Energy: 0.6411459225499376
Energy: 0.6395275629236749
Energy: 0.6781475427825246
Energy: 0.6892378409109275
Energy: 0.6618018372522187
Energy: 0.6406583857728717
Energy: 0.6422124267023095
Energy: 0.6425538284359648
Energy: 0.7153898289994705
Energy: 0.6415056791072137
Energy: 0.6412818453920442
Energy: 0.6433422114352874
Energy: 0.6427041823169228
Energy: 0.7409193795775034
Energy: 0.6407146899566705
Energy: 0.6408846194592719
Energy: 0.6416796990610849
Energy: 0.671745325135146
Energy: 0.7310620050655859
Energy: 0.6407077395189522
Energy: 0.6411074722664142
Energy: 0.6421530244304595
Energy: 0.6714778677785964
Energy: 0.7306845699451138
Energy: 0.6406927617601684
Energy: 0.6396942272989863
Energy: 0.6454013246544589
Energy: 0.7636491761899337
Energy: 0.6451666072705899
Energy: 0.6424334384337843
Energy: 0.6729673136270512
Energy: 0.6428549442063534
Energy: 0.7987527392807189
Energy: 0.645054719388472
Energy: 0.6721822129792479

minimum gb energy = 0.6379700531754168 eV
minimum distance =  2.69197716458454 Angstroms
sigma value = 33