Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080053472518922
cohesive_energy=3.9303141807648228
mass=196.9665
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=[1.068807226011498e-19, 1.72237192508268e-19, 2.270284290378e-19, 2.7505046928868197e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57769101336578e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29043385687812e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06388753471942e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.8571615914122e-19, 1.9324813688654397e-19, 7.75270842719724e-20, -6.808321432052279e-20, -2.52634416002388e-19, -4.88748788731602e-19, -7.94386412139978e-19, -1.195294264735896e-18, -1.72852428335724e-18, -2.4493275292274997e-18, -3.44512837255752e-18, -4.861804995872999e-18, -6.95589792181002e-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: 0.013463677556735228
Energy: 0.2910228984067864
Energy: 0.07058430996304725
Energy: 0.07015773320850671
Energy: 0.015711160859942595
Energy: 0.01447530685957694
Energy: 0.06932754872766718
Energy: 0.07090716614828263
Energy: 0.06979346533869485
Energy: 0.015255143987043487
Energy: 0.2996891537341738
Energy: 0.06902795643908079
Energy: 0.06968993824047111
Energy: 0.07032484822378465
Energy: 0.07023068572911885
Energy: 0.06924796074086279
Energy: 0.07089608180062651
Energy: 0.06970982155683005
Energy: 0.07020986504735369
Energy: 0.07009263906422689
Energy: 0.07090717369906528
Energy: 0.01602716701859288
Energy: 0.013856995735370288
Energy: 0.06899450370362634
Energy: 0.06996763522828461
Energy: 0.0703412560402861
Energy: 0.015392999148821454
Energy: 0.013808454667997117
Energy: 0.0689468368436686
Energy: 0.07046249811477459
Energy: 0.06996299594393948
Energy: 0.014809204757850414
Energy: 0.014564452123641502
Energy: 0.07019360528946077
Energy: 0.06923604653656183
Energy: 0.0703401854229523
Energy: 0.014655573704112428
Energy: 0.013972811209378697
Energy: 0.06963337020005816
Energy: 0.06901064967804499
Energy: 0.06957825452869774
Energy: 0.06971674330847442
Energy: 0.07065195715731944
Energy: 0.014753857977241325
Energy: 0.014785872400553603
Energy: 0.06923246199557077
Energy: 0.07016446983044874
Energy: 0.07039042604454308
Energy: 0.015425134706749262
Energy: 0.06931284749100161
Energy: 0.07074963260630683
Energy: 0.06915001824351327
Energy: 0.06960366326472656
Energy: 0.014346911773348903
Energy: 0.01660594461337163
Energy: 0.07116632451559043
Energy: 0.06865392682772972
Energy: 0.06992289874303322
Energy: 0.014797103375388681
Energy: 0.017472197000937117
Energy: 0.0174823915394129
Energy: 0.07099617756830405
Energy: 0.06972817457012913
Energy: 0.07047729016612157
Energy: 0.07099712956906744
Energy: 0.01712737228811028
Energy: 0.07119732770695371
Energy: 0.06954673934623327
Energy: 0.0700729560437657
Energy: 0.07067765647195437

minimum gb energy = 0.013463677556735228 eV
minimum distance =  2.8470272798383 Angstroms
sigma value = 3


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

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Energy: 0.5549474740256466
Energy: 0.5696358816731929
Energy: 0.5324624049445544
Energy: 0.5449855272613047
Energy: 0.5452089435789175
Energy: 0.5326123591439688
Energy: 0.5604086505734814
Energy: 0.5591409174372246
Energy: 0.5410455737722595
Energy: 0.5100061416079291
Energy: 0.5651045848754509
Energy: 0.5609564531270881
Energy: 0.5981178235621775
Energy: 0.4345273929659802
Energy: 0.5041404892297774
Energy: 0.5039962947800882
Energy: 0.570635668714294
Energy: 0.511035542173693
Energy: 0.43453247567723974
Energy: 0.5398592785295362
Energy: 0.5485709329154815
Energy: 0.5192814745214651
Energy: 0.43274454271842716
Energy: 0.4333992157525019
Energy: 0.4328073058165919
Energy: 0.5986756579767981
Energy: 0.5195486216166665
Energy: 0.45910986948886284
Energy: 0.5355578896314392
Energy: 0.4954185040635434
Energy: 0.590350379581748
Energy: 0.5408801558423052
Energy: 0.43287691479493456
Energy: 0.43413585599037446
Energy: 0.43324362062987015
Energy: 0.5738141251312632
Energy: 0.5418015940264015
Energy: 0.5004820379356378
Energy: 0.5361536310892684
Energy: 0.5579645517181329
Energy: 0.5715072345919653
Energy: 0.5023302871223347
Energy: 0.5477164891013321
Energy: 0.52898142696939
Energy: 0.6301931637401424
Energy: 0.5425366101380236
Energy: 0.6149050639634012
Energy: 0.5474869287757349
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Energy: 0.5815313352363026
Energy: 0.5710171764745569
Energy: 0.5551792983615417
Energy: 0.476399014802974
Energy: 0.5189128134951169
Energy: 0.5821765477604763
Energy: 0.5419419559422466
Energy: 0.5999911173595102
Energy: 0.5142582759378921
Energy: 0.5480636671241771
Energy: 0.6293147021534689
Energy: 0.5842015438017988
Energy: 0.5390460205986912
Energy: 0.5209499561764451
Energy: 0.60556493966371
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Energy: 0.6148351676754529
Energy: 0.5412197717848153
Energy: 0.4782633076160577
Energy: 0.6194148356753503
Energy: 0.5864674268324148
Energy: 0.5761301551358482
Energy: 0.5669541851254399
Energy: 0.5326916584576805
Energy: 0.5757834118337338
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Energy: 0.5633024535600251
Energy: 0.5589085513051154
Energy: 0.5489941694296023
Energy: 0.5756018560372796
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Energy: 0.5637115196637019
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Energy: 0.5175087896479145
Energy: 0.5605382588529411
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Energy: 0.5431783648890833
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Energy: 0.4804639025039334
Energy: 0.6320723605409577
Energy: 0.5579318017783067
Energy: 0.5912093716277518
Energy: 0.48345657314826157
Energy: 0.48289335605383404
Energy: 0.6192366115308291
Energy: 0.555831130972711
Energy: 0.5951835841821022
Energy: 0.7781194925356409
Energy: 0.560228734747132
Energy: 0.5861192150343422
Energy: 0.5605772474360224
Energy: 0.5453111233469564
Energy: 0.5425708613772472
Energy: 0.5614307029232247
Energy: 0.5858663280199394
Energy: 0.5587446451368604
Energy: 0.5720521856782158
Energy: 0.4879638945419667
Energy: 0.5841775188998104
Energy: 0.5724718330703275
Energy: 0.60786483092137
Energy: 0.48385484731801287
Energy: 0.4284725066660993
Energy: 0.5919508678966562
Energy: 0.5735412233855328
Energy: 0.6356329997212321
Energy: 0.4840917121217117
Energy: 0.43677554595950785
Energy: 0.5980983461922926
Energy: 0.48337708463031426
Energy: 0.5012186560608056
Energy: 0.4773665652266253
Energy: 0.4895261409876586
Energy: 0.4856309701939602
Energy: 0.515292994275072
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Energy: 0.476149855483042
Energy: 0.48470358122526064
Energy: 0.4842860125488917
Energy: 0.5427748459032398
Energy: 0.48757692746017045
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Energy: 0.4795998348684525
Energy: 0.5147120069742355
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Energy: 0.5350222812006828
Energy: 0.4925061140513476
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Energy: 0.5882937092380737
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Energy: 0.537666988480949
Energy: 0.47951677139933613
Energy: 0.621492017125425
Energy: 0.5734654118406274
Energy: 0.5893009203811241
Energy: 0.5487072314275935
Energy: 0.4883538993845605
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Energy: 0.5650259530660859
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Energy: 0.5416269715731766
Energy: 0.5423417905931591
Energy: 0.5948659046095144
Energy: 0.5554149749685422
Energy: 0.5440859670170203
Energy: 0.6299448363254381
Energy: 0.5582689100957227
Energy: 0.595706922500931
Energy: 0.47914341595560866
Energy: 0.6016292584103784
Energy: 0.5786941065185841
Energy: 0.6193306774178924
Energy: 0.458538314668724
Energy: 0.5188780138166951
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Energy: 0.6706713668076251
Energy: 0.5623930224104741
Energy: 0.5758094012129094
Energy: 0.47662947485990725
Energy: 0.5773568281552038
Energy: 0.5869906510533357
Energy: 0.5629812245757614
Energy: 0.4794135260302402
Energy: 0.5327064257682822
Energy: 0.5749711875441904
Energy: 0.6302351142117883
Energy: 0.5115521658528348
Energy: 0.4519647705386309
Energy: 0.5839499865311288
Energy: 0.6019061042559511
Energy: 0.6302950430769574
Energy: 0.5240380008708793
Energy: 0.4545125682351191
Energy: 0.5062142684872054
Energy: 0.5605015923399752
Energy: 0.533978498696437
Energy: 0.4896214364223221
Energy: 0.5171678946249817
Energy: 0.5269031552700051
Energy: 0.5135593576832705
Energy: 0.5313536808927434
Energy: 0.49058380153690845
Energy: 0.4732337471486712
Energy: 0.5202234619109374
Energy: 0.5134510062122527
Energy: 0.5079617596538015
Energy: 0.5304067121823601
Energy: 0.47773831973508857
Energy: 0.509851579828879
Energy: 0.5197692418400327
Energy: 0.5262643235865972
Energy: 0.4346750155175964
Energy: 0.4612217221997258
Energy: 0.46732351122864707
Energy: 0.5145253316681953
Energy: 0.5581769699193514
Energy: 0.521119478094927
Energy: 0.48358084155921643
Energy: 0.6160359883832206
Energy: 0.5673985208383339
Energy: 0.6067841084148605
Energy: 0.4368581321072848
Energy: 0.5205725997518091
Energy: 0.640762212107418
Energy: 0.5716952112143956
Energy: 0.521652847472477
Energy: 0.5554339779639659
Energy: 0.5569247830202604
Energy: 0.5427816829559232
Energy: 0.5415378098197389
Energy: 0.5008012355973491
Energy: 0.5395976575392741
Energy: 0.50253373532893
Energy: 0.5435097599795459
Energy: 0.5417257507581579
Energy: 0.5237593768027476
Energy: 0.487497402825555
Energy: 0.6155016008040195
Energy: 0.532999309905892
Energy: 0.5690719060398378
Energy: 0.43654848435873517
Energy: 0.4349046988683077
Energy: 0.6080636320589994
Energy: 0.5318484507921788
Energy: 0.5418939103626004
Energy: 0.5490119330872302
Energy: 0.5338888263318416
Energy: 0.5711832262143854
Energy: 0.531712145480364
Energy: 0.5451427186073795
Energy: 0.5419909975283103
Energy: 0.5320980563049962
Energy: 0.5597260671607927
Energy: 0.5602283120158643
Energy: 0.542600782297136

minimum gb energy = 0.4284725066660993 eV
minimum distance =  2.55815865575044 Angstroms
sigma value = 75


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

Energy: 1.2309277093572324
Energy: 0.5141447334914229
Energy: 0.5109063043400032
Energy: 0.5214065268004351
Energy: 0.5863996678103893
Energy: 0.5214160158460848
Energy: 0.5106940469286707
Energy: 0.5116904584224226
Energy: 0.521974903511178
Energy: 0.6032815516965222
Energy: 0.5334547978423787
Energy: 0.5396890594371316
Energy: 0.5115799559859537
Energy: 0.5220752435192538
Energy: 0.5276792657494853
Energy: 0.5719087407969686
Energy: 0.5406834846778852
Energy: 0.5107310829133714
Energy: 0.5351615015431738
Energy: 0.5448594550164396
Energy: 0.5597728554902384
Energy: 0.6630358266951698
Energy: 0.5510649842132744
Energy: 0.53121944034331
Energy: 0.5749132377881311
Energy: 0.5691470019875351
Energy: 0.6604308315972413
Energy: 0.5551499735273768
Energy: 0.5413146812703753
Energy: 0.5094372843983364
Energy: 0.5873189321098302
Energy: 0.558275507376505
Energy: 0.5617969557685636
Energy: 0.5511132349272347
Energy: 0.5097388577632885
Energy: 0.5359427348843034
Energy: 0.5110272664249538
Energy: 0.5493446033515805
Energy: 0.5279442065704605
Energy: 0.5515435552942093
Energy: 0.5520171893770338
Energy: 0.5460036746957544
Energy: 0.60960660553324
Energy: 0.5597137811861598
Energy: 0.5119054817551854
Energy: 0.5310459748453102
Energy: 0.5377016108751331
Energy: 0.59672134153185
Energy: 0.5221371803100886
Energy: 0.5324362488998172
Energy: 0.5352412333310221
Energy: 0.5412494004581958
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Energy: 0.5320520065095629
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Energy: 0.5459858863023653
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Energy: 0.533229022988806
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Energy: 0.5386365640378967
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Energy: 0.6075713270896502
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Energy: 0.6230964509662915
Energy: 0.5473804082655923
Energy: 0.5466898885786705
Energy: 0.5468680886106579
Energy: 0.6125553295152671
Energy: 0.5393378278362606
Energy: 0.5457159540648436
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Energy: 0.556464769293023
Energy: 0.5441856435467539
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Energy: 0.5726860759815794
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Energy: 0.6079405712221478
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Energy: 0.5433118740415278
Energy: 0.5500117235506461
Energy: 0.5513526972217543
Energy: 0.6242046547577281
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minimum gb energy = 0.5041390909800926 eV
minimum distance =  2.61150582780154 Angstroms
sigma value = 105


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

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Energy: 0.5649537088102229
Energy: 0.5822685895996103
Energy: 0.569479501993301
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Energy: 0.5666100679964869
Energy: 0.5744622567085144
Energy: 0.5658036749002059
Energy: 0.550783431136698
Energy: 0.5996328666072728
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Energy: 0.5805814152238542
Energy: 0.5708598460654065
Energy: 0.5598875342076939
Energy: 0.5836158922357725
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Energy: 0.5562588830781692
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Energy: 0.554972796503544
Energy: 0.596802097482467
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Energy: 0.5854113626028554
Energy: 0.5744504618673492
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Energy: 0.5586045762266424
Energy: 0.5520995967937008
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Energy: 0.5674482380304467
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Energy: 0.5568646468034669
Energy: 0.6075977834610027
Energy: 0.6015710924997342
Energy: 0.6045121718234642
Energy: 0.6124098860399938
Energy: 0.6041574848686867
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Energy: 0.5701971887085414
Energy: 0.6061206629506554
Energy: 0.6078886930916199
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Energy: 0.5754257600080873
Energy: 0.5827253043253331
Energy: 0.5643367962912301
Energy: 0.5521096382484191
Energy: 0.5817458704851082
Energy: 0.5777854301118243
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Energy: 0.5818663630015606
Energy: 0.575604642139325
Energy: 0.5504308242783372
Energy: 0.5595813302643223
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Energy: 0.5597961004683816
Energy: 0.5902726514689081
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Energy: 0.5591193284657944
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Energy: 0.5849421049483645
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Energy: 0.5590580074742327
Energy: 0.5663403098644119
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Energy: 0.5605361508164316
Energy: 0.5596604008371932
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Energy: 0.6329171683131548
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Energy: 0.5868410501583943
Energy: 0.6036417690424803
Energy: 0.566460662879275
Energy: 0.5722170557521599
Energy: 0.5878991244822283
Energy: 0.5822129072668941
Energy: 0.5767938774128042
Energy: 0.5787722473039076
Energy: 0.5752339942345576
Energy: 0.5524887479333925
Energy: 0.6106887976833872
Energy: 0.5776140775253785
Energy: 0.5828693677135712
Energy: 0.5753262906462904
Energy: 0.5485982214247724
Energy: 0.6069832112281669
Energy: 0.5901868603378698
Energy: 0.580387859363446
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Energy: 0.5947158354272469
Energy: 0.5490928990500077
Energy: 0.570891453051874
Energy: 0.5785970478983423
Energy: 0.5573477304442341
Energy: 0.5780950160170778
Energy: 0.5838780897846719
Energy: 0.5708354689057903
Energy: 0.5717912447267884
Energy: 0.5711810818531963
Energy: 0.6001537770535633
Energy: 0.5888713200199457
Energy: 0.570937263411671
Energy: 0.5708121288400031
Energy: 0.5670366138145738
Energy: 0.600353946352655
Energy: 0.614452838676986
Energy: 0.5725807202562679
Energy: 0.5676966562779928
Energy: 0.5691687314186705
Energy: 0.5695586717731943
Energy: 0.5932833717680849
Energy: 0.5756796843166418
Energy: 0.5675381853822438
Energy: 0.5695121984798256
Energy: 0.5949823798267679
Energy: 0.5681947091354573
Energy: 0.575231743956494
Energy: 0.5749703053516614
Energy: 0.5734649372250961
Energy: 0.5896225246863063
Energy: 0.5692417583069305
Energy: 0.5746154064049632
Energy: 0.5755836556376674
Energy: 0.5736528751109301
Energy: 0.5627951509582427
Energy: 0.5791951505054109
Energy: 0.5515964169511415
Energy: 0.5819592264281214
Energy: 0.57000069927995
Energy: 0.5625207210386493
Energy: 0.5732005961957637
Energy: 0.5516844245712366
Energy: 0.581707418229225
Energy: 0.5734099090407385
Energy: 0.5614154606965904
Energy: 0.5903263577898284
Energy: 0.5454541333216002
Energy: 0.5755367613449662
Energy: 0.5791021656327063
Energy: 0.559214892123586
Energy: 0.6006238035926288
Energy: 0.5571343870866624
Energy: 0.5755081669331729
Energy: 0.5791141999640673
Energy: 0.5784022891299982
Energy: 0.6059267064400901
Energy: 0.5877000234486364
Energy: 0.5980739293071927
Energy: 0.5968514499037636
Energy: 0.6050321070236481
Energy: 0.5518046322692283
Energy: 0.5930329358299761
Energy: 0.5981128235233808
Energy: 0.5819290588354966
Energy: 0.6054977180384308
Energy: 0.5796728695525987
Energy: 0.6017667677568274
Energy: 0.5512885635524588
Energy: 0.5590515794677411
Energy: 0.5899288792583671
Energy: 0.561621837526084
Energy: 0.597542490975621
Energy: 0.5614096504151166
Energy: 0.5602940670242266
Energy: 0.5902582835566722
Energy: 0.5800548598633463
Energy: 0.5506702073654758
Energy: 0.5519237235206204
Energy: 0.5504898924241863
Energy: 0.5634066093224126
Energy: 0.5610363297159107
Energy: 0.5507636068831564
Energy: 0.5510658529674286
Energy: 0.5503685560109993
Energy: 0.5782874301194556

minimum gb energy = 0.5437503233266405 eV
minimum distance =  2.60678984675188 Angstroms
sigma value = 165


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

Energy: 0.7962280096538962
Energy: 0.5794157518282493
Energy: 0.5592953972710962
Energy: 0.5730153217499677
Energy: 0.5370857865263811
Energy: 0.7407365727507347
Energy: 0.5635769591271919
Energy: 0.5632534466048317
Energy: 0.5800776758536467
Energy: 0.5610630251860838
Energy: 0.5483624554994792
Energy: 0.5937153008789958
Energy: 0.5754953145117091
Energy: 0.5741659241113087
Energy: 0.5680451527766887
Energy: 0.5697920954776122
Energy: 0.5568155631372013
Energy: 0.5805290023906369
Energy: 0.5801859843478683
Energy: 0.6051017838562679
Energy: 0.5629865449017996
Energy: 0.5872359197635582
Energy: 0.5676214279920472
Energy: 0.5716327347986886
Energy: 0.575324570214207
Energy: 0.5541981466796128
Energy: 0.5657787941698782
Energy: 0.5934045828766424
Energy: 0.5794852739527663
Energy: 0.6089808586544924
Energy: 0.5900744526166151
Energy: 0.5726573593103035
Energy: 0.5944261849698683
Energy: 0.5549580450925743
Energy: 0.5610001528607952
Energy: 0.5946501807105409
Energy: 0.5815519662307038
Energy: 0.565245844711872
Energy: 0.562059864230157
Energy: 0.6095460246187987
Energy: 0.6027992145660812
Energy: 0.5810030563752642
Energy: 0.5869268207581113
Energy: 0.5856914895389854
Energy: 0.5513580459362392
Energy: 0.5812039591080567
Energy: 0.5663038487186971
Energy: 0.5604427170850586
Energy: 0.5563268635846148
Energy: 0.5863460958237672
Energy: 0.5807387692041807
Energy: 0.5649804473736746
Energy: 0.6067353696889518
Energy: 0.5626851911978111
Energy: 0.5521343512443181
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Energy: 0.5646968912831858
Energy: 0.5583703015172856
Energy: 0.5616305296576287
Energy: 0.5526719166474527
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Energy: 0.600955314072335
Energy: 0.6019341238175391
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Energy: 0.5570274916474993
Energy: 0.5686671625872466
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Energy: 0.6034374817227652
Energy: 0.5890529482369923
Energy: 0.557061180944259
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Energy: 0.6072988418581938
Energy: 0.6021056877726655
Energy: 0.6009307006312692
Energy: 0.5947167322155491
Energy: 0.5377241808077377
Energy: 0.5902735893143457
Energy: 0.6036635942289398
Energy: 0.6033938078888158
Energy: 0.5371690078593273
Energy: 0.5380932954115649
Energy: 0.5569851807296964
Energy: 0.5883310582592945
Energy: 0.6052508901005973
Energy: 0.5905936447752392
Energy: 0.5379663483365995
Energy: 0.5502934842026039
Energy: 0.5869811353161238
Energy: 0.600705108124247
Energy: 0.5674729323400831
Energy: 0.6057861561177502
Energy: 0.5584137387087813
Energy: 0.6091325383292012
Energy: 0.603676743439892
Energy: 0.597791505291647
Energy: 0.5705479425479945
Energy: 0.558525209054549
Energy: 0.5676447722731447
Energy: 0.6024920998605326
Energy: 0.6049094561927808
Energy: 0.5971436663103802
Energy: 0.6024135868787668
Energy: 0.5702832031967826
Energy: 0.6008962189651204
Energy: 0.5718590115374581
Energy: 0.6032475274778726
Energy: 0.5877599609979562
Energy: 0.5689624308879719
Energy: 0.6176588486743647
Energy: 0.572725217357502
Energy: 0.6053336323576703
Energy: 0.6084861760424537
Energy: 0.5901686981334189
Energy: 0.5542177926438928
Energy: 0.5581938174561885
Energy: 0.6058354863812929
Energy: 0.5711093139272758
Energy: 0.5905424054242463
Energy: 0.5898613342574065
Energy: 0.5935407902663358
Energy: 0.5839072761440949
Energy: 0.5817754630768837
Energy: 0.5484136711631303
Energy: 0.5507008258483309
Energy: 0.5585313309309641
Energy: 0.5677408493348877
Energy: 0.5771857787037558
Energy: 0.5903638923245909
Energy: 0.5911199382624519
Energy: 0.5676396118993766
Energy: 0.579105793500218
Energy: 0.5825424291244237
Energy: 0.5731500440162669
Energy: 0.5637640993676131
Energy: 0.5488653129584289
Energy: 0.5707430511452763
Energy: 0.5817542666230479
Energy: 0.5647032000453758
Energy: 0.5627492968069135
Energy: 0.5554076491225737
Energy: 0.5593228519747597
Energy: 0.5743338020105394
Energy: 0.5765092420090179
Energy: 0.5648563503171294
Energy: 0.5690528571054108
Energy: 0.5639157023881318
Energy: 0.5681269026375929
Energy: 0.5796756391352722
Energy: 0.5661657966008927
Energy: 0.5948644030737269

minimum gb energy = 0.5370857865263811 eV
minimum distance =  2.62046219585163 Angstroms
sigma value = 41


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

Energy: 0.5578175624951855
Energy: 0.4818458103045492
Energy: 0.5052478499749802
Energy: 0.4849364144929106
Energy: 0.476837588460432
Energy: 0.4753739201454149
Energy: 0.4815900817662837
Energy: 0.5038865987134915
Energy: 0.5188504067425816
Energy: 0.48336049533959224
Energy: 0.5369171662826877
Energy: 0.529132801829215
Energy: 0.5041929050959084
Energy: 0.5019228151454089
Energy: 0.47593415216682
Energy: 0.512056354607583
Energy: 0.4779325251650777
Energy: 0.5056353147751126
Energy: 0.5074354005872578
Energy: 0.5011354729738491
Energy: 0.4897859756260877
Energy: 0.5341625708109338
Energy: 0.508390332792859
Energy: 0.4978492302456451
Energy: 0.5078478648589232
Energy: 0.49574518202061474
Energy: 0.526584696159324
Energy: 0.5508464951513601
Energy: 0.5275302215661997
Energy: 0.5223380538498418
Energy: 0.5176690579971469
Energy: 0.4937587692977454
Energy: 0.5296595970207179
Energy: 0.5088085016959448
Energy: 0.5105351150653453
Energy: 0.5255225026346462
Energy: 0.48124452274414814
Energy: 0.49319905401027986
Energy: 0.5224431243230542
Energy: 0.5704597171043134
Energy: 0.5378948940444789
Energy: 0.5284158093894318
Energy: 0.5222166167082665
Energy: 0.5156602907392657
Energy: 0.5014281158721934
Energy: 0.5048863859089547
Energy: 0.49665750192064645
Energy: 0.48924193159813373
Energy: 0.5006673193170929
Energy: 0.523742782550109
Energy: 0.49671523807520546
Energy: 0.5131307462017103
Energy: 0.491177550102326
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Energy: 0.5389433505750635
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Energy: 0.5367957126107553
Energy: 0.4988815157217931
Energy: 0.5100662448085438
Energy: 0.5332325739967605
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Energy: 0.5335114139365535
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Energy: 0.48436799988163787
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Energy: 0.5160081969436077
Energy: 0.48017739659486486
Energy: 0.5244976090621475
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Energy: 0.4873231006870813
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Energy: 0.48922926468515215
Energy: 0.48958516743420055
Energy: 0.49606963855747876
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Energy: 0.4956629147008486
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Energy: 0.4808711173894457
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Energy: 0.4772387507148624
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Energy: 0.4815116914721897
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Energy: 0.5088629505477426
Energy: 0.478944781335607
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Energy: 0.5082417098506847
Energy: 0.47595186906091236
Energy: 0.5097593359156616
Energy: 0.5071669593908696
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Energy: 0.5231032941290424
Energy: 0.5131473344287084
Energy: 0.5103243212869661
Energy: 0.5444152528082892
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Energy: 0.5098597557470295
Energy: 0.5427370782090136
Energy: 0.5161367783612383
Energy: 0.5131162995341451
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Energy: 0.5217772425679053
Energy: 0.5297305547246582
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Energy: 0.5349287071321209
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Energy: 0.526769252607419
Energy: 0.5339464205825494
Energy: 0.5265794087473418
Energy: 0.512346006686374
Energy: 0.5207750600883109
Energy: 0.5286273666508124
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Energy: 0.537491967447165
Energy: 0.5133638616847662
Energy: 0.529362464771083
Energy: 0.5104026669765508
Energy: 0.5180470661788444
Energy: 0.5211043592705084
Energy: 0.5261279904194086
Energy: 0.5141436359882887
Energy: 0.5248903904100045
Energy: 0.5055987300371823
Energy: 0.5005936487813888
Energy: 0.5125012016042186
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Energy: 0.4923907812641678
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Energy: 0.5261611622494393
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Energy: 0.5167004261023049
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Energy: 0.49026216166586095
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Energy: 0.5192881159286802
Energy: 0.5163553076092389
Energy: 0.5232371491873289
Energy: 0.5133574851966229
Energy: 0.5039375355909366
Energy: 0.522174272807158
Energy: 0.5099235390143416
Energy: 0.4772985414514436
Energy: 0.47624166200764917
Energy: 0.5192780500140209
Energy: 0.477523606298598
Energy: 0.5410275879393021
Energy: 0.48901169011744383
Energy: 0.5164611512508717
Energy: 0.4771343373569112
Energy: 0.48680032384988103
Energy: 0.4995279861999512
Energy: 0.49512010467700646
Energy: 0.47750807372519105
Energy: 0.5001760450507131
Energy: 0.4876349407563324
Energy: 0.511225669536262
Energy: 0.5003314347789912
Energy: 0.5195165431857455
Energy: 0.5121597900490186
Energy: 0.4985322964008059
Energy: 0.5367775286347899
Energy: 0.5009890167510375
Energy: 0.4788720162530544
Energy: 0.47612198759563495
Energy: 0.4889737213808469
Energy: 0.5098498056691574
Energy: 0.5053920657156843
Energy: 0.4769912401297122
Energy: 0.521559363201247
Energy: 0.5162708178310194
Energy: 0.4815619078141678
Energy: 0.4961820002498959
Energy: 0.523120259438965
Energy: 0.49349448348923663
Energy: 0.4899101274437584
Energy: 0.47704389323132945
Energy: 0.4978445558335586
Energy: 0.5043032327331141
Energy: 0.5110166129101118

minimum gb energy = 0.47536404645591573 eV
minimum distance =  2.64913513000902 Angstroms
sigma value = 185


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

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Energy: 0.3724910160605457
Energy: 0.342799166367048
Energy: 0.3386075041072884
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Energy: 0.33895567994068426
Energy: 0.32888676002211725
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Energy: 0.3706549771743446
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Energy: 0.33733638757438134
Energy: 0.32692543547642666
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Energy: 0.33825270147982345
Energy: 0.4054720938346741
Energy: 0.4263675582923003
Energy: 0.3298122477011274
Energy: 0.3356702006885162
Energy: 0.3341218094451032
Energy: 0.38739451753288756
Energy: 0.40763483888587365
Energy: 0.3524788942864736
Energy: 0.3905658908255189
Energy: 0.32281711491912457
Energy: 0.4212657227202601
Energy: 0.427805742397912
Energy: 0.3546579789897506
Energy: 0.45821968066893387
Energy: 0.3310155814455408
Energy: 0.3387230187493408
Energy: 0.34053938347360857
Energy: 0.3517880856653704
Energy: 0.3397698240125587
Energy: 0.32475332538046076
Energy: 0.3333737682634932
Energy: 0.3338017083903031
Energy: 0.3469228525162286
Energy: 0.3313208861310074
Energy: 0.3279813646248085
Energy: 0.4639679854726441
Energy: 0.32447087605753433
Energy: 0.3460677316047078
Energy: 0.3318751762792552
Energy: 0.3282058029131221
Energy: 0.39382168505988757
Energy: 0.32617797744719623
Energy: 0.3420765121432302
Energy: 0.33202732340726926
Energy: 0.38180862286824474

minimum gb energy = 0.31116681957398934 eV
minimum distance =  2.58715136796289 Angstroms
sigma value = 33


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

Energy: 0.44110356330430156
Energy: 0.4461754365889178
Energy: 0.4596540616417493
Energy: 0.46369519783573543
Energy: 0.43363086115841
Energy: 0.43215818167461567
Energy: 0.44585266130201623
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Energy: 0.44622745925402085
Energy: 0.44694556324490786
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Energy: 0.43532202622296456
Energy: 0.4459511515105056
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Energy: 0.4570350208970821
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Energy: 0.44539939627785113
Energy: 0.4501284115941755
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Energy: 0.44766495352634095
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Energy: 0.4457816925102822
Energy: 0.46523637047083266
Energy: 0.4346054720098095
Energy: 0.44165664488967443
Energy: 0.445972349684073
Energy: 0.4448444090493839
Energy: 0.4463404997504019
Energy: 0.43480703366933793
Energy: 0.43373261069309
Energy: 0.4454297973034386
Energy: 0.44493201341759436
Energy: 0.446561434622737
Energy: 0.4355517937126353
Energy: 0.4358045543100541
Energy: 0.4684449983118975
Energy: 0.45527031892185077
Energy: 0.44549716331105726
Energy: 0.4361491889481722
Energy: 0.43563104964471006
Energy: 0.4676050775327436
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Energy: 0.43229550608492795
Energy: 0.44601107208097457
Energy: 0.4551361229394025
Energy: 0.46263569041671715
Energy: 0.4333837392673234

minimum gb energy = 0.431213509808976 eV
minimum distance =  2.68112446198427 Angstroms
sigma value = 219


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

Energy: 0.8767142540843977
Energy: 0.5927968549333512
Energy: 0.5852100031356677
Energy: 0.585307374975285
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Energy: 0.6004168659249072
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Energy: 0.5992525699640314
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Energy: 0.5889766562135288
Energy: 0.5790838627190674
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Energy: 0.5850875002702546
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Energy: 0.58022073234267
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Energy: 0.585555848700878
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Energy: 0.598081058842576
Energy: 0.5835344397670575
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Energy: 0.5823370668787028
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Energy: 0.5801333839676913
Energy: 0.5818769757635445
Energy: 0.5851021797428201
Energy: 0.5818121544339353
Energy: 0.583490654189031
Energy: 0.5821369346441824
Energy: 0.5822180193193776
Energy: 0.5832737105717202
Energy: 0.5821247164953933
Energy: 0.5848113919759251
Energy: 0.5902566125257839
Energy: 0.5798616294145323
Energy: 0.5840573216950432
Energy: 0.582412741106653
Energy: 0.5839419884096251
Energy: 0.5883915289838545
Energy: 0.580924834166923
Energy: 0.5718089723376019
Energy: 0.58364547731969
Energy: 0.5833871299203159
Energy: 0.5834076533778306
Energy: 0.5851956423209451
Energy: 0.5728105737218018
Energy: 0.583919191214619
Energy: 0.5832022244863831
Energy: 0.5827989411200851
Energy: 0.5812092379710452

minimum gb energy = 0.5718089723376019 eV
minimum distance =  2.624151616574 Angstroms
sigma value = 15


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

Energy: 1.0336038498150757
Energy: 0.6775276541905536
Energy: 0.6723094814938915
Energy: 0.6762807114801866
Energy: 0.6900748913821654
Energy: 0.6617510834960341
Energy: 0.6671285929319759
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Energy: 0.6925109623045872
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Energy: 0.6716529931669429
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Energy: 0.6709340792823205
Energy: 0.6743283918258243
Energy: 0.6737536246616137
Energy: 0.6830952346119343
Energy: 0.7032294558458243
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Energy: 0.6887411086520616
Energy: 0.6689679002830009
Energy: 0.6838664445654627
Energy: 0.6705499087369324
Energy: 0.6708645550923025
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Energy: 0.6722429714869634
Energy: 0.6683972004439289
Energy: 0.679630752062316
Energy: 0.6767287787260642
Energy: 0.6850016743199133
Energy: 0.6598530734372156
Energy: 0.6623760465078267
Energy: 0.6794023415512417
Energy: 0.6770084539006838
Energy: 0.6840788125670759
Energy: 0.676410246501314
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minimum gb energy = 0.6536001409258684 eV
minimum distance =  2.58838145074168 Angstroms
sigma value = 293


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

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Energy: 0.6661682806376898
Energy: 0.679741274272805
Energy: 0.6863508888308069
Energy: 0.6649379239782809
Energy: 0.716236311435714
Energy: 0.6776329350550812
Energy: 0.6738288899413875
Energy: 0.6621393064690528
Energy: 0.659842429757906
Energy: 0.6758872739343987
Energy: 0.6568586755124235
Energy: 0.678333886752705
Energy: 0.6599915142799903
Energy: 0.6673695416055352
Energy: 0.6753697869762776
Energy: 0.6747231077055373
Energy: 0.6802516069629169
Energy: 0.6586535366350367
Energy: 0.659892385901113
Energy: 0.6634516918930481
Energy: 0.6438288899008876
Energy: 0.6719564551591685
Energy: 0.6587122847459541
Energy: 0.6609520119624409
Energy: 0.6633566615710746
Energy: 0.6737372733578422
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Energy: 0.6610842972214998
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Energy: 0.6639140896792757
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Energy: 0.6605788579754919
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Energy: 0.6795543057892494
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Energy: 0.6727766470528259
Energy: 0.6609650067713997
Energy: 0.6633233326452469
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Energy: 0.6643978839130061
Energy: 0.6801403337651897
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Energy: 0.659627687709608
Energy: 0.6599672466127663
Energy: 0.6657604247675656
Energy: 0.678603389289524
Energy: 0.6696488397314442
Energy: 0.6604999492962472
Energy: 0.6582693877487268
Energy: 0.6550201314620742
Energy: 0.6654319903914288
Energy: 0.6601749896568664
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Energy: 0.6573547957973265
Energy: 0.6553128400538827
Energy: 0.6654296317823846
Energy: 0.6601279389305094
Energy: 0.6754603629093237
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Energy: 0.6705437466969913
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Energy: 0.6891779555513435
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Energy: 0.6748453276652038
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Energy: 0.6973039695583515
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Energy: 0.6739535204240894
Energy: 0.6672415723371763
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Energy: 0.6698710603591066
Energy: 0.6755714064954097
Energy: 0.6706454391523969
Energy: 0.6758810058528073
Energy: 0.7004267551305515
Energy: 0.675332536529577
Energy: 0.6794268553311154
Energy: 0.6783013819356531
Energy: 0.6564786216790672
Energy: 0.6683027072855083
Energy: 0.6774744651273586
Energy: 0.6742528829372815
Energy: 0.6521407488676648
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Energy: 0.6688679090338997
Energy: 0.6579927821584785
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Energy: 0.6515616879388236
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Energy: 0.6686926385824422
Energy: 0.6577017442016355
Energy: 0.6667359243344824
Energy: 0.6506067709017195
Energy: 0.673437088988503
Energy: 0.6686394625214189
Energy: 0.6694393998551824
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Energy: 0.6764656084867184
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Energy: 0.6584807844496058
Energy: 0.6761678922333033
Energy: 0.6625609154860517
Energy: 0.6755709837395011
Energy: 0.669459321444338
Energy: 0.6619444351750162
Energy: 0.6763829010574288
Energy: 0.6544556718906969
Energy: 0.6621060272767129
Energy: 0.6641053334566577
Energy: 0.6792373057988121
Energy: 0.6857916820184259
Energy: 0.6504270178336607
Energy: 0.6691405637679141
Energy: 0.6630906072770847
Energy: 0.6781412637568432
Energy: 0.6624718839266552
Energy: 0.6720088138152263
Energy: 0.6916648897705105
Energy: 0.6587117297278686
Energy: 0.6586476518992531
Energy: 0.6782341796197889
Energy: 0.6908382511350771
Energy: 0.6886889108998316
Energy: 0.657378909473253
Energy: 0.6581393060011713
Energy: 0.6785388235514271
Energy: 0.6499867029844574
Energy: 0.6782175813141892
Energy: 0.6690128230070104
Energy: 0.6599812235744146
Energy: 0.6784069519615937
Energy: 0.6617328802239919
Energy: 0.6737431071110519
Energy: 0.669127364050495
Energy: 0.6578874633260531
Energy: 0.6663409816668764
Energy: 0.6577229556883294
Energy: 0.6666615550281049
Energy: 0.6753300427436415
Energy: 0.668033746999761
Energy: 0.6547594205051577
Energy: 0.6589329110945413
Energy: 0.6640736920628931
Energy: 0.6750060087359033
Energy: 0.6639063506216035
Energy: 0.6548102764858889
Energy: 0.6593703950949625
Energy: 0.6617987711467554
Energy: 0.6971595541578698
Energy: 0.6794030867926204
Energy: 0.6620814769847242
Energy: 0.6685141988656922
Energy: 0.6581401685712667
Energy: 0.6891640260869792
Energy: 0.6979810547451338
Energy: 0.6728508710677197
Energy: 0.6714291286005621
Energy: 0.6650602001272118
Energy: 0.669721842066968
Energy: 0.7020816932665334
Energy: 0.6673878749734041
Energy: 0.6718522493526051
Energy: 0.665353857394388
Energy: 0.6615341281948671
Energy: 0.7076841359154602
Energy: 0.6689946445043153
Energy: 0.6706020831682222
Energy: 0.6473127788569262
Energy: 0.6790713732731084
Energy: 0.6657125846598871
Energy: 0.6594938167546528
Energy: 0.6774175187834066
Energy: 0.6567698732388778
Energy: 0.6675718213222693
Energy: 0.6639466447718368
Energy: 0.661911087955361
Energy: 0.6716585491254842

minimum gb energy = 0.6438288899008876 eV
minimum distance =  2.57253450228529 Angstroms
sigma value = 293


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

Energy: 0.6316775958908731
Energy: 0.6721608367771387
Energy: 0.688447189159917
Energy: 0.6478006140356355
Energy: 0.6375536126818897
Energy: 0.6319061769356261
Energy: 0.6493080812784054
Energy: 0.6885236110498766
Energy: 0.6487005523201155
Energy: 0.6373834840433547
Energy: 0.6951052264514168
Energy: 0.6435298967718629
Energy: 0.6429677778502466
Energy: 0.6439422801836064
Energy: 0.6442054446512956
Energy: 0.67665767538063
Energy: 0.6436937212254573
Energy: 0.6385026701062472
Energy: 0.6448848094328208
Energy: 0.6466197335534968
Energy: 0.6451428540242203
Energy: 0.6452600020664004
Energy: 0.6442081293437283
Energy: 0.6485592737705311
Energy: 0.6774049966204554
Energy: 0.6442608922583986
Energy: 0.6435633405585603
Energy: 0.6438028749315752
Energy: 0.6902034228332664
Energy: 0.6788363345627463
Energy: 0.6913853057728571
Energy: 0.6339774055879488
Energy: 0.6356530217839186
Energy: 0.6452190598519599
Energy: 0.6938652038876233
Energy: 0.6902281869317572
Energy: 0.6336004798829749
Energy: 0.6367325155129904
Energy: 0.6466446571735702
Energy: 0.635720130076127
Energy: 0.645188231289655
Energy: 0.6409129781811974
Energy: 0.6334368771824814
Energy: 0.6774350734325553
Energy: 0.6511165470551679
Energy: 0.6437596613375709
Energy: 0.6387896382912459
Energy: 0.6337965866051514
Energy: 0.6474371265048918
Energy: 0.643665409713679
Energy: 0.6438263040467502
Energy: 0.6911068885182474
Energy: 0.6499277168197335
Energy: 0.6446169412338741
Energy: 0.6415047324915423
Energy: 0.6445860042819572
Energy: 0.6884758299414049
Energy: 0.6487832704257661
Energy: 0.6437408826982369
Energy: 0.6432659369956703
Energy: 0.646338699033877
Energy: 0.6347498232229579
Energy: 0.6444735120284404
Energy: 0.6436647823698456
Energy: 0.6829495806159436
Energy: 0.6457981808365549
Energy: 0.6335644765520133
Energy: 0.645068893949072
Energy: 0.6434081889488023
Energy: 0.6447629395920556
Energy: 0.6460251999306859
Energy: 0.674506111217928
Energy: 0.6477078528183126
Energy: 0.633160525299841
Energy: 0.640966426978906
Energy: 0.653070786581131
Energy: 0.6743382639619411
Energy: 0.6469227790420619
Energy: 0.6367685459648917
Energy: 0.6362661310944858
Energy: 0.6433739187677241
Energy: 0.637870484727816
Energy: 0.6450400065884185
Energy: 0.634999869129525
Energy: 0.6806210839196858
Energy: 0.6434601992509965
Energy: 0.6424409142911176
Energy: 0.6449209462746897
Energy: 0.6342594193817783
Energy: 0.6844272030340884
Energy: 0.6440187901010074
Energy: 0.6458292267918055
Energy: 0.6769390045256503
Energy: 0.6941267728123827
Energy: 0.6489113648215447
Energy: 0.6513121443085553
Energy: 0.6467130375011921
Energy: 0.6767058827390299
Energy: 0.6508754246924415
Energy: 0.6455132011304718
Energy: 0.6346640142397981
Energy: 0.6496434115093934
Energy: 0.6428738603164217
Energy: 0.6447981137403171
Energy: 0.680884785791648
Energy: 0.6347514443956661
Energy: 0.6463401254793628
Energy: 0.6333195575264117
Energy: 0.6463334256425057
Energy: 0.6789710762013809
Energy: 0.6317997900984564
Energy: 0.6478246554625204
Energy: 0.6887548013465783
Energy: 0.6476975017962645
Energy: 0.6376622083890983
Energy: 0.6322260662902125
Energy: 0.6491367185199264
Energy: 0.6921146278072271
Energy: 0.6484098097046438
Energy: 0.637061162918109
Energy: 0.6804607797506096
Energy: 0.6435527939706379
Energy: 0.6426563096017466
Energy: 0.6440657745214471
Energy: 0.6451258586395647
Energy: 0.6769095111005076
Energy: 0.6438653725020331
Energy: 0.6381808652824168
Energy: 0.6446088926757338
Energy: 0.6503815270184062
Energy: 0.6461255416206695
Energy: 0.6454840878315475
Energy: 0.6445924943073705
Energy: 0.6936217543403924
Energy: 0.6777351799338774
Energy: 0.6472346847598263
Energy: 0.6440286199492833
Energy: 0.6438015152994314
Energy: 0.6888159084863842
Energy: 0.678566164534035
Energy: 0.6914078966642467
Energy: 0.6338252977298031
Energy: 0.6356054905681168
Energy: 0.6469408225315294
Energy: 0.6876223552421781
Energy: 0.6900065854630574
Energy: 0.6334149077381652
Energy: 0.6366413612375842
Energy: 0.6471502211783778
Energy: 0.6783747596840409
Energy: 0.6455841872103633
Energy: 0.6397049488392463
Energy: 0.6334819132472816
Energy: 0.6509951674932029
Energy: 0.6518870296061704
Energy: 0.6437437206141085
Energy: 0.6392810709499043
Energy: 0.6334798983419206
Energy: 0.6437519960032594
Energy: 0.6438839130332789
Energy: 0.6435288276732167
Energy: 0.6900724480690806
Energy: 0.6503853273886337
Energy: 0.6441166839982218
Energy: 0.6381729006634034
Energy: 0.6443654687619347
Energy: 0.6884160167850143
Energy: 0.649127659737016
Energy: 0.6434164597536177
Energy: 0.6435814610251488
Energy: 0.6474559805233147
Energy: 0.6345562904735602
Energy: 0.6448991558407644
Energy: 0.6436259561234925
Energy: 0.6787093023074248
Energy: 0.6459016273919995
Energy: 0.6335022062516286
Energy: 0.6454267320218655
Energy: 0.6432925581481972
Energy: 0.6447379262038514
Energy: 0.6464619077199071
Energy: 0.6744025934419775
Energy: 0.6481842014607175
Energy: 0.633292939851544
Energy: 0.6406796421082129
Energy: 0.6541536205588178
Energy: 0.6746220090326491
Energy: 0.6467683740636911
Energy: 0.6356566816184677
Energy: 0.6368079307919063
Energy: 0.6434766355237705
Energy: 0.638323131452802
Energy: 0.6450698162482797
Energy: 0.635099165947526
Energy: 0.6802659655304734
Energy: 0.6433974783054609
Energy: 0.6424559868829386
Energy: 0.645114867715009
Energy: 0.6344031442101022
Energy: 0.6449626624623752
Energy: 0.6439034710688126
Energy: 0.6450274314471722
Energy: 0.6750684019955887
Energy: 0.6907000095631195
Energy: 0.6490457464938736
Energy: 0.6477909994242372
Energy: 0.6466348439915957
Energy: 0.6774209017429622
Energy: 0.6556270741639367
Energy: 0.646084865862244
Energy: 0.6340808445446341
Energy: 0.6497670735203268
Energy: 0.6428110743674577
Energy: 0.6442597037158072
Energy: 0.6798333917909304
Energy: 0.6343550093577524
Energy: 0.6458768084082533
Energy: 0.633235930725411
Energy: 0.6453051836748469
Energy: 0.6780310113624342

minimum gb energy = 0.6316775958908731 eV
minimum distance =  2.5975559214974 Angstroms
sigma value = 15


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

Energy: 1.1500438168823348
Energy: 0.6857456044459397
Energy: 0.6514932985051186
Energy: 0.6646793080902634
Energy: 0.700655968921804
Energy: 0.6363479385641644
Energy: 0.7141677698784221
Energy: 0.6944354891434747
Energy: 0.6357918719652105
Energy: 0.6922806191482418
Energy: 0.6313956193888526
Energy: 0.6687256359177899
Energy: 0.6611632495881521
Energy: 0.6621912004784662
Energy: 0.642946213012781
Energy: 0.6227980248335772
Energy: 0.6710082838595907
Energy: 0.6600895314096444
Energy: 0.6832470019958818
Energy: 0.6358156973500255
Energy: 0.7099915971445796
Energy: 0.6659843305088803
Energy: 0.6359844461570511
Energy: 0.6770418491574826
Energy: 0.6460946592876986
Energy: 0.7094866062346791
Energy: 0.6628506761223807
Energy: 0.6340577144666606
Energy: 0.670957684870679
Energy: 0.7268644930643158
Energy: 0.6753643995803886
Energy: 0.6394082487396405
Energy: 0.6820325544610968
Energy: 0.7132846891535133
Energy: 0.7318744547917017
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Energy: 0.6329695082065
Energy: 0.682387536702998
Energy: 0.7119595290285224
Energy: 0.7271491205478671
Energy: 0.718767501591162
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Energy: 0.6309363836061478
Energy: 0.636036375276882
Energy: 0.6760702883844192
Energy: 0.6951234586850035
Energy: 0.6758352060159702
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Energy: 0.6352329959772898
Energy: 0.635259148464411
Energy: 0.6939953657991502
Energy: 0.7765378502172934
Energy: 0.6401259414379759
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Energy: 0.6354885966814701
Energy: 0.7207891553780118
Energy: 0.8497911315237019
Energy: 0.6408028723914286
Energy: 0.6344005785673273
Energy: 0.6373503680251501
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Energy: 0.6693996745557467
Energy: 0.6391263000729652
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Energy: 0.7066543598851696
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Energy: 0.6464647199252124
Energy: 0.6330977394225515
Energy: 0.6959784121510467
Energy: 0.638229084122369
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Energy: 0.6974189515434877
Energy: 0.6389425574440768
Energy: 0.7811670787442121
Energy: 0.6696774414142564
Energy: 0.675642969150837
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Energy: 0.6385481881383738
Energy: 0.7790345963255693
Energy: 0.6820695215683775
Energy: 0.6692858927714983
Energy: 0.6423083390707098
Energy: 0.6785797810842243
Energy: 0.6376202934375982
Energy: 0.6380100820753578
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Energy: 0.6467865813235224
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Energy: 0.6436015482849848
Energy: 0.6458760864803491
Energy: 0.6757937582820307
Energy: 0.6512819232414394
Energy: 0.6409723692229169
Energy: 0.6464978770071802
Energy: 0.6458485405167221
Energy: 0.6742853387170626
Energy: 0.64735367357637
Energy: 0.6417836300865631
Energy: 0.6443210934389207
Energy: 0.6436599440432741
Energy: 0.7465220517351892
Energy: 0.6699164395879271
Energy: 0.6334160260752993
Energy: 0.6229372583521559
Energy: 0.7037501728202448
Energy: 0.7462508721596023
Energy: 0.6586097261002011
Energy: 0.6309642555353457
Energy: 0.6227049991689436
Energy: 0.6725365165204682
Energy: 0.6843915791286798
Energy: 0.6589489041597102
Energy: 0.6387169901793134
Energy: 0.6407899843897392
Energy: 0.6725323138955898
Energy: 0.6927505778182055
Energy: 0.6653973281922639
Energy: 0.6509288122075615
Energy: 0.648851323579235
Energy: 0.6705237941567661
Energy: 0.6606451758595026
Energy: 0.6790815747823723
Energy: 0.7025773993192316
Energy: 0.6803300492954821
Energy: 0.6590236988207308
Energy: 0.6606402825951624
Energy: 0.6816188455842548
Energy: 0.6180560794431192
Energy: 0.6786225602093119
Energy: 0.6506888042773212
Energy: 0.636250746618642
Energy: 0.6813008492401795
Energy: 0.7329311628913486
Energy: 0.7013324810034187
Energy: 0.6653104136388612
Energy: 0.6459259702476309
Energy: 0.6861043929707079
Energy: 0.7333045858196611
Energy: 0.7104749984215964
Energy: 0.6571526620147455
Energy: 0.728288071519371
Energy: 0.7336208487508664
Energy: 0.646812498531159
Energy: 0.6804054675074583
Energy: 0.6451251164295895
Energy: 0.7262919485774405
Energy: 0.7324474785898539
Energy: 0.6432772276723268
Energy: 0.6743082931111789
Energy: 0.6265078696773193
Energy: 0.6273516925742205
Energy: 0.6412316621434977
Energy: 0.6641084898687303
Energy: 0.7184377180150661
Energy: 0.7043878194246604
Energy: 0.627491408194171
Energy: 0.6502455829344823
Energy: 0.7228791832202791
Energy: 0.7333518510915892
Energy: 0.7059149470884487
Energy: 0.648189575353982
Energy: 0.7525526325708383
Energy: 0.7549541221018211
Energy: 0.6586748793697386
Energy: 0.6395003497959529
Energy: 0.7405338540808759
Energy: 0.7431004414586778
Energy: 0.7546058952363118
Energy: 0.6575975812035529
Energy: 0.6378653782913425
Energy: 0.6370654076617299
Energy: 0.6530480942239948
Energy: 0.6569035465901253
Energy: 0.6384202698308852
Energy: 0.6417279081388075
Energy: 0.637029278441654
Energy: 0.6235927251640327
Energy: 0.6409558026575977
Energy: 0.6386530861091312
Energy: 0.6414673292894283
Energy: 0.6558636619030278
Energy: 0.7040824749758675
Energy: 0.6775701215140773
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Energy: 0.6377530821941995
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Energy: 0.6379813078315368
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Energy: 0.6779298115082979
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Energy: 0.6206839243923518
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Energy: 0.6232061651342318
Energy: 0.6490376669756573
Energy: 0.6779445640318266
Energy: 0.6378246777492644
Energy: 0.6401059468786838
Energy: 0.6429980773041837
Energy: 0.6428035352345784
Energy: 0.6735908362940652
Energy: 0.6493062464823949
Energy: 0.6407720527346956
Energy: 0.6455132626897602
Energy: 0.6461229059746892
Energy: 0.7465905132078641
Energy: 0.673461261495938
Energy: 0.6308538715227039
Energy: 0.6299886257434373
Energy: 0.6646542282315631
Energy: 0.7455659743271319
Energy: 0.677626809444915
Energy: 0.6221820997473047
Energy: 0.6223942298236059
Energy: 0.6692323755696535
Energy: 0.6851973050529322
Energy: 0.6370273807074547
Energy: 0.6392164759777718
Energy: 0.6401848778588138
Energy: 0.6593232905850728
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Energy: 0.623426707281041
Energy: 0.6401646244583317
Energy: 0.6420631866389898
Energy: 0.6671825799932573
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Energy: 0.6896036544620526
Energy: 0.7061824096674607
Energy: 0.6506930769868511
Energy: 0.6393724920620858
Energy: 0.6627556116301676
Energy: 0.6878179044517905
Energy: 0.6395499140695754
Energy: 0.6402948913761004
Energy: 0.6388728952321683
Energy: 0.6356028677714024
Energy: 0.6741413884059423
Energy: 0.7296649707371331
Energy: 0.7124421817965758
Energy: 0.6742027905050847
Energy: 0.6469628553934508
Energy: 0.6801883078192807
Energy: 0.7324101768923705
Energy: 0.6470431376765292
Energy: 0.6897298214161766
Energy: 0.6503420873411184
Energy: 0.730980483897017
Energy: 0.6435279078765114
Energy: 0.7117760350227992
Energy: 0.6532048800538642
Energy: 0.7272692376925526
Energy: 0.7322959056837826
Energy: 0.6467883247308585
Energy: 0.7059765437028948
Energy: 0.6250404638233725
Energy: 0.6298112810188189
Energy: 0.7472390636243276
Energy: 0.6664706614226361
Energy: 0.7296032611516566
Energy: 0.7034466208686544
Energy: 0.633173121149021
Energy: 0.7448551682248579
Energy: 0.6690521754086324
Energy: 0.7097786999994561
Energy: 0.6803862441103148
Energy: 0.7310543793219267
Energy: 0.7530827974473173
Energy: 0.752871019843125
Energy: 0.672666572459069
Energy: 0.6369014153422834
Energy: 0.7243631557598866
Energy: 0.7532111650856711
Energy: 0.7520172294517043
Energy: 0.6933144417230606
Energy: 0.6360207176055738
Energy: 0.635889131825097
Energy: 0.6480330757937885
Energy: 0.6396515684901836
Energy: 0.6358489901779106
Energy: 0.6415474841919054
Energy: 0.6360389794544367
Energy: 0.6414529005911723
Energy: 0.6391513181582964
Energy: 0.6396240810871124
Energy: 0.6414711139747674
Energy: 0.6413149730570462
Energy: 0.7020406519154926
Energy: 0.6869476617854012
Energy: 0.6349569303385398
Energy: 0.6367346891054967
Energy: 0.6670888192675634
Energy: 0.7033074084420154
Energy: 0.6712277692387756
Energy: 0.6349724076423152
Energy: 0.6368837200821531
Energy: 0.6983065343085659
Energy: 0.6317791504253844
Energy: 0.637022209751637
Energy: 0.6776795841166008
Energy: 0.6740128213687682
Energy: 0.6707139595653011
Energy: 0.6315040096145812
Energy: 0.6273881792142185
Energy: 0.6860325677587591
Energy: 0.6864918916357569
Energy: 0.638458890352688
Energy: 0.6368005559463681
Energy: 0.6790182071630525
Energy: 0.7782566298214192
Energy: 0.6384648386418746
Energy: 0.6236459333220836
Energy: 0.6232523932958707
Energy: 0.6673427495744606
Energy: 0.7807861259988593
Energy: 0.6391668527806467
Energy: 0.642986037405151
Energy: 0.64046671002176
Energy: 0.6430293619039988
Energy: 0.6356430320252815
Energy: 0.63494279747529
Energy: 0.6461499695817102
Energy: 0.6450988547283463
Energy: 0.646392286387119
Energy: 0.6371096321088295
Energy: 0.642319272080077
Energy: 0.6385356200772542
Energy: 0.6270357245448941
Energy: 0.6482096371398075
Energy: 0.7350670327552093
Energy: 0.6941706968178686
Energy: 0.6238217974503173
Energy: 0.6608564853547649
Energy: 0.7414269484663955
Energy: 0.682806288469178
Energy: 0.7062570591347065
Energy: 0.6443916491695802
Energy: 0.6965324699545895
Energy: 0.6351758849397405
Energy: 0.6362280159925431
Energy: 0.6167182510336592
Energy: 0.6371811331755907
Energy: 0.7023675005447401
Energy: 0.672819697217059
Energy: 0.6609672127376586
Energy: 0.6224574640547729

minimum gb energy = 0.6167182510336592 eV
minimum distance =  2.56124751388824 Angstroms
sigma value = 437


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

Energy: 0.8868733993718894
Energy: 0.6234810042354801
Energy: 0.6537537823848208
Energy: 0.6546021181841425
Energy: 0.6946935973498078
Energy: 0.8852365710682162
Energy: 0.6118266815500862
Energy: 0.6545313443584209
Energy: 0.6048138411095433
Energy: 0.5873361980960076
Energy: 0.5850130402852438
Energy: 0.6607038375942481
Energy: 0.5984355586977482
Energy: 0.7043274905473357
Energy: 0.6026004738287062
Energy: 0.5841207219196092
Energy: 0.6206240035116257
Energy: 0.5967727608244853
Energy: 0.6595905304777301
Energy: 0.6028075511528665
Energy: 0.6470037960800835
Energy: 0.6549773403899908
Energy: 0.6588932535799668
Energy: 0.6049874847767657
Energy: 0.5881233100291425
Energy: 0.6480296296141906
Energy: 0.6552601888924705
Energy: 0.6593378956570064
Energy: 0.603200954882835
Energy: 0.6535774955540463
Energy: 0.603757937774072
Energy: 0.6045939133237903
Energy: 0.658031851828388
Energy: 0.6511011745256181
Energy: 0.6469676482718865
Energy: 0.6040906917531527
Energy: 0.6040116989013867
Energy: 0.6576632447951475
Energy: 0.6463663764342742
Energy: 0.5875371225142809
Energy: 0.6013356398317754
Energy: 0.6217021985445438
Energy: 0.6036811351473905
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Energy: 0.6152855939097108
Energy: 0.60066219299011
Energy: 0.6584008106731098
Energy: 0.606767677316943
Energy: 0.6007781872599175
Energy: 0.5846643955968842
Energy: 0.615983302368647
Energy: 0.6024998342527706
Energy: 0.5841140409720722
Energy: 0.6033598588914013
Energy: 0.6132988331996682
Energy: 0.6165531867695652
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Energy: 0.5837673543754848
Energy: 0.6022148309838264
Energy: 0.613153673230667
Energy: 0.6548516989561068
Energy: 0.6456663191085417
Energy: 0.6442008075511744
Energy: 0.6021480284071081
Energy: 0.5998078122672246
Energy: 0.6525018928488011
Energy: 0.645450862323004
Energy: 0.6440455987782845
Energy: 0.6024952094071224
Energy: 0.5998889985054987
Energy: 0.6548749220872623
Energy: 0.5860478747170704
Energy: 0.602012201430889
Energy: 0.6046503669907032
Energy: 0.6599720118294551
Energy: 0.6541859943013805
Energy: 0.5872029937720132
Energy: 0.6020253894159779
Energy: 0.6058292117404961
Energy: 0.6598550583956272
Energy: 0.601419973221936
Energy: 0.6580373753136705
Energy: 0.6132437592318624
Energy: 0.6015898416447648
Energy: 0.6031210215413862
Energy: 0.6008449948136074
Energy: 0.6575536657184732
Energy: 0.6123695172484682
Energy: 0.6048508760207798
Energy: 0.6024684945766766
Energy: 0.5869216869880257
Energy: 0.6084495531722858
Energy: 0.5866802039160982
Energy: 0.5879802615827875
Energy: 0.6207873834541183
Energy: 0.6015024210634223
Energy: 0.6071256338998556
Energy: 0.5880763508204659
Energy: 0.585795570418778
Energy: 0.6172800646328133
Energy: 0.5848670486719416
Energy: 0.5844030021355607
Energy: 0.6124769917755473
Energy: 0.6130740988294994
Energy: 0.5854516958165035
Energy: 0.5844636455050403
Energy: 0.5840498031064424
Energy: 0.6137094334626249
Energy: 0.6132981328073575
Energy: 0.6053777321266925
Energy: 0.5873748759438235
Energy: 0.5870518847470568
Energy: 0.5873069289856847
Energy: 0.6690646518285547
Energy: 0.5862984952183965
Energy: 0.5840343272416119
Energy: 0.588367815360879
Energy: 0.5883970782271718
Energy: 0.6387956783938284
Energy: 0.5854124252866908
Energy: 0.5853050366460169
Energy: 0.5870357107456664
Energy: 0.6063319014984777
Energy: 0.659123665286777
Energy: 0.585936711860993
Energy: 0.5858052359373432
Energy: 0.5888232857759514
Energy: 0.6058059038247092
Energy: 0.6584364609164564
Energy: 0.5850585574304202
Energy: 0.5883723229043558
Energy: 0.6131574559283965
Energy: 0.6782260869975882
Energy: 0.5871372248715016
Energy: 0.5894879387500547
Energy: 0.7119014272788918
Energy: 0.6130581181607928
Energy: 0.7126482830414179
Energy: 0.5862901452992156
Energy: 0.613969874089833

minimum gb energy = 0.5837673543754848 eV
minimum distance =  2.6420438169022 Angstroms
sigma value = 33