Model name: model_name=EAM_Dynamo_HaleWongZimmerman_2008PairHybrid_PdAgH__MO_104806802344_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=4.089974194765093
cohesive_energy=2.8502318916670517
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=[9.00674810039538e-20, 1.419446786715666e-19, 1.8592779184579797e-19, 2.23412316374862e-19, 2.55088950605676e-19, 2.8220739231276e-19, 3.05656849527984e-19, 3.2607338637504597e-19, 3.4398892549643398e-19, 3.59951411300976e-19, 3.7442387283589796e-19, 3.87657851832738e-19, 3.9969660706061396e-19, 4.1049047104387196e-19, 4.200106046031e-19, 4.2827943821117394e-19, 4.35353048050284e-19, 4.41298725539058e-19, 4.46183762096124e-19, 4.50065836080306e-19, 4.53002625850428e-19, 4.5504219670551e-19, 4.562342161212059e-19, 4.5662194286663395e-19, 4.56206979118428e-19, 4.54867559452404e-19, 4.52440261851894e-19, 4.48703985941406e-19, 4.43221337499858e-19, 4.35345037167114e-19, 4.24331674984998e-19, 4.0934972128046395e-19, 3.8946510707588997e-19, 3.6363481538254193e-19, 3.3074373126315597e-19, 2.8953414606004195e-19, 2.38498411560606e-19, 1.7577960504604198e-19, 9.89956102969188e-20, 5.031219153152159e-21, -1.099182892815504e-19, -2.50149440043054e-19, -4.2054733377548993e-19, -6.271608281428619e-19, -8.784157700633759e-19, -1.1865591977273279e-18, -1.568756831591394e-18, -2.05067393915562e-18, -2.67384054094992e-18, -3.50362384146486e-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: -5.85410000009112e-06 eV

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

Energy: 0.009715422915619523
Energy: 0.07060082077892575
Energy: 0.07194074911228569
Energy: 0.0718382019396108
Energy: 0.01224619930753974
Energy: 0.01064396904283055
Energy: 0.07041640508930938
Energy: 0.07216318550930555
Energy: 0.07135130253676063
Energy: 0.011644882915391399
Energy: 0.07061095074724304
Energy: 0.07029080489591658
Energy: 0.07060259899175524
Energy: 0.07192863606576569
Energy: 0.07207211452996663
Energy: 0.0709073472240316
Energy: 0.07033464069764662
Energy: 0.07045006185977623
Energy: 0.07202855209055427
Energy: 0.07181992200305276
Energy: 0.07219072962693207
Energy: 0.012195597447600093
Energy: 0.010045245320091685
Energy: 0.07077681876152987
Energy: 0.07125337891379119
Energy: 0.07216441976076554
Energy: 0.01179249543541953
Energy: 0.009927209362457657
Energy: 0.0705726753202376
Energy: 0.0719217165371429
Energy: 0.07150039519975168
Energy: 0.010669130827541612
Energy: 0.010614271235130658
Energy: 0.07081006073756399
Energy: 0.07064096912333169
Energy: 0.07227923108222295
Energy: 0.010868774064999871
Energy: 0.010122136350294367
Energy: 0.07062473181530007
Energy: 0.0704429768562944
Energy: 0.07129477098000128
Energy: 0.07114353985174524
Energy: 0.07254483833844351
Energy: 0.01090219197955618
Energy: 0.010253091195128983
Energy: 0.0709016205267788
Energy: 0.07164589941740036
Energy: 0.07253812344379683
Energy: 0.01167114433945241
Energy: 0.07027213969685886
Energy: 0.07266500669419956
Energy: 0.07070067332641469
Energy: 0.07132952847907346
Energy: 0.010424089608940746
Energy: 0.01004828984243399
Energy: 0.07056718888645012
Energy: 0.07035257381745874
Energy: 0.07159999460566148
Energy: 0.010851302856556427
Energy: 0.01017261117666298
Energy: 0.010100596845649736
Energy: 0.07259028207862936
Energy: 0.07137549264923758
Energy: 0.07113789331946371
Energy: 0.07308460043149836
Energy: 0.010127193564028374
Energy: 0.07303766672695726
Energy: 0.07118874169626375
Energy: 0.07147806285101069
Energy: 0.07265367696389045

minimum gb energy = 0.009715422915619523 eV
minimum distance =  2.8516026122343 Angstroms
sigma value = 3


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

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Energy: 0.6043186680451328
Energy: 0.6413800610218335
Energy: 0.6174669580920727
Energy: 0.6032623903691623
Energy: 0.6277617123167397
Energy: 0.6056248489435238
Energy: 0.642025074673912
Energy: 0.6276041470071396
Energy: 0.6255940172195509
Energy: 0.586592792073077
Energy: 0.6705911411388132
Energy: 0.6458392506516589
Energy: 0.5535052719716163
Energy: 0.49113525195204183
Energy: 0.49070880989015064
Energy: 0.6456029505374781
Energy: 0.641725813952558
Energy: 0.5602220714626386
Energy: 0.5662707847870481
Energy: 0.571309805053628
Energy: 0.7143447257816818
Energy: 0.5530620760127232
Energy: 0.49070348744237224
Energy: 0.4905267840243708
Energy: 0.48973568861891814
Energy: 0.5470217152234392
Energy: 0.5525406918715151
Energy: 0.49014029730275344
Energy: 0.5587582798869658
Energy: 0.5862263492586766
Energy: 0.6881046566930187
Energy: 0.6761886971669898
Energy: 0.4895066006844857
Energy: 0.4899295041089066
Energy: 0.49013952807418154
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Energy: 0.6760023919487258
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Energy: 0.5591347611010189
Energy: 0.6755554383234154
Energy: 0.6284311353444474
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Energy: 0.7030263782601496
Energy: 0.5651433500556964
Energy: 0.6515310682301737
Energy: 0.5961671627904329
Energy: 0.6230527558062807
Energy: 0.6516031074039187
Energy: 0.5229380144461667
Energy: 0.6665853864873652
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Energy: 0.6116381176752459
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Energy: 0.6204214795990691
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Energy: 0.6531028110050532
Energy: 0.7016455124461979
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Energy: 0.6262272541006408
Energy: 0.5700072106216401
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Energy: 0.7066035480418923
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Energy: 0.6487898123795013
Energy: 0.6572159016782081
Energy: 0.6431090573132485
Energy: 0.689376449738953
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Energy: 0.6449350638410435
Energy: 0.7198314457260582
Energy: 0.6487029515169214
Energy: 0.6489927140704768
Energy: 0.6565706538241106
Energy: 0.6567641308167009
Energy: 0.6428607589143183
Energy: 0.6482457580611226
Energy: 0.6437884789115723
Energy: 0.6572402909839129
Energy: 0.6436134327253452
Energy: 0.651383568531189
Energy: 0.51531172013368
Energy: 0.6995982759969679
Energy: 0.6527604253206198
Energy: 0.7064556628192314
Energy: 0.6227828411553714
Energy: 0.5461064010889054
Energy: 0.6475145155198736
Energy: 0.6589783135363144
Energy: 0.5744877064514567
Energy: 0.5171596852290151
Energy: 0.5149371833192049
Energy: 0.5487459890560641
Energy: 0.5486433745936526
Energy: 0.5683523339803902
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Energy: 0.5154963567304329
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Energy: 0.519194755965098
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Energy: 0.5768527103906522
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Energy: 0.6418668895495224
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Energy: 0.5166133306840137
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Energy: 0.6556697149598428
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Energy: 0.6449036581503879
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Energy: 0.5630028930619391
Energy: 0.603689439491298
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Energy: 0.6411560048968397
Energy: 0.6111793756195378
Energy: 0.6872059020565281
Energy: 0.656758152312992
Energy: 0.7033894524441884
Energy: 0.5772841281174118
Energy: 0.5189450236848134
Energy: 0.6794000864023595
Energy: 0.64476940140255
Energy: 0.703694893868115
Energy: 0.58341094485305
Energy: 0.5631305739734936
Energy: 0.573397714827331
Energy: 0.6583925890739956
Energy: 0.5907615146740159
Energy: 0.5205544069683848
Energy: 0.5184053344678319
Energy: 0.5787268193825514
Energy: 0.6241916931715472
Energy: 0.5643106251758407
Energy: 0.5719025946989313
Energy: 0.5176727589353777
Energy: 0.568281598411453
Energy: 0.5516180038350319
Energy: 0.5505884335270858
Energy: 0.5176808193902809
Energy: 0.6176728683213464
Energy: 0.538556558227838
Energy: 0.5511698633324578
Energy: 0.5810035748327678
Energy: 0.6093177364267364
Energy: 0.5190715363086723
Energy: 0.5703418977385266
Energy: 0.5512273228493922
Energy: 0.7218440644139703
Energy: 0.521752328398301
Energy: 0.5201831036019451
Energy: 0.6695916685429624
Energy: 0.6378768278383348
Energy: 0.5527868390765582
Energy: 0.49351219052623024
Energy: 0.5207703202900653
Energy: 0.7024633601120351
Energy: 0.6414372624176053
Energy: 0.7717893389165252
Energy: 0.6396946789729067
Energy: 0.6748009769027018
Energy: 0.6620916269746431
Energy: 0.6623946668314722
Energy: 0.625899862294124
Energy: 0.5138165301893449
Energy: 0.5773898751313726
Energy: 0.6299820255856152
Energy: 0.6616193050094638
Energy: 0.562604215395201
Energy: 0.5646468070038703
Energy: 0.6897979245622075
Energy: 0.607139186416186
Energy: 0.6524085368036134
Energy: 0.4935338504253334
Energy: 0.4923471825805693
Energy: 0.6772348737845045
Energy: 0.6083169085428964
Energy: 0.6963081868561588
Energy: 0.6289353860798746
Energy: 0.6072965841596101
Energy: 0.6424317118338119
Energy: 0.6043629972352896
Energy: 0.6034225921831412
Energy: 0.6023501965706509
Energy: 0.6061199366989781
Energy: 0.6412025562866568
Energy: 0.6269064729598759
Energy: 0.5959849867498833

minimum gb energy = 0.4895066006844857 eV
minimum distance =  2.59808501977001 Angstroms
sigma value = 75


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

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Energy: 0.7006502854092512
Energy: 0.6064587674540309
Energy: 0.6113526505417791
Energy: 0.6976604434088699
Energy: 0.5915974811650592
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Energy: 0.6401610482640108
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Energy: 0.7593770858526844
Energy: 0.6200581248564652
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Energy: 0.6386737449837045
Energy: 0.6308831927313879
Energy: 0.5992589864041415
Energy: 0.6127943942585009
Energy: 0.6422793002218002
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Energy: 0.6226594792443427
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Energy: 0.6179086385008633
Energy: 0.6063584623037255
Energy: 0.7474387031276939
Energy: 0.6461879250964767
Energy: 0.6009193059000449
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Energy: 0.6140083849850636
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Energy: 0.6024916940937615
Energy: 0.7351767358480861
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Energy: 0.7202281444485904
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Energy: 0.6618620980176768
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minimum gb energy = 0.5799352053078655 eV
minimum distance =  2.62709729145405 Angstroms
sigma value = 105


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

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Energy: 0.6361317006524504
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Energy: 0.6709297077328509
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Energy: 0.6600768465818653
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Energy: 0.6352289869363558
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Energy: 0.6299977932541573
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Energy: 0.6669231070973585
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Energy: 0.6582821465041894
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Energy: 0.6404518060663809
Energy: 0.6398461211771758
Energy: 0.6357356969254404
Energy: 0.6495963651520446
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Energy: 0.6229770161816374
Energy: 0.6211891422775673
Energy: 0.6486768606574007
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Energy: 0.6487054215095894
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Energy: 0.6307828106034351
Energy: 0.6306686572033635
Energy: 0.6674936913325884
Energy: 0.6342837204076746
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Energy: 0.6617772330688546
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Energy: 0.6352013142399963
Energy: 0.624853057800286
Energy: 0.6620636908353851
Energy: 0.6464522300454081
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Energy: 0.6315722662516798
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Energy: 0.6353118942296145
Energy: 0.6616552721485316
Energy: 0.6619421424001048
Energy: 0.6205190057113354
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Energy: 0.6351898431247216
Energy: 0.646123855860002
Energy: 0.6908508302118548
Energy: 0.6456297482517632
Energy: 0.6345645764395584
Energy: 0.655886434521188
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Energy: 0.633467331820574
Energy: 0.6545100655223628
Energy: 0.6464567370273151
Energy: 0.6560477069303962
Energy: 0.6619525407042207
Energy: 0.646142961357003
Energy: 0.6614986808285829
Energy: 0.6615683100472683
Energy: 0.6240122904554953
Energy: 0.6212943507156465
Energy: 0.6232684967950788
Energy: 0.6619114412106265
Energy: 0.6619063432402368
Energy: 0.6244617460643332
Energy: 0.6911645172420479
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Energy: 0.6611490322316392
Energy: 0.6417503856097873
Energy: 0.6813748327185282
Energy: 0.6127548526305296
Energy: 0.6572893326998048
Energy: 0.6612434697761196
Energy: 0.6420145539728586
Energy: 0.687596734242099
Energy: 0.6596798570357101
Energy: 0.665923439673767
Energy: 0.6634929346515054
Energy: 0.6431894165456017
Energy: 0.6808671542878374
Energy: 0.6601752450764512
Energy: 0.659482808191341
Energy: 0.6545133795223226
Energy: 0.6538636421332004
Energy: 0.6782318540656418
Energy: 0.6576609041800835
Energy: 0.6571608443441964
Energy: 0.6626290079195257
Energy: 0.6603477085885345
Energy: 0.6574984637370873
Energy: 0.6580057838341944
Energy: 0.6585653524518378
Energy: 0.6309439376070535
Energy: 0.661159141859434
Energy: 0.6619596193593534
Energy: 0.6589193391536435
Energy: 0.658271218321031
Energy: 0.6758289020165845
Energy: 0.6530474423684189
Energy: 0.6555960737980697
Energy: 0.6478614783669876
Energy: 0.6705555595975997
Energy: 0.6748549889059114
Energy: 0.676170778236533
Energy: 0.6382707594761212
Energy: 0.6953747248694802
Energy: 0.63182103180555
Energy: 0.6606502677858295
Energy: 0.64599882644873
Energy: 0.6404103451999827
Energy: 0.6467238310277695
Energy: 0.6052390608778349
Energy: 0.6584671917957666
Energy: 0.6542921832966032
Energy: 0.6482284382861858
Energy: 0.6537271662790236
Energy: 0.6329649594194767
Energy: 0.6478910221867682
Energy: 0.6492369105089875
Energy: 0.6114198290038972
Energy: 0.6561700435498542
Energy: 0.6335543710253153
Energy: 0.6591906177565175
Energy: 0.657627722496275
Energy: 0.6673079922743573
Energy: 0.6811366422495514
Energy: 0.6588059608316303
Energy: 0.6488826262298952
Energy: 0.6554901741162178
Energy: 0.7016347798733946
Energy: 0.6331144539214679
Energy: 0.6588434727386477
Energy: 0.6623835158257858
Energy: 0.6553797499786022
Energy: 0.6984518138102099
Energy: 0.6595353792047648
Energy: 0.6277679236545762
Energy: 0.6256042756632195
Energy: 0.611599139170022
Energy: 0.6489434772864299
Energy: 0.6093390358329691
Energy: 0.6213977504728445
Energy: 0.6169435994554203
Energy: 0.617782072562167
Energy: 0.6578868118380643
Energy: 0.6424966596940052
Energy: 0.6163110530196327
Energy: 0.617494352358974
Energy: 0.6159528151849754
Energy: 0.6173724246489181
Energy: 0.6160951434027071
Energy: 0.6166207306306181
Energy: 0.6250088666325059
Energy: 0.6161434174339061
Energy: 0.6601467440661208

minimum gb energy = 0.5997471301069093 eV
minimum distance =  2.63322984806519 Angstroms
sigma value = 165


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

Energy: 0.8167086919578169
Energy: 0.5943281160020171
Energy: 0.5935218291147139
Energy: 0.6218956769928173
Energy: 0.5879368819721401
Energy: 0.8158295025804281
Energy: 0.5943785644236141
Energy: 0.5933419402283162
Energy: 0.6212650887880734
Energy: 0.5877440032482703
Energy: 0.6166893754761015
Energy: 0.6220935720838654
Energy: 0.6160360435585772
Energy: 0.6147626768266038
Energy: 0.6143354138295326
Energy: 0.6171178256503529
Energy: 0.6186386802470788
Energy: 0.616783305937556
Energy: 0.6155070589459125
Energy: 0.6195723045105582
Energy: 0.6182066257324031
Energy: 0.6401528332884197
Energy: 0.5930245876456373
Energy: 0.6192691858820871
Energy: 0.6314406341788731
Energy: 0.6178663818585672
Energy: 0.594262978037558
Energy: 0.6192895544044409
Energy: 0.6194106851575747
Energy: 0.6309167999705152
Energy: 0.5871557780304062
Energy: 0.6205011753991387
Energy: 0.617234881232847
Energy: 0.6191465007047425
Energy: 0.6308730087907191
Energy: 0.6391155442935306
Energy: 0.6188017056758868
Energy: 0.617457775269748
Energy: 0.6191485057963038
Energy: 0.6294713141133891
Energy: 0.6243585444124744
Energy: 0.6219210193538255
Energy: 0.6144648796504977
Energy: 0.6145358829486511
Energy: 0.616727403104897
Energy: 0.6205122019814299
Energy: 0.5904141088580919
Energy: 0.6141556039027883
Energy: 0.6159842038906955
Energy: 0.6172051946087216
Energy: 0.6559590226207229
Energy: 0.6168665266258406
Energy: 0.5937012889001362
Energy: 0.5897677120851188
Energy: 0.5966011515589327
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Energy: 0.6166301758568169
Energy: 0.5942188535775259
Energy: 0.5889220005238545
Energy: 0.5967938404126123
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Energy: 0.6159041566968044
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Energy: 0.5932777655848057
Energy: 0.6211776428791429
Energy: 0.6409509024453689
Energy: 0.5936399540807646
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Energy: 0.6311601901019638
Energy: 0.6139118207665305
Energy: 0.6151876033094197
Energy: 0.6145473140710208
Energy: 0.6165485168154741
Energy: 0.5917113986552539
Energy: 0.6137124113283631
Energy: 0.6156911529498271
Energy: 0.6147630669457185
Energy: 0.5892621647248171
Energy: 0.5924891538746098
Energy: 0.615987010756043
Energy: 0.5933120860282568
Energy: 0.6147753481888346
Energy: 0.6141926761429746
Energy: 0.5914539594690603
Energy: 0.5967727323607919
Energy: 0.5937219362120129
Energy: 0.614399307364058
Energy: 0.630166870177645
Energy: 0.6430516861802611
Energy: 0.6221932750182952
Energy: 0.6194768133923204
Energy: 0.6173666764111554
Energy: 0.6158367644372272
Energy: 0.6421238035466025
Energy: 0.6210155206379203
Energy: 0.6181160035144786
Energy: 0.6176556353395926
Energy: 0.6165553041645887
Energy: 0.6170843486107961
Energy: 0.6179201932981178
Energy: 0.6191153438872491
Energy: 0.6190702844747753
Energy: 0.6299869482702725
Energy: 0.6199203291958448
Energy: 0.6175367991828088
Energy: 0.6199454269731872
Energy: 0.6400640619776979
Energy: 0.6306723868682741
Energy: 0.6166677949292755
Energy: 0.6144210965780904
Energy: 0.6175245268167348
Energy: 0.6167415745176739
Energy: 0.6274389912603419
Energy: 0.6208214543862244
Energy: 0.6261925455768733
Energy: 0.6174612610076182
Energy: 0.6178811146914325
Energy: 0.6261683293722442
Energy: 0.6659699313524633
Energy: 0.5900280660161781
Energy: 0.614879471056469
Energy: 0.6176916745712746
Energy: 0.5925466019826079
Energy: 0.5906616182588764
Energy: 0.6161049880396189
Energy: 0.6148646588077806
Energy: 0.6179355366969587
Energy: 0.5925796993006981
Energy: 0.6153579057940322
Energy: 0.6212327996202404
Energy: 0.6139581781632645
Energy: 0.5877936721736092
Energy: 0.6143827877624439
Energy: 0.6407288230267963
Energy: 0.6202432532301649
Energy: 0.5959799191435651
Energy: 0.5880526498430614
Energy: 0.6137958550084657
Energy: 0.588394161613067
Energy: 0.6168480846390998
Energy: 0.6222545384931626
Energy: 0.5938918087554497
Energy: 0.622710195243418
Energy: 0.6160123062262801
Energy: 0.6158220410128025
Energy: 0.6220926625325447
Energy: 0.5935652375454938
Energy: 0.6223987706445249

minimum gb energy = 0.5871557780304062 eV
minimum distance =  2.66977636018246 Angstroms
sigma value = 41


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

Energy: 0.5580354650664249
Energy: 0.5389732940934553
Energy: 0.5387111008397536
Energy: 0.5341568908091892
Energy: 0.5443263008470131
Energy: 0.5511526409890445
Energy: 0.5441270685589944
Energy: 0.5408432196653694
Energy: 0.5465262982068326
Energy: 0.5419488978932653
Energy: 0.5720105521293882
Energy: 0.55908463934453
Energy: 0.5407211967594062
Energy: 0.5454058412279538
Energy: 0.5396302690259025
Energy: 0.5618906679634499
Energy: 0.534560142536284
Energy: 0.5464014133823294
Energy: 0.5535117436645605
Energy: 0.5849171768253593
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Energy: 0.5664436415220546
Energy: 0.5676425192307839
Energy: 0.5484731544691327
Energy: 0.553455980886961
Energy: 0.547404354396747
Energy: 0.5430675617675466
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Energy: 0.5570508815971826
Energy: 0.5740182575527987
Energy: 0.554972073248991
Energy: 0.5417680597367079
Energy: 0.5594692070146772
Energy: 0.5541988764856783
Energy: 0.6384118111067266
Energy: 0.5684573116965864
Energy: 0.5679073577762298
Energy: 0.5437375377784724
Energy: 0.5616126951695406
Energy: 0.6354058441253141
Energy: 0.5677238149092232
Energy: 0.5577824504494013
Energy: 0.5600569886506265
Energy: 0.5594060074411541
Energy: 0.566495467279456
Energy: 0.551754273931834
Energy: 0.5565812510133956
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Energy: 0.5435087985577559
Energy: 0.5902376179003331
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Energy: 0.5516386034935233
Energy: 0.5638591819684429
Energy: 0.5435998423606536
Energy: 0.5548114749804889
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Energy: 0.5763576354766496
Energy: 0.5759001756469014
Energy: 0.5698009354937238
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Energy: 0.5657605745939027
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Energy: 0.5587243327979294
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Energy: 0.5530996639285496
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Energy: 0.5566023806841277
Energy: 0.560368611209921
Energy: 0.5569162736832547
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Energy: 0.5533820108976666
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Energy: 0.5715757023013178
Energy: 0.5475207789771147
Energy: 0.5753347262859527
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Energy: 0.5491809929278084
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Energy: 0.5382307253488745
Energy: 0.5476427055004316
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Energy: 0.5480667760272284
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Energy: 0.553417542628977
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Energy: 0.5634331745569442
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Energy: 0.5369815364043848
Energy: 0.5550594595538255
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Energy: 0.5595889977969848
Energy: 0.5700496734666033
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Energy: 0.5546645009846236
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Energy: 0.5515402982847153
Energy: 0.5620873783136576
Energy: 0.5569511000598156
Energy: 0.5571922315425277
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Energy: 0.5568658348708354
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Energy: 0.553360166761771
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Energy: 0.5653872132999492
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Energy: 0.56824490094257
Energy: 0.5766632804006215
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Energy: 0.5834940023910011
Energy: 0.5609978306288422
Energy: 0.571011901092291
Energy: 0.5775683043607482
Energy: 0.6441301691495174
Energy: 0.5631526293774647
Energy: 0.5568494820128232
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Energy: 0.5659301581600611
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Energy: 0.5594195876280172
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Energy: 0.5696100767937456
Energy: 0.5696810183724903
Energy: 0.5570167602236037
Energy: 0.5663521363747726
Energy: 0.5807655786217293
Energy: 0.5498094063797122
Energy: 0.5528395342570654
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Energy: 0.5995023317850634
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Energy: 0.5471486224329958
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Energy: 0.5525323051289749
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Energy: 0.5469307571820546
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Energy: 0.548717480365086
Energy: 0.5591680433548905
Energy: 0.5317975728772192
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Energy: 0.5515979574459631
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Energy: 0.557948148280335
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Energy: 0.6091979530691298
Energy: 0.5650121695317655
Energy: 0.5571857371701404
Energy: 0.5708172254408412
Energy: 0.5617128821654952
Energy: 0.5697546945060796
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Energy: 0.5495613389806002
Energy: 0.5683715697937455
Energy: 0.5572445915088903
Energy: 0.5717647928163077
Energy: 0.5704954220819094
Energy: 0.5836202025368138
Energy: 0.5622570860839807
Energy: 0.5569574386461923
Energy: 0.5589785855116678
Energy: 0.5657294843470341
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Energy: 0.562680005854665
Energy: 0.5575975311628631
Energy: 0.5543285021239154
Energy: 0.5687045981379375
Energy: 0.5651201317435253
Energy: 0.5433187142540494
Energy: 0.5641855833568993
Energy: 0.5504022355855277
Energy: 0.5803328110172103
Energy: 0.5642565261216018
Energy: 0.559433919296092
Energy: 0.5761059787597388
Energy: 0.5675941282619321
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Energy: 0.5587190783072418
Energy: 0.553532193485055
Energy: 0.5491410154249066
Energy: 0.560660489631674
Energy: 0.5589283890854487
Energy: 0.564777998287474
Energy: 0.5549946918659747
Energy: 0.5534658440952136
Energy: 0.5585588037250852
Energy: 0.5626084346970974
Energy: 0.5294382958416589
Energy: 0.5290695113175329
Energy: 0.5450720244724249
Energy: 0.5501124226071274
Energy: 0.56955597407319
Energy: 0.548318476657809
Energy: 0.5454999730184552
Energy: 0.5288002419407998
Energy: 0.5316853226828792
Energy: 0.548119068228707
Energy: 0.5463246871440844
Energy: 0.5348697976538742
Energy: 0.5379145282093126
Energy: 0.532165873865055
Energy: 0.5471900765414752
Energy: 0.5436718839409735
Energy: 0.5493079813045199
Energy: 0.5464046352964085
Energy: 0.5495028626209888
Energy: 0.5699803263332919
Energy: 0.5496437552540588
Energy: 0.5440964918678656
Energy: 0.5347835396721458
Energy: 0.5525840086341006
Energy: 0.5601314482642391
Energy: 0.5476870403924056
Energy: 0.5458045536718911
Energy: 0.5621266112475356
Energy: 0.5748469671140239
Energy: 0.5345028122306241
Energy: 0.5459737045630181
Energy: 0.5520715907960856
Energy: 0.540726927630994
Energy: 0.5646088600584761
Energy: 0.5343146698036687
Energy: 0.5386725347556393
Energy: 0.539025387902352
Energy: 0.551998730487015

minimum gb energy = 0.5288002419407998 eV
minimum distance =  2.66924521724938 Angstroms
sigma value = 185


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

Energy: 0.2558856766097412
Energy: 0.3016753734082042
Energy: 0.30645973631364337
Energy: 0.29542303573659734
Energy: 0.2294605630868831
Energy: 0.2282901607257256
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Energy: 0.32438819004149816
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Energy: 0.30668926700985377
Energy: 0.2906825061379589
Energy: 0.30569086454357103
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Energy: 0.296057973003349
Energy: 0.2904112555800012
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Energy: 0.28856115900453955
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Energy: 0.29538632212443977
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Energy: 0.23029756675146343
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Energy: 0.3325160994419595
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Energy: 0.29815171170962834
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Energy: 0.3084165053791191
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Energy: 0.30746034348423934
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Energy: 0.2934465020854171
Energy: 0.3291059552675456
Energy: 0.23289124479474443
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Energy: 0.33232600297612114
Energy: 0.3076069521007436
Energy: 0.29615254560378423
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Energy: 0.30492397086431444
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Energy: 0.22894529978630065
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Energy: 0.3071877876409551
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Energy: 0.2971779180613897
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Energy: 0.2970861322500568
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Energy: 0.3078106240550198
Energy: 0.29249195330325667
Energy: 0.229568147543342
Energy: 0.2423627634641888
Energy: 0.30566224412881293
Energy: 0.3116086290071507
Energy: 0.2971742399284556
Energy: 0.22942976443202137
Energy: 0.22843831921212657
Energy: 0.3057370771111415
Energy: 0.3106216619681883
Energy: 0.293866622238418
Energy: 0.22911021978104407
Energy: 0.22849959669807823
Energy: 0.3062517649218059
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Energy: 0.30448392032649163
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Energy: 0.30790719981323705
Energy: 0.3074660958890963
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Energy: 0.2412873211846038
Energy: 0.22950177890227913
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Energy: 0.3075718764632531
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Energy: 0.2968048121060396
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Energy: 0.3298762353802404
Energy: 0.2953959057209097
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Energy: 0.29330675377562265
Energy: 0.23088784384014488
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Energy: 0.3325384237866872
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Energy: 0.2962708693795989
Energy: 0.29234104566382463
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Energy: 0.30840141142321326
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Energy: 0.22778484648941658
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Energy: 0.33003927506348785
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Energy: 0.2922229621923159
Energy: 0.22836318928307778
Energy: 0.23166603986476098
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Energy: 0.22886366738119998
Energy: 0.2958878515996888
Energy: 0.30780678295617325
Energy: 0.30372442757124224
Energy: 0.2947399414469208
Energy: 0.22985868736052678
Energy: 0.2987078482844078
Energy: 0.30754076673867553
Energy: 0.30387477174836847
Energy: 0.2949176248590439
Energy: 0.29652074424112296
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Energy: 0.3075533717498206
Energy: 0.2856428981603481
Energy: 0.2423493854314091
Energy: 0.2953502856755166
Energy: 0.33285510057980183
Energy: 0.30649864477676714
Energy: 0.2946020838297384
Energy: 0.24165603338947853
Energy: 0.30927505075365896
Energy: 0.3325278481763624
Energy: 0.307322379282465
Energy: 0.24174006633519468
Energy: 0.23030038493649374
Energy: 0.3047840809620654
Energy: 0.30783727826076096
Energy: 0.29535250512541056
Energy: 0.22965451478224602
Energy: 0.23128333358533126
Energy: 0.30510351912064004
Energy: 0.3058650820162727
Energy: 0.2946619662386053
Energy: 0.2989759379678713
Energy: 0.3055159658810013
Energy: 0.2906562839251333
Energy: 0.30865833976012186
Energy: 0.30469531691893176
Energy: 0.3072418691197948
Energy: 0.2933063185278643
Energy: 0.29120693852508067
Energy: 0.3083452468322901
Energy: 0.2964000798539928
Energy: 0.2629253329439374
Energy: 0.2934738937448774
Energy: 0.2917498588966027
Energy: 0.3300707799604757
Energy: 0.29997482689762633
Energy: 0.2334517085987394
Energy: 0.2937721015402365
Energy: 0.2918893689926375
Energy: 0.32978169109679906
Energy: 0.2577028238708322

minimum gb energy = 0.22778484648941658 eV
minimum distance =  2.73713758971896 Angstroms
sigma value = 33


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

Energy: 0.5288979558051833
Energy: 0.48291529116635784
Energy: 0.5166386492687386
Energy: 0.5092821796811949
Energy: 0.47753002678471845
Energy: 0.4754234668359041
Energy: 0.4815546284807855
Energy: 0.5044480049295909
Energy: 0.5017987053172959
Energy: 0.48636115008455855
Energy: 0.4990610431589509
Energy: 0.5255126923010998
Energy: 0.5090112992395524
Energy: 0.4975422671972169
Energy: 0.49980514277040866
Energy: 0.481042968195161
Energy: 0.5111524852390058
Energy: 0.5248082150361246
Energy: 0.4988211486858187
Energy: 0.5096613479310421
Energy: 0.49962481947265525
Energy: 0.5039663818442452
Energy: 0.5030254075397137
Energy: 0.5092929765181909
Energy: 0.4843214537027608
Energy: 0.48632717441284357
Energy: 0.5064770356769546
Energy: 0.505737539358996
Energy: 0.5203257086998474
Energy: 0.4840192283277159
Energy: 0.5186907334965748
Energy: 0.5251772218286106
Energy: 0.5110791265804963
Energy: 0.4921594279037266
Energy: 0.5021540574945406
Energy: 0.5195061772483924
Energy: 0.5188330763433951
Energy: 0.5037348920604432
Energy: 0.5087456669906298
Energy: 0.4993727011725058
Energy: 0.5060140340522633
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Energy: 0.5187682579034713
Energy: 0.4978110971134567
Energy: 0.47658237503086126
Energy: 0.5118347307432568
Energy: 0.5162268231055953
Energy: 0.5187229409862572
Energy: 0.4983485633566902
Energy: 0.499311647292281
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Energy: 0.5060793631357259
Energy: 0.5445930418226115
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Energy: 0.4842082386745345
Energy: 0.5080697809197138
Energy: 0.5028258030289524
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Energy: 0.4996221461028117
Energy: 0.5131603213006148
Energy: 0.5437320321530927
Energy: 0.502826591180887
Energy: 0.5129507592983681
Energy: 0.49749834310676916
Energy: 0.5235523037305526
Energy: 0.49856927073240875
Energy: 0.5091543464777625
Energy: 0.4945703308745576
Energy: 0.5128683479915547
Energy: 0.4980375612208912
Energy: 0.49836256432499443
Energy: 0.5108476476560352
Energy: 0.4941796507282707
Energy: 0.5076578543454192
Energy: 0.49831004462053274
Energy: 0.49810969642070174
Energy: 0.5079357164492342
Energy: 0.48593257456387123
Energy: 0.4874702417320271
Energy: 0.5072755064759779
Energy: 0.49792846457427564
Energy: 0.4960584783532498
Energy: 0.4857587439117551
Energy: 0.48492151113270016
Energy: 0.5071426571186478
Energy: 0.5260535309797343
Energy: 0.49830619236301865
Energy: 0.48881056768079656
Energy: 0.49586764045483606
Energy: 0.498779729052151
Energy: 0.4893237188746009
Energy: 0.4987647859905744
Energy: 0.527023136305577
Energy: 0.49573634554384166
Energy: 0.49984844628609976
Energy: 0.4979111206957133
Energy: 0.5165667104207593
Energy: 0.5099788324731144
Energy: 0.49449849222430986
Energy: 0.4946566120022389
Energy: 0.4978697928763547
Energy: 0.5153705451661404
Energy: 0.5061917251906521
Energy: 0.4959468272859949
Energy: 0.49492483972300194
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Energy: 0.5127899615504045
Energy: 0.48626313252011816
Energy: 0.5008721527002677
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Energy: 0.4881232580884507
Energy: 0.5024751620772824
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Energy: 0.49726331494702253
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Energy: 0.5117605539593467
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Energy: 0.5136435148871731
Energy: 0.4818211683114674
Energy: 0.48192594735362804
Energy: 0.47487333094189405
Energy: 0.5423253238330824
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Energy: 0.47362994184913826
Energy: 0.48217002768153827
Energy: 0.5136846668322029
Energy: 0.5165827088163819
Energy: 0.5021744839936176

minimum gb energy = 0.47362994184913826 eV
minimum distance =  2.66637740616186 Angstroms
sigma value = 219


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

Energy: 0.6450473895094746
Energy: 0.6600565133140602
Energy: 0.642195884542474
Energy: 0.6425557982113572
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Energy: 0.6542524486583551
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Energy: 0.6654864286451223
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Energy: 0.6422702874414054
Energy: 0.6424048793435886
Energy: 0.6398472926846052
Energy: 0.6407080318809796
Energy: 0.660699790825637
Energy: 0.6424817077047813
Energy: 0.6412196564192426
Energy: 0.6390597261007529
Energy: 0.6440836256887329
Energy: 0.643218632996462
Energy: 0.640230361742467
Energy: 0.6500480155549796
Energy: 0.6392690759098366
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Energy: 0.6511265591884635
Energy: 0.6411780079220992
Energy: 0.6360042033241311
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Energy: 0.6373295353926955
Energy: 0.6487881630643569
Energy: 0.6419716776196241
Energy: 0.6429791814591775
Energy: 0.6412220596738419

minimum gb energy = 0.6344182537275589 eV
minimum distance =  2.67624428875592 Angstroms
sigma value = 15


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

Energy: 1.1362789039486385
Energy: 0.7319527790090415
Energy: 0.7376329453482601
Energy: 0.7285639523290746
Energy: 0.7434106250737382
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Energy: 0.7471946660390844
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Energy: 0.7380689488772877
Energy: 0.7324421884149733
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Energy: 0.7511139057767322
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Energy: 0.7312846557609572
Energy: 0.7512241745587158
Energy: 0.7294396071986925
Energy: 0.7408484247815024
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Energy: 0.7355748031645672
Energy: 0.7373486166257426
Energy: 0.7459322376018105
Energy: 0.7409102101915728
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minimum gb energy = 0.7159433655723447 eV
minimum distance =  2.61923346353132 Angstroms
sigma value = 293


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

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Energy: 0.7697227958962802
Energy: 0.7705387066843874
Energy: 0.7209724155392376
Energy: 0.7247776473172158
Energy: 0.722074465333606
Energy: 0.7393923157704785
Energy: 0.7346924383274728
Energy: 0.7328598744038824
Energy: 0.7384324985732438
Energy: 0.7219537013768591
Energy: 0.7385176943637735
Energy: 0.7337467423337534
Energy: 0.7335767529868599
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Energy: 0.7256302092004049
Energy: 0.7202700872585126
Energy: 0.7218950370647669
Energy: 0.7261888864345514
Energy: 0.7052351795499342
Energy: 0.7268304013903718
Energy: 0.7204548192519548
Energy: 0.7222059846643524
Energy: 0.7257400828156969
Energy: 0.7290510464786574
Energy: 0.7178266677552295
Energy: 0.73196647929299
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Energy: 0.7186049860783513
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Energy: 0.7277577508494637
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Energy: 0.7210629766971205
Energy: 0.7182465412778027
Energy: 0.7335594244828824
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Energy: 0.7296446274114761
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Energy: 0.7185997284003457
Energy: 0.721226548292828
Energy: 0.7351780925380881
Energy: 0.7281750052620571
Energy: 0.7208917111648726
Energy: 0.7173346879333237
Energy: 0.7171736489594585
Energy: 0.727053108981498
Energy: 0.7208614914908265
Energy: 0.7329148813000336
Energy: 0.7193692618289426
Energy: 0.7159943990943395
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Energy: 0.7189239370882543
Energy: 0.7342092042722294
Energy: 0.7517193315829446
Energy: 0.7295612078204271
Energy: 0.7391885474819384
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Energy: 0.7379439716042733
Energy: 0.7327298426186832
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Energy: 0.7325590925265435
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Energy: 0.7368174321350353
Energy: 0.7575151731589229
Energy: 0.7358542836970734
Energy: 0.7328389385085957
Energy: 0.7466448775927423
Energy: 0.7289524677850762
Energy: 0.721403368992767
Energy: 0.752913596702358
Energy: 0.7330159134860483
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Energy: 0.7209966132339578
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Energy: 0.7280579629614504
Energy: 0.7119376936672379
Energy: 0.7038231301431469
Energy: 0.7319766351025084
Energy: 0.7187186262191239
Energy: 0.7281902860880354
Energy: 0.7110433185663078
Energy: 0.7036435683861565
Energy: 0.7318204133589341
Energy: 0.7298857194278963
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Energy: 0.7523895409879728
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Energy: 0.7312757296309884
Energy: 0.7343442998939618
Energy: 0.7193386769091902
Energy: 0.7535093590225816
Energy: 0.7263107490533288
Energy: 0.7319228397972506
Energy: 0.7342266438381303
Energy: 0.7202444493732039
Energy: 0.710295849387248
Energy: 0.7354410511720604
Energy: 0.7306295570303585
Energy: 0.7213123140548221
Energy: 0.7088961123971445
Energy: 0.7263059828975056
Energy: 0.721430368635153
Energy: 0.7404865236475798
Energy: 0.7609847884298342
Energy: 0.7113256617781583
Energy: 0.754109743754839
Energy: 0.7214316985917173
Energy: 0.7185945029842037
Energy: 0.7358776316603799
Energy: 0.7300260102541832
Energy: 0.7527537914518836
Energy: 0.7211496319823876
Energy: 0.7188171648371381
Energy: 0.7270684244854638
Energy: 0.7089919923254853
Energy: 0.7342786957568774
Energy: 0.728587573317621
Energy: 0.7200677619013819
Energy: 0.7382583469941397
Energy: 0.7209447970980398
Energy: 0.7341124293184442
Energy: 0.729690822402231
Energy: 0.7191802702505885
Energy: 0.7292397738233973
Energy: 0.7296209568867414
Energy: 0.7340041565349494
Energy: 0.7376287911876945
Energy: 0.7279506674321304
Energy: 0.7160192998972155
Energy: 0.7196336801788527
Energy: 0.7214233754913568
Energy: 0.7389082151121779
Energy: 0.7270676396381645
Energy: 0.7159840454042616
Energy: 0.7172445007764657
Energy: 0.7208819043227693
Energy: 0.7488970296166372
Energy: 0.7660786189553952
Energy: 0.7210706237498248
Energy: 0.7376180882098696
Energy: 0.7513386220983902
Energy: 0.7504686853153756
Energy: 0.7574915237586292
Energy: 0.7212509045864015
Energy: 0.7379496882652844
Energy: 0.7284661308032793
Energy: 0.7510929660386856
Energy: 0.7762216111584342
Energy: 0.7229803202299119
Energy: 0.7376450546076796
Energy: 0.722266172368956
Energy: 0.7201570834596643
Energy: 0.775583302085004
Energy: 0.7201732332260251
Energy: 0.7382746518573988
Energy: 0.7053265379149883
Energy: 0.7400368227820974
Energy: 0.72091119573865
Energy: 0.7305583738786964
Energy: 0.7393890837618577
Energy: 0.7290252239280055
Energy: 0.7298737385794797
Energy: 0.7200429754613371
Energy: 0.7308736750939898
Energy: 0.7339152111105028

minimum gb energy = 0.7036435683861565 eV
minimum distance =  2.64150051509349 Angstroms
sigma value = 293


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

Energy: 0.6965488040873066
Energy: 0.7085908330607934
Energy: 0.7505021569932722
Energy: 0.7089204866693226
Energy: 0.6966457338219741
Energy: 0.6956781626436379
Energy: 0.7094447420591181
Energy: 0.7500310098406912
Energy: 0.7089278448096984
Energy: 0.6958202137466213
Energy: 0.7438989743796753
Energy: 0.7041552924381905
Energy: 0.7036014061631287
Energy: 0.7024078937475216
Energy: 0.7039875384966486
Energy: 0.7431130283002078
Energy: 0.7045857139359553
Energy: 0.6964770557214003
Energy: 0.7032472894998608
Energy: 0.7106676837458731
Energy: 0.7039876791791528
Energy: 0.7040884854448496
Energy: 0.7057565950843026
Energy: 0.7119396839416403
Energy: 0.745764253655
Energy: 0.7033250286908045
Energy: 0.7033366575314705
Energy: 0.7051482524111882
Energy: 0.7511964024910824
Energy: 0.7451237198699704
Energy: 0.7526327045200012
Energy: 0.6954621041882636
Energy: 0.6950514057133289
Energy: 0.7037233910921379
Energy: 0.7530249925160493
Energy: 0.7524712164430595
Energy: 0.6960095269421005
Energy: 0.6955478636305089
Energy: 0.703688454970577
Energy: 0.6962151776014586
Energy: 0.7042107721412573
Energy: 0.6971043181845286
Energy: 0.6957507117134027
Energy: 0.7077109869380614
Energy: 0.7093897196774587
Energy: 0.7035064744722768
Energy: 0.6968722526746773
Energy: 0.695266840206876
Energy: 0.7044845183669197
Energy: 0.7045980590417661
Energy: 0.7043554996739768
Energy: 0.7517255580578112
Energy: 0.7098232478358577
Energy: 0.7046032231796907
Energy: 0.6976279415858159
Energy: 0.7044042236278336
Energy: 0.750292532133048
Energy: 0.7090589657753841
Energy: 0.7062538633960861
Energy: 0.7008425820269959
Energy: 0.7546592168524562
Energy: 0.6933610214605599
Energy: 0.7066860009140737
Energy: 0.7047316290804071
Energy: 0.7049024650814256
Energy: 0.7111181948986914
Energy: 0.692160068397675
Energy: 0.7123563349597354
Energy: 0.7045717744307403
Energy: 0.7045948173640768
Energy: 0.7085072046883594
Energy: 0.7436850390813154
Energy: 0.7096149678197227
Energy: 0.696005634628298
Energy: 0.698079360219288
Energy: 0.7152214461425156
Energy: 0.743519067980511
Energy: 0.7086563296429559
Energy: 0.6971392631512243
Energy: 0.6961894900182932
Energy: 0.7045048817654536
Energy: 0.6961883528499809
Energy: 0.7029120186957118
Energy: 0.6950402131220744
Energy: 0.7437143923298865
Energy: 0.7043025446599096
Energy: 0.7029907539580424
Energy: 0.7022752153514583
Energy: 0.6948930281438452
Energy: 0.7482219473021962
Energy: 0.7066808711255295
Energy: 0.705974711713356
Energy: 0.7437523522278654
Energy: 0.7529110079128178
Energy: 0.7076274744913569
Energy: 0.7115342542201246
Energy: 0.7081542956062229
Energy: 0.7447373509154712
Energy: 0.7149918090397995
Energy: 0.7041909491257474
Energy: 0.695482427039734
Energy: 0.7113120188467552
Energy: 0.7059052681473652
Energy: 0.7111445687322027
Energy: 0.7468951619204452
Energy: 0.6955545940689595
Energy: 0.7124854302903044
Energy: 0.6919345080355288
Energy: 0.752341303305509
Energy: 0.7470066753210597
Energy: 0.6965442673453974
Energy: 0.7086490632615549
Energy: 0.7497686831789968
Energy: 0.7088630608475406
Energy: 0.6962751109686018
Energy: 0.6962561850830048
Energy: 0.7091233460499533
Energy: 0.7509834067993517
Energy: 0.7087218497721973
Energy: 0.6960438591072851
Energy: 0.7435431657694263
Energy: 0.7046124630444434
Energy: 0.7033363167147586
Energy: 0.7030242584359585
Energy: 0.7038424785393959
Energy: 0.7436761343228461
Energy: 0.7044549929988072
Energy: 0.696094057406009
Energy: 0.7035281375003998
Energy: 0.712132093748264
Energy: 0.7040009979718291
Energy: 0.7042297418920952
Energy: 0.7060198254112524
Energy: 0.750508719680493
Energy: 0.7454734015494419
Energy: 0.7032079239554183
Energy: 0.7045038663257573
Energy: 0.7050122343654386
Energy: 0.7503999800733636
Energy: 0.7450370388515736
Energy: 0.7531008431335235
Energy: 0.6955823130803237
Energy: 0.6951365464508623
Energy: 0.7037335239223015
Energy: 0.752988129759736
Energy: 0.752455270006772
Energy: 0.696004115310578
Energy: 0.6954309692462055
Energy: 0.7034415451894447
Energy: 0.7454082647171835
Energy: 0.7043931004513531
Energy: 0.6971074522569211
Energy: 0.6958286924112134
Energy: 0.7055519697372662
Energy: 0.709655866003145
Energy: 0.703448532766204
Energy: 0.695807513396655
Energy: 0.6953761748274164
Energy: 0.7050385277434255
Energy: 0.7045877413283239
Energy: 0.7042359329088017
Energy: 0.7517319132337998
Energy: 0.7097136537593441
Energy: 0.7041247076669693
Energy: 0.6967386956717416
Energy: 0.7044916720693962
Energy: 0.7508712210148867
Energy: 0.7089626298740718
Energy: 0.7047987264316842
Energy: 0.7009917567585883
Energy: 0.7524162159982895
Energy: 0.6933081244318389
Energy: 0.7088398373107239
Energy: 0.7048627096949992
Energy: 0.7058315101025878
Energy: 0.7539651733742417
Energy: 0.6920685694004964
Energy: 0.7125857402763102
Energy: 0.7044553496732521
Energy: 0.7048008765696087
Energy: 0.7161783340888853
Energy: 0.7429370803990432
Energy: 0.7130986107049493
Energy: 0.6957342321297668
Energy: 0.6975592080305396
Energy: 0.724752088145427
Energy: 0.7423187785527117
Energy: 0.7095289095952227
Energy: 0.6971319588334786
Energy: 0.6962069261713711
Energy: 0.7048114755170664
Energy: 0.6962009012635977
Energy: 0.7023056550307802
Energy: 0.6951765029598836
Energy: 0.7452938356551513
Energy: 0.7046092834316597
Energy: 0.7030806554186108
Energy: 0.7024791151909026
Energy: 0.695157644657936
Energy: 0.705573614295152
Energy: 0.7058227871283687
Energy: 0.705618470910773
Energy: 0.742632090469523
Energy: 0.7542351235008466
Energy: 0.7072681865016103
Energy: 0.7086487849137973
Energy: 0.7078777105502226
Energy: 0.744455736070018
Energy: 0.7161808010299002
Energy: 0.7045250199467403
Energy: 0.6953339083102712
Energy: 0.7111886736910208
Energy: 0.7058792854854399
Energy: 0.7095839377365913
Energy: 0.746021924720675
Energy: 0.6954366001600083
Energy: 0.7121993598377463
Energy: 0.6917364340990294
Energy: 0.710226256524033
Energy: 0.7462631063816584

minimum gb energy = 0.6917364340990294 eV
minimum distance =  2.67250741632641 Angstroms
sigma value = 15


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

Energy: 1.2478750585687872
Energy: 0.7406474274203597
Energy: 0.7409765507431278
Energy: 0.6948827514982644
Energy: 0.7058382267948016
Energy: 0.704118473034226
Energy: 0.7920717257197185
Energy: 0.7367983671996742
Energy: 0.7041160094723442
Energy: 0.7761574426423797
Energy: 0.6949075223636949
Energy: 0.752415856906526
Energy: 0.7324939274642175
Energy: 0.7320532663351776
Energy: 0.6959515462685826
Energy: 0.6877383570443795
Energy: 0.7607159538737183
Energy: 0.7324168329382156
Energy: 0.7673358077576251
Energy: 0.7270218603443876
Energy: 0.7754052989701657
Energy: 0.7140506195848897
Energy: 0.7669487116575389
Energy: 0.7331574896480011
Energy: 0.7010402249889559
Energy: 0.7754484788878628
Energy: 0.7159346479456437
Energy: 0.7166791215887864
Energy: 0.7280972605689296
Energy: 0.7946289813549673
Energy: 0.7292643673292846
Energy: 0.6987838535995465
Energy: 0.744262739971413
Energy: 0.7795554267169573
Energy: 0.797246344801519
Energy: 0.7377318635912672
Energy: 0.6925485474572749
Energy: 0.7441864779490841
Energy: 0.7952649475888814
Energy: 0.7954151210438551
Energy: 0.7970150737309522
Energy: 0.7153747378452957
Energy: 0.6913725118548854
Energy: 0.6946695279876336
Energy: 0.6831200677840854
Energy: 0.7719599074933767
Energy: 0.753349861076879
Energy: 0.7149686299893026
Energy: 0.694800406755673
Energy: 0.6815900356018029
Energy: 0.6817463096417603
Energy: 0.694128916365284
Energy: 0.6944549341425992
Energy: 0.7715136904202131
Energy: 0.8405144810347893
Energy: 0.697193323665345
Energy: 0.6939487929367602
Energy: 0.6947361246161029
Energy: 0.8074731847936122
Energy: 0.8403938145413256
Energy: 0.6952466640574163
Energy: 0.6948093684212803
Energy: 0.6949476564324546
Energy: 0.6986897581774382
Energy: 0.7446238430892687
Energy: 0.6976333069553433
Energy: 0.694222081265046
Energy: 0.6946105509514663
Energy: 0.7061528923746473
Energy: 0.7777271644000154
Energy: 0.6964136356137471
Energy: 0.698505903010222
Energy: 0.6997527292860131
Energy: 0.6922799482649421
Energy: 0.7468782166762808
Energy: 0.6955120836799786
Energy: 0.6946880541429825
Energy: 0.7558551396225616
Energy: 0.7461930819185566
Energy: 0.7328567074872641
Energy: 0.6959783879388519
Energy: 0.838915433997052
Energy: 0.7535225127148608
Energy: 0.7415117366378187
Energy: 0.701786489101451
Energy: 0.6960067335496619
Energy: 0.842888609122625
Energy: 0.732118083723359
Energy: 0.7917815324828451
Energy: 0.698266192744594
Energy: 0.746815368298594
Energy: 0.7047965632541676
Energy: 0.6983774704876886
Energy: 0.7100212842147389
Energy: 0.71064609849429
Energy: 0.7113903722322636
Energy: 0.7054173869046224
Energy: 0.697583878397994
Energy: 0.7111950319115623
Energy: 0.7115272813550356
Energy: 0.741619732499209
Energy: 0.708173605428609
Energy: 0.7076115488203091
Energy: 0.7095165706648118
Energy: 0.6960141942023785
Energy: 0.7390271330731697
Energy: 0.7010655329505263
Energy: 0.7078342243570087
Energy: 0.7099325734210552
Energy: 0.696641515334221
Energy: 0.8304922739697289
Energy: 0.7485443468134646
Energy: 0.7111805415354917
Energy: 0.6838651071503935
Energy: 0.8013949745253185
Energy: 0.8153219671390226
Energy: 0.7495193077681129
Energy: 0.6842520063449212
Energy: 0.6844194758360868
Energy: 0.7509355148002066
Energy: 0.7562742110759024
Energy: 0.727779304351978
Energy: 0.7199457360655713
Energy: 0.6983679847078815
Energy: 0.7463679419105058
Energy: 0.7706827691371373
Energy: 0.7218136667088
Energy: 0.7122982699562932
Energy: 0.6993412680668369
Energy: 0.7735271016841675
Energy: 0.7375819667596526
Energy: 0.7403263701287786
Energy: 0.7797125174070656
Energy: 0.7228482584601551
Energy: 0.7338698586830528
Energy: 0.7358726420974552
Energy: 0.7405929639165427
Energy: 0.6776607699616802
Energy: 0.7496633850915612
Energy: 0.7334670059139332
Energy: 0.6983855102782182
Energy: 0.7190998428177289
Energy: 0.8051012520110525
Energy: 0.7182108317110563
Energy: 0.7178694926969157
Energy: 0.6988831906230271
Energy: 0.7339070460162682
Energy: 0.8050592064516189
Energy: 0.7181416476990561
Energy: 0.7309628264783121
Energy: 0.7271702278066835
Energy: 0.8060609827087925
Energy: 0.6855659043852278
Energy: 0.7184934004028276
Energy: 0.7032532137322146
Energy: 0.7853148606019783
Energy: 0.8060764113758768
Energy: 0.6853494721192133
Energy: 0.7203005393700603
Energy: 0.6966540402301242
Energy: 0.6834018572020696
Energy: 0.7478195576613079
Energy: 0.8513871852614617
Energy: 0.7851709034799671
Energy: 0.7584539111096292
Energy: 0.6841084109013092
Energy: 0.7482115498216716
Energy: 0.8569921420705264
Energy: 0.7925404877012439
Energy: 0.7587004235216585
Energy: 0.7336201440020188
Energy: 0.8278932255500316
Energy: 0.8291443805511557
Energy: 0.7353493437845848
Energy: 0.6986530800057815
Energy: 0.7361483222739746
Energy: 0.8278673286278109
Energy: 0.8287095268900455
Energy: 0.7021330407364617
Energy: 0.6975023362925846
Energy: 0.6994061482739347
Energy: 0.7054308206157275
Energy: 0.7055862495353514
Energy: 0.7017634819956593
Energy: 0.7002877344142452
Energy: 0.7003527828518431
Energy: 0.6948497394502355
Energy: 0.701208393155741
Energy: 0.7021611492890383
Energy: 0.7027353956656822
Energy: 0.7123495989428373
Energy: 0.7565516895406525
Energy: 0.7325961482351515
Energy: 0.6969183761242067
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Energy: 0.6868196484905011
Energy: 0.710395961896029
Energy: 0.7405589362894499
Energy: 0.7047199031705496
Energy: 0.7026531121809393
Energy: 0.7101062735678638
Energy: 0.684569382354799
Energy: 0.7399752458651071
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Energy: 0.7030882898182739
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Energy: 0.8301042883479925
Energy: 0.7426937980607508
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Energy: 0.7316621633588802
Energy: 0.8186414769022585
Energy: 0.739147577475522
Energy: 0.6839171371973355
Energy: 0.6836698068342362
Energy: 0.7254728896021251
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Energy: 0.6980841344544373
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Energy: 0.7500012900043622
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Energy: 0.6992112546361382
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Energy: 0.7542230003583268
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Energy: 0.7084689451132
Energy: 0.7225046915668955
Energy: 0.7226082102290856
Energy: 0.7293151466272801
Energy: 0.806072548192968
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Energy: 0.7099649435046437
Energy: 0.7302797541267696
Energy: 0.8059425244628408
Energy: 0.7254196298475134
Energy: 0.7439670350213807
Energy: 0.7860155679520423
Energy: 0.8056678820299896
Energy: 0.8079038516735243
Energy: 0.8047318108708493
Energy: 0.7123822150159161
Energy: 0.7856683168794498
Energy: 0.8060112622967817
Energy: 0.813167622954185
Energy: 0.8051449810444947
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Energy: 0.6838427758905148
Energy: 0.7787615269119569
Energy: 0.7257147218648781
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Energy: 0.7590321855660195
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Energy: 0.7608458525572994
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Energy: 0.826847560491352
Energy: 0.7670658515224229
Energy: 0.6950717604141045
Energy: 0.7355472633226715
Energy: 0.8422708951045073
Energy: 0.8261730205881074
Energy: 0.7347798233527815
Energy: 0.6944592448017497
Energy: 0.6964227727004796
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Energy: 0.6979194785608819
Energy: 0.6975825519253027
Energy: 0.6976590742133592
Energy: 0.8042768646261895
Energy: 0.6970642903566006
Energy: 0.6980316819937522
Energy: 0.6998600340432283
Energy: 0.6995160579181257
Energy: 0.7557802378012035
Energy: 0.7257699313553572
Energy: 0.694220813882691
Energy: 0.6946938983761223
Energy: 0.7380220825288698
Energy: 0.755663122783818
Energy: 0.7192057448032911
Energy: 0.6941047504636871
Energy: 0.6948974851408448
Energy: 0.7314462912481041
Energy: 0.6928043983416008
Energy: 0.7012244380213449
Energy: 0.732103449262895
Energy: 0.7451644242781512
Energy: 0.7202319754049181
Energy: 0.6923004728655103
Energy: 0.7008883945590434
Energy: 0.7572595176585315
Energy: 0.7369509600278289
Energy: 0.6951407657925465
Energy: 0.6947434774578883
Energy: 0.7301527087930817
Energy: 0.8415878731547393
Energy: 0.6960845242725876
Energy: 0.6876447665037843
Energy: 0.698968884809543
Energy: 0.7343196609717291
Energy: 0.8394669985398678
Energy: 0.69641836775103
Energy: 0.6979410508070983
Energy: 0.6957098617056373
Energy: 0.6972470650035608
Energy: 0.6951916017457418
Energy: 0.6901598965395783
Energy: 0.7016223123410884
Energy: 0.7001041502351801
Energy: 0.702953629039003
Energy: 0.7190576602669896
Energy: 0.698948651152189
Energy: 0.6950663470288306
Energy: 0.6906834590010971
Energy: 0.8177723953667345
Energy: 0.8151512517941235
Energy: 0.714772800477116
Energy: 0.688539773129917
Energy: 0.7250947696631214
Energy: 0.8185414312496433
Energy: 0.7675386034109328
Energy: 0.7181112961440732
Energy: 0.7079250114383707
Energy: 0.7577677216796851
Energy: 0.7670790622639037
Energy: 0.6950772944743161
Energy: 0.6801732256971297
Energy: 0.6974281868424917
Energy: 0.7583961447383984
Energy: 0.8074158738047079
Energy: 0.6987570620111269
Energy: 0.6838649403016913

minimum gb energy = 0.6776607699616802 eV
minimum distance =  2.62112383711787 Angstroms
sigma value = 437


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

Energy: 0.9691957030542793
Energy: 0.6787411369183417
Energy: 0.7224686639368469
Energy: 0.6906908397679791
Energy: 0.6530654208721333
Energy: 0.6933144354822209
Energy: 0.6802669953879708
Energy: 0.7216794302863022
Energy: 0.6467459616172765
Energy: 0.6629076306632732
Energy: 0.6413122308563487
Energy: 0.7337519742727521
Energy: 0.6422894993438388
Energy: 0.7748021375793694
Energy: 0.6594143418056436
Energy: 0.6406440546457445
Energy: 0.6890818916729364
Energy: 0.6425177550626131
Energy: 0.7332236367135464
Energy: 0.6586155229806999
Energy: 0.7109473939708331
Energy: 0.7191167488553681
Energy: 0.7320804329372923
Energy: 0.6605321920906937
Energy: 0.644053935217041
Energy: 0.7112224312158134
Energy: 0.7200432526076848
Energy: 0.7324725542779448
Energy: 0.6596486285582877
Energy: 0.711583579760544
Energy: 0.6591554493451683
Energy: 0.6616584461845105
Energy: 0.72929968028517
Energy: 0.7092059233179931
Energy: 0.7113627826501131
Energy: 0.6598211144815195
Energy: 0.6595343370820582
Energy: 0.7296365161272335
Energy: 0.709042284210406
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Energy: 0.6509912789003524
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Energy: 0.6576744537101822
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Energy: 0.6556796705626133
Energy: 0.7353259845511237
Energy: 0.6582451715563373
Energy: 0.6578544620492031
Energy: 0.6379584633220653
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Energy: 0.6599331678953524
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Energy: 0.6743552068057671
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Energy: 0.6584610830320176
Energy: 0.689543812303583
Energy: 0.7130952775494414
Energy: 0.7068999640167711
Energy: 0.7084929024782812
Energy: 0.6602577041315238
Energy: 0.6671552561545627
Energy: 0.7109050313028147
Energy: 0.7071237230425287
Energy: 0.7077109209445829
Energy: 0.6602108372422885
Energy: 0.6678801284099776
Energy: 0.7186257505735734
Energy: 0.7076306591363178
Energy: 0.6592480035205271
Energy: 0.6572926176354039
Energy: 0.7334889546635394
Energy: 0.7187296348195572
Energy: 0.7077928101665171
Energy: 0.6594052158081414
Energy: 0.6575369767531507
Energy: 0.7336773397195258
Energy: 0.6582758598827602
Energy: 0.7289589378674788
Energy: 0.6780414980761251
Energy: 0.7329044759577611
Energy: 0.6591675035292284
Energy: 0.6574732022302276
Energy: 0.7289223629642659
Energy: 0.678397385315466
Energy: 0.6666614941520379
Energy: 0.6583377470412507
Energy: 0.6416013161810017
Energy: 0.6575240503958772
Energy: 0.6426092876154165
Energy: 0.6408218797766667
Energy: 0.6812144220160998
Energy: 0.7107740061957968
Energy: 0.6611983308599325
Energy: 0.6430825241032951
Energy: 0.6411164151755345
Energy: 0.680087972670412
Energy: 0.6415311677083821
Energy: 0.6398359107839788
Energy: 0.6444073580134313
Energy: 0.6893039016216623
Energy: 0.6389507894308925
Energy: 0.6412311503274348
Energy: 0.639632689096015
Energy: 0.678197675458214
Energy: 0.6893664480185773
Energy: 0.6619042543685153
Energy: 0.6407622805842925
Energy: 0.6423118767317889
Energy: 0.6426501583319603
Energy: 0.7154692086874417
Energy: 0.6416074914249572
Energy: 0.6413864258735351
Energy: 0.6434384367427123
Energy: 0.6428007520327226
Energy: 0.7410405653916857
Energy: 0.6408137560354676
Energy: 0.6409899741342111
Energy: 0.6417847540047377
Energy: 0.6719689070937697
Energy: 0.7311136091525441
Energy: 0.6408115027957202
Energy: 0.6412013983486237
Energy: 0.642287772887945
Energy: 0.6715437340757995
Energy: 0.7306528815885742
Energy: 0.6407829076590611
Energy: 0.6396427526871705
Energy: 0.6455125051495473
Energy: 0.7637615090354045
Energy: 0.6453619697105241
Energy: 0.6425323550488766
Energy: 0.6729904486063047
Energy: 0.6429816411498357
Energy: 0.7988572265574383
Energy: 0.6451558808618292
Energy: 0.6727875252818885

minimum gb energy = 0.6379584633220653 eV
minimum distance =  2.69233599597015 Angstroms
sigma value = 33