Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_Al__MO_315820974149_001
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.36025423720221
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[3.48204252220488e-19, 3.913508689741079e-19, 4.1544760554946797e-19, 4.3201411194502795e-19, 4.44839535900198e-19, 4.555420758153179e-19, 4.64905196064414e-19, 4.733390538657899e-19, 4.81072760478108e-19, 4.8823128567882e-19, 4.94885125239822e-19, 5.010679248704279e-19, 5.06798910690246e-19, 5.120796848759099e-19, 5.1691024742742e-19, 5.212809852849719e-19, 5.25180683212128e-19, 5.28599728149084e-19, 5.31525302682768e-19, 5.33946191576742e-19, 5.358479752413e-19, 5.37219438440004e-19, 5.3805096811305e-19, 5.383297468473659e-19, 5.38022128933638e-19, 5.37020768537388e-19, 5.351942871746279e-19, 5.32384069358592e-19, 5.28396251716566e-19, 5.2299851863662e-19, 5.15905682677902e-19, 5.06762060627664e-19, 4.9513666697136e-19, 4.80483159476796e-19, 4.62119010897888e-19, 4.3918225020554395e-19, 4.1056417116903593e-19, 3.74838836584104e-19, 3.3013971067213794e-19, 2.74001043593412e-19, 2.0311594277534998e-19, 1.1298084991744139e-19, -2.6342667780901197e-21, -1.525244918565222e-19, -3.49389862929648e-19, -6.12090754723458e-19, -9.6954917918193e-19, -1.4673871159582137e-18, -2.17974528879066e-18, -3.23069305186296e-18, -4.83330227355414e-18, -7.35812436577572e-18, -1.1429431432199458e-17, -1.7908329326535e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.011682357036137262
Energy: 0.013437497083321561
Energy: 0.0760762381263701
Energy: 0.07601755551384366
Energy: 0.013138974862321323
Energy: 0.01303042918658533
Energy: 0.07644243315354082
Energy: 0.0762694844819018
Energy: 0.07695301673515247
Energy: 0.013051574612624127
Energy: 0.014031307201807184
Energy: 0.07688804982681365
Energy: 0.07696501260683926
Energy: 0.0763809698258999
Energy: 0.07738150512615016
Energy: 0.07660758778342688
Energy: 0.07671882248332552
Energy: 0.0770226845053713
Energy: 0.07651553015917625
Energy: 0.07716430975368396
Energy: 0.077843851119994
Energy: 0.012955979578542826
Energy: 0.012453566848693485
Energy: 0.07609618245281202
Energy: 0.07608345754303482
Energy: 0.07749081396265439
Energy: 0.012724379421691974
Energy: 0.0121802206729264
Energy: 0.07616426762712178
Energy: 0.07618745580408663
Energy: 0.07698221045365582
Energy: 0.012666079074479294
Energy: 0.01248968867850317
Energy: 0.07640847702879458
Energy: 0.07630828038921102
Energy: 0.07642295301118156
Energy: 0.012834692667293849
Energy: 0.012322667410043368
Energy: 0.36570267121207134
Energy: 0.07580287058162515
Energy: 0.07639654131090748
Energy: 0.07678978718822108
Energy: 0.07806462820233015
Energy: 0.012789867451586305
Energy: 0.01236335212036802
Energy: 0.07593724600541206
Energy: 0.07730822942614413
Energy: 0.07772727502927389
Energy: 0.012720044537395052
Energy: 0.0758257733851443
Energy: 0.07798744346735549
Energy: 0.07578553457619101
Energy: 0.07667004767616624
Energy: 0.012564403779468634
Energy: 0.013175235915598495
Energy: 0.07619370268951699
Energy: 0.07530558809358602
Energy: 0.07696503589478752
Energy: 0.012903151534251209
Energy: 0.01356800031726121
Energy: 0.013738308828008102
Energy: 0.07778399739327817
Energy: 0.07595679394873933
Energy: 0.07784616080623136
Energy: 0.07654179303071354
Energy: 0.013737769025446654
Energy: 0.0781593145887391
Energy: 0.07605535369684609
Energy: 0.07863232608299651
Energy: 0.07795863255524149

minimum gb energy = 0.011682357036137262 eV
minimum distance =  2.82878635213491 Angstroms
sigma value = 3


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

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Energy: 0.7168809500067951
Energy: 0.7106182255067395
Energy: 0.7057065030348142
Energy: 0.7385080582856708
Energy: 0.7822213727413179
Energy: 0.7381006599462506
Energy: 0.7016654721074325
Energy: 0.7471635134468223
Energy: 0.7048296633185355
Energy: 0.6006896632592807
Energy: 0.8436316280600886
Energy: 0.7114142757102618
Energy: 0.7114103374616839
Energy: 0.5524679610205784
Energy: 0.555484520825792
Energy: 0.7308062334604125
Energy: 0.7086635751345556
Energy: 0.7104426789757802
Energy: 0.6673387038298696
Energy: 0.6581952766371615
Energy: 0.7596967685667533
Energy: 0.5847872144188379
Energy: 0.692772708266786
Energy: 0.6444287826532137
Energy: 0.5549555300864131
Energy: 0.8090048740064264
Energy: 0.5811438804331953
Energy: 0.6441610024720652
Energy: 0.6638546759602005
Energy: 0.6721498469922893
Energy: 0.7538725158358796
Energy: 0.6544336577229791
Energy: 0.6399153982135983
Energy: 0.6477197100990627
Energy: 0.6099723845267819
Energy: 0.734351671939048
Energy: 0.7005316684800937
Energy: 0.6641423436889461
Energy: 0.6717659242714562
Energy: 0.7873209747861681
Energy: 0.767117303793058
Energy: 0.8062578249360418
Energy: 0.632845707497583
Energy: 0.6489594661695082
Energy: 0.8003110500032189
Energy: 0.7078947930140341
Energy: 0.792496959544861
Energy: 0.6440426148857715
Energy: 0.6266637906039739
Energy: 0.7925150802871552
Energy: 0.8757896144291316
Energy: 0.6187376745401991
Energy: 0.6523955149269554
Energy: 0.8690506477391814
Energy: 0.7640883915639126
Energy: 0.7085414628956855
Energy: 0.6284280642783034
Energy: 0.6238134358787131
Energy: 0.866428175231395
Energy: 0.7426283195238227
Energy: 0.7626295427619023
Energy: 0.7895729078842156
Energy: 0.6803918353729689
Energy: 0.7931903278529049
Energy: 0.739987022015476
Energy: 0.7785101572358573
Energy: 0.5999253482355356
Energy: 0.6743470225993713
Energy: 0.788569660462572
Energy: 0.7098712427494034
Energy: 0.7306067874128213
Energy: 0.7258568726774025
Energy: 0.6430016984408728
Energy: 0.758903056147071
Energy: 0.7108212246234286
Energy: 0.768318987259845
Energy: 0.8094079138357033
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Energy: 0.7450739110988223
Energy: 0.7188618210286275
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Energy: 0.598135004845157
Energy: 0.6893326478809533
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Energy: 0.6550053760120789
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Energy: 0.7809312942037886
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Energy: 0.8243704264784908
Energy: 0.6290265646391805
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Energy: 0.7422427207200027
Energy: 0.7641672589215105
Energy: 0.8030769075863691
Energy: 0.8186701738678034
Energy: 0.7302320254214374
Energy: 0.7119607245812054
Energy: 0.7143372273036939
Energy: 0.7601754820968807
Energy: 0.7819391783954821
Energy: 0.7549169949936585
Energy: 0.7164987221760453
Energy: 0.7065938139092195
Energy: 0.7106395454737509
Energy: 0.5879775238963704
Energy: 0.8312028987433954
Energy: 0.7144297947321273
Energy: 0.7218513101679467
Energy: 0.5578109764814257
Energy: 0.5568386178976459
Energy: 0.7511859403242853
Energy: 0.7138519706412113
Energy: 0.7196590231658851
Energy: 0.6344964111453405
Energy: 0.6290488529319184
Energy: 0.8599853468468049
Energy: 0.5790130450285734
Energy: 0.6732824510192819
Energy: 0.639710267046214
Energy: 0.5557138281565107
Energy: 0.9231869809528771
Energy: 0.579688193570356
Energy: 0.664757310399678
Energy: 0.6567869693416464
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Energy: 0.6760676951189584
Energy: 0.6702937097115629
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Energy: 0.7634569814779946
Energy: 0.7777268056104103
Energy: 0.7997332070963844
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Energy: 0.5584836650162317
Energy: 0.8231280891029397
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Energy: 0.7852232586317774
Energy: 0.6275638446474527
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Energy: 0.7867722978718338
Energy: 0.7077532360006438
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Energy: 0.6393862212617569
Energy: 0.8604484727175746
Energy: 0.8069423747333253
Energy: 0.7090770866595141
Energy: 0.7849514757436432
Energy: 0.6944145584431807
Energy: 0.7998800735514864
Energy: 0.7428846425093407
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Energy: 0.7581359688029723
Energy: 0.6748924258355833
Energy: 0.7906848777528134
Energy: 0.7386992222212716
Energy: 0.7821719908681297
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Energy: 0.6768752186847222
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Energy: 0.7044642057479641
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Energy: 0.7467310588180125
Energy: 0.5823107620123662
Energy: 0.7413150407405977
Energy: 0.6999365468547417
Energy: 0.7596824651045035
Energy: 0.8660494249591024
Energy: 0.6597422128565796
Energy: 0.7439246260288847
Energy: 0.7185998104614005
Energy: 0.651290052792213
Energy: 0.5905351312144791
Energy: 0.9165363866489995
Energy: 0.7299740546649154
Energy: 0.7171307779565412
Energy: 0.5946247853082981
Energy: 0.695082728736686
Energy: 0.9144513211338718
Energy: 0.7115775089277944
Energy: 0.6282062047175978
Energy: 0.6638538940399188
Energy: 0.5985196168032809
Energy: 0.6701895978509694
Energy: 0.5824870866393768
Energy: 0.6861016954850069
Energy: 0.6709324590290492
Energy: 0.605446613316098
Energy: 0.6553482129053981
Energy: 0.5815453484263622
Energy: 0.6720184658085558
Energy: 0.6028820392557162
Energy: 0.6745893120655335
Energy: 0.6413110488931681
Energy: 0.5797141906992226
Energy: 0.6562856294856418
Energy: 0.6032477488336213
Energy: 0.6795800984493461
Energy: 0.6654433948098438
Energy: 0.5849145588152134
Energy: 0.8302722136248251
Energy: 0.667379034338659
Energy: 0.5936906501484484
Energy: 0.8099942566780357
Energy: 0.7457635080438714
Energy: 0.8180878979733904
Energy: 0.625297267330183
Energy: 0.6167359649281818
Energy: 0.8151334311466224
Energy: 0.7696342050143631
Energy: 0.7751110315207979
Energy: 0.6921145301087344
Energy: 0.8079383777053214
Energy: 0.707362869882521
Energy: 0.8134128953934744
Energy: 0.6839404491072234
Energy: 0.8738608999187061
Energy: 0.7274555946193311
Energy: 0.7071970227365073
Energy: 0.8324510186090853
Energy: 0.7412830432019656
Energy: 0.6705178859559202
Energy: 0.7376662916619423
Energy: 0.7399412346057501
Energy: 0.82182362181415
Energy: 0.6266020304915881
Energy: 0.5597474947870096
Energy: 0.7391881764628705
Energy: 0.7411931644491357
Energy: 0.8330261345465687
Energy: 0.7094094549304047
Energy: 0.711589380623833
Energy: 0.6999240873157412
Energy: 0.7007900012494193
Energy: 0.7527945304307395
Energy: 0.7667268504211721
Energy: 0.7851629103316009
Energy: 0.6955345914789123
Energy: 0.7047826372459155
Energy: 0.7209192478215247

minimum gb energy = 0.5524679610205784 eV
minimum distance =  2.52960909071813 Angstroms
sigma value = 75


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

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Energy: 0.6092193676046063
Energy: 0.6392312428135437
Energy: 0.6706505682888247
Energy: 0.6253178581157067
Energy: 0.5779937177141433
Energy: 0.6271628846887006
Energy: 0.6455393253340649
Energy: 0.661196755689259
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Energy: 0.6348510249789124
Energy: 0.6546035750208385
Energy: 0.5729050745412038
Energy: 0.5934136316738239
Energy: 0.6132623295860128
Energy: 0.6426923377951322
Energy: 0.6720278720432246
Energy: 0.6618576653348803
Energy: 0.7016714540184557
Energy: 0.6821371540542573
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Energy: 0.688103742999177
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Energy: 0.5972280220629681
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Energy: 0.6118580421006029
Energy: 0.7031536462606892
Energy: 0.6153614414726348
Energy: 0.6403861774194705
Energy: 0.6750117185247824
Energy: 0.6476020325552024
Energy: 0.6361513741706669
Energy: 0.6275357355220256
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Energy: 0.6352235239912747
Energy: 0.6338490907576444
Energy: 0.6962417800755532
Energy: 0.6172839934229513
Energy: 0.6432976441523242
Energy: 0.5993210199806487
Energy: 0.6323508865770311
Energy: 0.6510146775652988
Energy: 0.5652051722880724
Energy: 0.6532601999969008
Energy: 0.5933795800480277
Energy: 0.6281087138397696
Energy: 0.6667097765205448
Energy: 0.6570921141019602
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Energy: 0.6634804744905988
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Energy: 0.7000552186198341
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Energy: 0.647716057363304
Energy: 0.6611919083042144
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Energy: 0.6500538834447508
Energy: 0.6669658873778419
Energy: 0.8340272333025411
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Energy: 0.62109645526294
Energy: 0.639853962905625
Energy: 0.6368439476068235
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Energy: 0.601796209806551
Energy: 0.6467016678572555
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minimum gb energy = 0.5652051722880724 eV
minimum distance =  2.47543243825174 Angstroms
sigma value = 105


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

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Energy: 0.6967675305294775
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Energy: 0.7088186422785795
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Energy: 0.7645296747799614
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Energy: 0.7347603700479974
Energy: 0.683046070500177
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Energy: 0.7541826133315703
Energy: 0.7296866716877181
Energy: 0.6743852600610655
Energy: 0.7293224158786084
Energy: 0.7059055072035167
Energy: 0.6894377123369636
Energy: 0.7207992470391662
Energy: 0.6806247169396769
Energy: 0.6970596954824188
Energy: 0.7087049190829117
Energy: 0.6865331556200934
Energy: 0.7051855147992949
Energy: 0.7291409759347092
Energy: 0.6911908268229647
Energy: 0.6741737301726576
Energy: 0.6774294400144166
Energy: 0.6946124221729335
Energy: 0.7289252058664684
Energy: 0.6890425328007084
Energy: 0.674353641573191
Energy: 0.6775597975913451
Energy: 0.694879453994577
Energy: 0.7327630845521849
Energy: 0.6442733015461917
Energy: 0.6816740272106083
Energy: 0.7281742470651529
Energy: 0.7093576140068816
Energy: 0.7494025009457983
Energy: 0.6467122379892318
Energy: 0.6799887689843375
Energy: 0.7736016273911973
Energy: 0.7248229216655896
Energy: 0.6921368471292754
Energy: 0.7490057957034598
Energy: 0.778645400428739
Energy: 0.7607096738166401
Energy: 0.6733151899191654
Energy: 0.6261138035295298
Energy: 0.7415286095762007
Energy: 0.807689864183871
Energy: 0.7576717730142811
Energy: 0.666666182553327
Energy: 0.6774119598895977
Energy: 0.7129211871400939
Energy: 0.6351431200084523
Energy: 0.6281022590263052
Energy: 0.8442365643603931
Energy: 0.6984163928296602
Energy: 0.6254801363457879
Energy: 0.6349165098790761
Energy: 0.6637943228122267
Energy: 0.7981528193230927
Energy: 0.7043183261341812
Energy: 0.6291576849081036
Energy: 0.632544801521661
Energy: 0.6169858966434477
Energy: 0.6253335222382649
Energy: 0.668237158678581
Energy: 0.6226575425894714
Energy: 0.6418818989135717
Energy: 0.616395504992857
Energy: 0.8151950186852749

minimum gb energy = 0.5966863015496484 eV
minimum distance =  2.48553352046252 Angstroms
sigma value = 165


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

Energy: 0.8488952765416964
Energy: 0.6808544051422496
Energy: 0.7004361466107955
Energy: 0.652715985308654
Energy: 0.6808202423774111
Energy: 0.8492226659326225
Energy: 0.6507879887638311
Energy: 0.6981522298093301
Energy: 0.6502005987166508
Energy: 0.6832407172218578
Energy: 0.8540054886144449
Energy: 0.7245064516359515
Energy: 0.6480253776427356
Energy: 0.6580735290658071
Energy: 0.6677373399771014
Energy: 0.8014515966973104
Energy: 0.7248949666134845
Energy: 0.6445502589785266
Energy: 0.659309259444227
Energy: 0.6698732067316797
Energy: 0.6892714220297116
Energy: 0.806808559214449
Energy: 0.7142648684238097
Energy: 0.7503768341016831
Energy: 0.7911499424062725
Energy: 0.6862097198577302
Energy: 0.821436949489018
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Energy: 0.7875443519342628
Energy: 0.7852195652420114
Energy: 0.6576790948527385
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Energy: 0.8153621525475782
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Energy: 0.6281868695315335
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Energy: 0.6584769569929372
Energy: 0.7834276172603433
Energy: 0.7218403708625609
Energy: 0.7082685705838273
Energy: 0.6578083373277135
Energy: 0.7368458857705503
Energy: 0.7417300816198824
Energy: 0.6630714354132944
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Energy: 0.6851648357873689
Energy: 0.6580152517206808
Energy: 0.760818549917142
Energy: 0.6615025871836928
Energy: 0.6578089471302451
Energy: 0.6859381834745828
Energy: 0.6578583288484986
Energy: 0.747260780488221
Energy: 0.6842558757651643
Energy: 0.6570623023250184
Energy: 0.8113478387067726
Energy: 0.7986894653079387
Energy: 0.7212078854075641
Energy: 0.6845130450973523
Energy: 0.6569299415375691
Energy: 0.8108674510006253
Energy: 0.7988883813919864
Energy: 0.8221250139950359
Energy: 0.7603086625229867
Energy: 0.6685118524681886
Energy: 0.6568266348914676
Energy: 0.7007202297209153
Energy: 0.8222284850483423
Energy: 0.6506478828695067
Energy: 0.6672558979912488
Energy: 0.6561960112769109
Energy: 0.6991004541731359
Energy: 0.8838532799907957
Energy: 0.8087603313866915
Energy: 0.6569402755504592
Energy: 0.6529635541201151
Energy: 0.6261364714253529
Energy: 0.8286705482207306
Energy: 0.7013962355233921
Energy: 0.6563506487658054
Energy: 0.6531860543111458
Energy: 0.6450743498115116
Energy: 0.6687293869048501
Energy: 0.7577909341368236
Energy: 0.7045727004656746
Energy: 0.6156546254934325
Energy: 0.6574828524457037
Energy: 0.6680976289321341
Energy: 0.7989066909954583
Energy: 0.7041016435199722
Energy: 0.6143608307536242
Energy: 0.6582326186088024
Energy: 0.8780801028878762
Energy: 0.6666124809004342
Energy: 0.7153917429949039
Energy: 0.625961723108618
Energy: 0.6602112685396172
Energy: 0.6798331841867487
Energy: 0.6857413657478764
Energy: 0.7134467088799709
Energy: 0.6266412138331114
Energy: 0.6598222440294788

minimum gb energy = 0.6143608307536242 eV
minimum distance =  2.52228991050525 Angstroms
sigma value = 41


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

Energy: 1.1141194000805146
Energy: 0.6505369557988456
Energy: 0.6377088023732507
Energy: 0.6121245437096297
Energy: 0.6191975595141994
Energy: 0.783469995533118
Energy: 0.6141571968452751
Energy: 0.636440530370346
Energy: 0.6118886833393516
Energy: 0.7329913386554587
Energy: 0.8365426731030894
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Energy: 0.6096507449451228
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Energy: 0.7525935431013081
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Energy: 0.6749282201541508
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Energy: 0.6886648686953772
Energy: 0.7303895030605517
Energy: 0.6854209970737015
Energy: 0.6679420960061543
Energy: 0.7136669843246634
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Energy: 0.7296959419344878
Energy: 0.7378770686526267
Energy: 0.7320584919393146
Energy: 0.6508651611460822
Energy: 0.6706035574115989
Energy: 0.6118706242209234
Energy: 0.7424682647357989
Energy: 0.7189394359752517
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Energy: 0.7005445491634836
Energy: 0.8009754202240496
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Energy: 0.7022980372927106
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Energy: 0.6141550843192671
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Energy: 0.6516796195308795
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Energy: 0.6487809714493499
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Energy: 0.7359393572325958
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Energy: 0.6125159651049726
Energy: 0.6404056223519032
Energy: 0.7470764420496923
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Energy: 0.6102408619902268
Energy: 0.6139009984593441
Energy: 0.6396815276891132
Energy: 0.7571490939266503
Energy: 0.717901393406871
Energy: 0.6705287515947502
Energy: 0.7002878501399731
Energy: 0.7284895132292688
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Energy: 0.6914504907385582
Energy: 0.809217602761372
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Energy: 0.7299795329517348
Energy: 0.6825775800374835
Energy: 0.706066992485361
Energy: 0.6455756028001107
Energy: 0.6496664597867595
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Energy: 0.7536232066613195
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Energy: 0.707554073269171
Energy: 0.7426882388160166
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Energy: 0.7290119742602109
Energy: 0.769663870306367
Energy: 0.6914738025077678
Energy: 0.6785101231551606
Energy: 0.6797875092709487
Energy: 0.7290951200353364
Energy: 0.6841668306446328
Energy: 0.67334768577888
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Energy: 0.6412374892497895
Energy: 0.7357544134970603
Energy: 0.6974511433937925
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Energy: 0.6492412261832946
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Energy: 0.6655506318759085
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Energy: 0.7252684511782875
Energy: 0.8169509343603047
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Energy: 0.8390964812919867
Energy: 0.6392022281425809
Energy: 0.6118090524004245
Energy: 0.6538027141703624
Energy: 0.6714927588783
Energy: 0.8035622670484517
Energy: 0.6137657254968708
Energy: 0.6496039860323843
Energy: 0.6176930474025931
Energy: 0.6704067875657216
Energy: 0.7021913517120595
Energy: 0.6135376145007301
Energy: 0.6532694508755811
Energy: 0.6177678186755471
Energy: 0.6399057323055507
Energy: 0.7053007357406484
Energy: 0.6646562270960641
Energy: 0.6166258865006172
Energy: 0.6918361186006297
Energy: 0.7570492367311871
Energy: 0.6931574747770642
Energy: 0.6165717861720243
Energy: 0.653324208229451
Energy: 0.6151928006108837
Energy: 0.7672046157977642
Energy: 0.6103993187127401
Energy: 0.655063332613386
Energy: 0.6570986896366571
Energy: 0.7227726533011329
Energy: 0.7357193664247369
Energy: 0.6110078935681139
Energy: 0.6546180091810013
Energy: 0.6521875425950158
Energy: 0.6959226886453779

minimum gb energy = 0.6096507449451228 eV
minimum distance =  2.56084103710472 Angstroms
sigma value = 185


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

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Energy: 0.4864049112215547
Energy: 0.6460272694138975
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Energy: 0.38761461529657293
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Energy: 1.3085073268782312
Energy: 0.595763140620267
Energy: 0.40447321561157346
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Energy: 0.5457530050482993
Energy: 0.6473612956079369
Energy: 0.4983402624578632
Energy: 0.3904930601439059
Energy: 0.3965304736505487
Energy: 0.49691930234007686
Energy: 0.678878122455083
Energy: 0.543552941489332
Energy: 0.4919603690755834
Energy: 0.5292413314335512
Energy: 0.5081373602484714
Energy: 0.6072690907041053
Energy: 0.5155155617933053
Energy: 0.4795116518814693
Energy: 0.49864355195439264
Energy: 0.5071814132602596
Energy: 0.6704009149204216
Energy: 0.5124620661134756
Energy: 0.5069412704309118
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Energy: 0.6195596986993609
Energy: 0.4840411482668245
Energy: 0.41268480484557835
Energy: 0.47604020712558615
Energy: 0.48635160526168525
Energy: 0.5271259397194078
Energy: 0.49804836423120646

minimum gb energy = 0.3838689630679434 eV
minimum distance =  2.59086573265282 Angstroms
sigma value = 33


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

Energy: 0.9823559535598926
Energy: 0.6203869585844837
Energy: 0.6037251464949249
Energy: 0.6175703278524058
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Energy: 0.6126567582400047
Energy: 0.6228147382556221
Energy: 0.6779584242095622
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Energy: 0.629069665524487

minimum gb energy = 0.5841437973586538 eV
minimum distance =  2.57058854451703 Angstroms
sigma value = 219


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

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Energy: 0.7030769839912389
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Energy: 0.7250399281710288
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Energy: 0.7631081555422843
Energy: 0.7694445280522001
Energy: 0.7991474225149323
Energy: 0.6953354313748041
Energy: 0.7151888545434374

minimum gb energy = 0.6551699434231107 eV
minimum distance =  2.55027695679569 Angstroms
sigma value = 15


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

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Energy: 0.7101412556389805
Energy: 0.7269802079538534
Energy: 0.7398195891588517
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Energy: 0.7917853205161477
Energy: 0.6723059025997642
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Energy: 0.7938958018608095
Energy: 0.7435858314001158
Energy: 0.7594648392330976
Energy: 0.6851873166788977
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minimum gb energy = 0.6696093358309966 eV
minimum distance =  2.53491945141657 Angstroms
sigma value = 293


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

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Energy: 0.7708407226852327
Energy: 0.7157876141101194
Energy: 0.7218974944638766
Energy: 0.7208329892082087
Energy: 0.7340532897076699
Energy: 0.7693009557964575
Energy: 0.6995007505508992
Energy: 0.7649466179797932
Energy: 0.7077514980936824
Energy: 0.6791705138294437
Energy: 0.731382518915075
Energy: 0.7214054528049192
Energy: 0.7539327235276108
Energy: 0.8106826537520246
Energy: 0.6792206455477144
Energy: 0.7316311091079236
Energy: 0.6474727024909436
Energy: 0.7215132020007726
Energy: 0.7068603330573244
Energy: 0.7155042825173156
Energy: 0.735637688481997
Energy: 0.6479409131581141
Energy: 0.7073830245028122
Energy: 0.7059218571984707
Energy: 0.7158880111575906
Energy: 0.7416496503682385
Energy: 0.7508169000915089
Energy: 0.7097549303255951
Energy: 0.6769241999383525
Energy: 0.7220953811214125
Energy: 0.7220661573921735
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Energy: 0.6793030854463404
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Energy: 0.7315165310215025
Energy: 0.7318945603797006
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Energy: 0.6899602596251404
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Energy: 0.764327537893494
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Energy: 0.8995284630621927
Energy: 0.6966339333601925
Energy: 0.709782260942577
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Energy: 0.7350027503504132
Energy: 0.8225803767701886
Energy: 0.732790457908409
Energy: 0.7086384278955171
Energy: 0.6851949077137932
Energy: 0.7371612543838447
Energy: 0.7165490426030631
Energy: 0.7665104078931652
Energy: 0.7114655092982246
Energy: 0.6770889497331789
Energy: 0.7307271379063026
Energy: 0.7133033327452782
Energy: 0.7748472784073838
Energy: 0.7094741486912975
Energy: 0.6779893908211073
Energy: 0.704030316322498
Energy: 0.8618719430830768
Energy: 0.7176674205747183
Energy: 0.7149640506792966
Energy: 0.7483161243395663
Energy: 0.7213384990996244
Energy: 0.8190139014148428
Energy: 0.7226244278174727
Energy: 0.7151465096058459
Energy: 0.7467394553304435
Energy: 0.7853329358862206
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Energy: 0.731043738250266
Energy: 0.7582037773963141
Energy: 0.7308029689946751
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Energy: 0.7338937466728995
Energy: 0.6975021445693906
Energy: 0.7387701259375594
Energy: 0.7499524715093483
Energy: 0.7050988478281354
Energy: 0.8007877192831725
Energy: 0.6979201085493625
Energy: 0.7380141238411725
Energy: 0.7642354789718329
Energy: 0.6977190689326228
Energy: 0.7531958406188977
Energy: 0.6971968165448428
Energy: 0.6802758923623704
Energy: 0.721581612884769
Energy: 0.7153589301496195
Energy: 0.7093297546129641
Energy: 0.6975208987848993
Energy: 0.7300787002772354
Energy: 0.7058087075701436
Energy: 0.690700707831074
Energy: 0.7082360421761595
Energy: 0.689464603251215
Energy: 0.7162690122584077
Energy: 0.8932762853875211
Energy: 0.7386633867082025
Energy: 0.7471311569505416
Energy: 0.6834200127570987
Energy: 0.711227251488937
Energy: 0.9030392024467664
Energy: 0.7182392333391759
Energy: 0.7353881709631827
Energy: 0.68466962900407
Energy: 0.7709818336254773
Energy: 0.7114546930692457
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Energy: 0.6905600418058944
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Energy: 0.7513525526216449
Energy: 0.6814636920576923
Energy: 0.7038682078402413
Energy: 0.7255176448328409
Energy: 0.813324721970869
Energy: 0.7265106052642993
Energy: 0.6869447058296277
Energy: 0.7048923596233909
Energy: 0.7642981325660836
Energy: 0.8066347937300982
Energy: 0.7323250594424585
Energy: 0.6868342741823171
Energy: 0.7087444534936235
Energy: 0.7262238894032081
Energy: 0.7120212622556038
Energy: 0.75410347789621
Energy: 0.6482138652842834
Energy: 0.7313551270087723
Energy: 0.7149551506935821
Energy: 0.7492844443541944
Energy: 0.7269757592273112
Energy: 0.6481867654925644
Energy: 0.6839108602188051
Energy: 0.6815624711168934
Energy: 0.7428093564136272
Energy: 0.7402263052701944
Energy: 0.6477152427935176
Energy: 0.7102978055777587
Energy: 0.692965503184045
Energy: 0.7411648873386297
Energy: 0.7454948408397227
Energy: 0.6477032993059257
Energy: 0.735636761772549
Energy: 0.7093883609994924
Energy: 0.6802515950204475
Energy: 0.7410526346918067
Energy: 0.7220443864428937
Energy: 0.7357430479724787
Energy: 0.7111877683752815
Energy: 0.683085923899806
Energy: 0.7416482047730931
Energy: 0.7650509249085382
Energy: 0.7465744671193797
Energy: 0.6851531595833724
Energy: 0.7184593355737721
Energy: 0.8598612934930928
Energy: 0.7245607921329138
Energy: 0.7467462630762658
Energy: 0.6842296271575175
Energy: 0.718656606994303
Energy: 0.8689999276145941
Energy: 0.6880942872615852
Energy: 0.7089987530076054
Energy: 0.7559938936541074
Energy: 0.7654689150664767
Energy: 0.7196004108343287
Energy: 0.7391349601139027
Energy: 0.7321369358026562
Energy: 0.7586940326159001
Energy: 0.7955696679562889
Energy: 0.7168168433844339
Energy: 0.7434963254284963
Energy: 0.7339890633697883
Energy: 0.7222131002554205
Energy: 0.7340618755817089
Energy: 0.7331376865240743
Energy: 0.74886297595169
Energy: 0.7323539466929389
Energy: 0.7222297979441992
Energy: 0.7409743320868336
Energy: 0.7337891399072731
Energy: 0.7480469165858586
Energy: 0.6463240670231434
Energy: 0.7307242888583163
Energy: 0.8092716330230474
Energy: 0.7642607663572212
Energy: 0.727044662230859
Energy: 0.6464372809122613
Energy: 0.7118206615666592
Energy: 0.8098487725759965
Energy: 0.7179380310489782
Energy: 0.7027478616976134

minimum gb energy = 0.6463240670231434 eV
minimum distance =  2.53081370696725 Angstroms
sigma value = 293


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

Energy: 0.704594051030232
Energy: 0.6786573192079263
Energy: 0.6999851047548794
Energy: 0.6975470267845261
Energy: 0.6796258633955219
Energy: 0.7051570273837614
Energy: 0.6962904785400098
Energy: 0.6997114610078019
Energy: 0.6754602906772859
Energy: 0.6788867518499645
Energy: 0.7002459735429126
Energy: 0.6803232784782303
Energy: 0.6696519710060993
Energy: 0.6527801530067233
Energy: 0.6732266273474101
Energy: 0.6908633506042539
Energy: 0.679876871771063
Energy: 0.6615835335340621
Energy: 0.678959153641094
Energy: 0.7039170168228092
Energy: 0.6548083976228166
Energy: 0.6951842383115922
Energy: 0.692563750066817
Energy: 0.6993701626275423
Energy: 0.6996396801779892
Energy: 0.653111905418903
Energy: 0.6964757780040013
Energy: 0.6937963751512966
Energy: 0.698916648484884
Energy: 0.7007906806525592
Energy: 0.7080429551475833
Energy: 0.686446225727891
Energy: 0.6829807536264769
Energy: 0.652161455058735
Energy: 0.7000136588729204
Energy: 0.707569121756494
Energy: 0.6863499413981548
Energy: 0.6809441244501094
Energy: 0.6534064049744128
Energy: 0.6742686463286701
Energy: 0.6986335810279386
Energy: 0.6428254607855537
Energy: 0.7012429921165148
Energy: 0.6980322920506499
Energy: 0.6997649410334168
Energy: 0.6783069840225946
Energy: 0.6441158227460324
Energy: 0.7020949054249803
Energy: 0.6984304917420026
Energy: 0.6756228101399283
Energy: 0.6714136581827644
Energy: 0.6990824788679988
Energy: 0.7145345428833291
Energy: 0.6793831369243752
Energy: 0.6609239323604699
Energy: 0.6972185993679706
Energy: 0.6993548997465033
Energy: 0.7130132285834528
Energy: 0.6774561929470344
Energy: 0.6612493715823166
Energy: 0.7072966959763386
Energy: 0.6743010153251537
Energy: 0.6522172299436712
Energy: 0.6779553607670451
Energy: 0.6872282706557706
Energy: 0.7073177832955534
Energy: 0.6746942361609468
Energy: 0.6861454177860131
Energy: 0.677016076281269
Energy: 0.7025701919189721
Energy: 0.690718118697199
Energy: 0.6895650518963066
Energy: 0.6996532637254369
Energy: 0.6966221992803829
Energy: 0.6418480230785892
Energy: 0.6893161150951661
Energy: 0.7147427922985823
Energy: 0.6989882339537689
Energy: 0.6960291811205164
Energy: 0.6416507873665982
Energy: 0.6949916696182503
Energy: 0.6420807357642703
Energy: 0.6534154905019259
Energy: 0.6783502022526112
Energy: 0.6757433532369507
Energy: 0.6945111011552333
Energy: 0.6526041735431178
Energy: 0.6522964584175343
Energy: 0.6947917454296719
Energy: 0.6890702093265263
Energy: 0.6781499258594167
Energy: 0.6946432698016868
Energy: 0.715116474217187
Energy: 0.6933024524575844
Energy: 0.676827558768851
Energy: 0.681078318311222
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Energy: 0.7153743100566494
Energy: 0.6751081999983712
Energy: 0.6765775128008857
Energy: 0.6870324997729903
Energy: 0.7035223626714711
Energy: 0.6533710282923799
Energy: 0.699384221044569
Energy: 0.6908503053412142
Energy: 0.6884433734170274
Energy: 0.7017643869294933
Energy: 0.6464147520863679
Energy: 0.699090905141926
Energy: 0.6907636057817098
Energy: 0.7046502665435133
Energy: 0.6892621066179276
Energy: 0.7000916108488378
Energy: 0.6974183697178921
Energy: 0.6790873173572903
Energy: 0.7050564035877344
Energy: 0.699724268673168
Energy: 0.699684493373886
Energy: 0.6972541334835309
Energy: 0.6781253173170428
Energy: 0.6975982357964631
Energy: 0.6803435577694474
Energy: 0.6688096749373975
Energy: 0.6527239280611177
Energy: 0.6726208609210661
Energy: 0.6904304679783203
Energy: 0.6817561513511409
Energy: 0.6416570648814175
Energy: 0.6537302340721095
Energy: 0.7039341350149294
Energy: 0.6550383339051188
Energy: 0.6958970797271078
Energy: 0.6931196586362987
Energy: 0.6993387051464647
Energy: 0.6999914552024205
Energy: 0.653124252295305
Energy: 0.6968299084821296
Energy: 0.694190161724328
Energy: 0.6990402686676493
Energy: 0.7010664367369556
Energy: 0.6982595696104791
Energy: 0.6865871320166846
Energy: 0.6824769892079914
Energy: 0.6519707726873257
Energy: 0.6999048722925513
Energy: 0.6990868609612652
Energy: 0.6865080087481146
Energy: 0.6803164999741859
Energy: 0.6531841336781947
Energy: 0.6995320885691997
Energy: 0.679166353800595
Energy: 0.6427633618651508
Energy: 0.7002482020190404
Energy: 0.6980285553800567
Energy: 0.6997132445863664
Energy: 0.6796370055981218
Energy: 0.6445072187071518
Energy: 0.7011113059332683
Energy: 0.6984335176861222
Energy: 0.6866784751818691
Energy: 0.6707706176787089
Energy: 0.698873179005148
Energy: 0.7145865367069737
Energy: 0.6794870313618494
Energy: 0.6616870637516601
Energy: 0.671676496591328
Energy: 0.6992581130896236
Energy: 0.6968967921989454
Energy: 0.6772849308122721
Energy: 0.6621109999285769
Energy: 0.7073109172509245
Energy: 0.6739605225258821
Energy: 0.6838355559332627
Energy: 0.678476923016462
Energy: 0.6982861508453928
Energy: 0.7073556314842429
Energy: 0.6745082851800742
Energy: 0.6851908082934032
Energy: 0.6775159870730437
Energy: 0.7028299295854287
Energy: 0.6994276947037171
Energy: 0.6895711486539222
Energy: 0.6879743317824538
Energy: 0.6967933662508539
Energy: 0.6423205452845645
Energy: 0.6887260209744
Energy: 0.7147631321106087
Energy: 0.697720418019035
Energy: 0.6968493533348641
Energy: 0.6419715595788675
Energy: 0.6944185576307071
Energy: 0.6419418581339833
Energy: 0.6537040307540122
Energy: 0.6785691116709476
Energy: 0.6773586383551473
Energy: 0.6957325322473802
Energy: 0.652209015878287
Energy: 0.6527883771808322
Energy: 0.694983804172395
Energy: 0.6754776534880849
Energy: 0.678260786412908
Energy: 0.6972792492424492
Energy: 0.7150410488651149
Energy: 0.6774517523540314
Energy: 0.6765376037135147
Energy: 0.6786554107674222
Energy: 0.694786565991063
Energy: 0.715159968012951
Energy: 0.6751463803658908
Energy: 0.676197793904298
Energy: 0.6870560627418715
Energy: 0.7029610685226086
Energy: 0.6526751257941006
Energy: 0.6995001065163148
Energy: 0.6908217496760276
Energy: 0.68836582553192
Energy: 0.7020598782333708
Energy: 0.64645650351775
Energy: 0.6993023173188039
Energy: 0.6908935775506897

minimum gb energy = 0.6416507873665982 eV
minimum distance =  2.57866743157389 Angstroms
sigma value = 15


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

Energy: 1.1914340060128867
Energy: 0.6285961813029858
Energy: 0.776023081430872
Energy: 0.7734615125747498
Energy: 0.6346323238192563
Energy: 0.8260027546714382
Energy: 0.6711833578737125
Energy: 0.7543246973901064
Energy: 0.7718152300106764
Energy: 0.6309766950645521
Energy: 0.6363254704588639
Energy: 0.6812256488569843
Energy: 0.6579380886174413
Energy: 0.6550449690256632
Energy: 0.7855733999918936
Energy: 0.6357770197390685
Energy: 0.6845270223689283
Energy: 0.6765910550764562
Energy: 0.7492234270873899
Energy: 0.8210516733683826
Energy: 0.6858652665240953
Energy: 0.6794053452438847
Energy: 0.6266617979269145
Energy: 0.6962949682105363
Energy: 0.7191147088805585
Energy: 0.6844551151397893
Energy: 0.688610640333245
Energy: 0.626636527460633
Energy: 0.6960410853481005
Energy: 0.7451049005141859
Energy: 0.7360739449317529
Energy: 0.6289433522797058
Energy: 0.7197884702639834
Energy: 0.71050562584437
Energy: 0.7609956981058437
Energy: 0.7229843257415178
Energy: 0.6289095436160924
Energy: 0.7784881313066958
Energy: 0.7094987065362209
Energy: 0.7449960875079521
Energy: 0.7957864383628203
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Energy: 0.7260475052587265
Energy: 0.6732307194393661
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Energy: 0.796410153244191
Energy: 0.715631242992667
Energy: 0.6646706968638365
Energy: 0.6630443614396782
Energy: 0.7869746027883979
Energy: 0.8072390122360096
Energy: 0.6523631075892137
Energy: 0.693389051383629
Energy: 0.6832216238305876
Energy: 0.8903085943818744
Energy: 0.7328175631153357
Energy: 0.6282738850109677
Energy: 0.6585930368450187
Energy: 0.6865240775852077
Energy: 0.8074335214871037
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Energy: 0.6552973276125478
Energy: 0.627224079500225
Energy: 0.7084188520391215
Energy: 0.8215503334755331
Energy: 0.6558085856779389
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Energy: 0.7083175357129412
Energy: 0.760477539331377
Energy: 0.6797370303615643
Energy: 0.6639772191784364
Energy: 0.6948889150649663
Energy: 0.7277981069231381
Energy: 0.7441812171520048
Energy: 0.6799916740087695
Energy: 0.6445300419556705
Energy: 0.7000178650193467
Energy: 0.6971124376961283
Energy: 0.6937645265355905
Energy: 0.6688960499765322
Energy: 0.8543057752940396
Energy: 0.6909616600511042
Energy: 0.7515062750502631
Energy: 0.6290726681780597
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Energy: 0.8398553567727657
Energy: 0.6918041683757727
Energy: 0.7520922148470002
Energy: 0.628471240051714
Energy: 0.6922699109070186
Energy: 0.6803968098997687
Energy: 0.626989383946116
Energy: 0.6459471320632258
Energy: 0.6309522090138926
Energy: 0.6829562758503779
Energy: 0.6791472538606284
Energy: 0.6330136113283018
Energy: 0.6539587414883601
Energy: 0.6316110235320426
Energy: 0.7393888617015049
Energy: 0.6864018514326347
Energy: 0.6307591563748296
Energy: 0.6300230668459447
Energy: 0.6535918172760891
Energy: 0.7385979639400567
Energy: 0.6708409788785445
Energy: 0.6295401429433892
Energy: 0.6557318586126649
Energy: 0.6847665601135737
Energy: 0.8038739256305378
Energy: 0.6858444382605994
Energy: 0.6946611683659031
Energy: 0.6533900614377337
Energy: 0.7212734696659707
Energy: 0.7622578131413327
Energy: 0.6855725360668944
Energy: 0.6943539948686048
Energy: 0.7090413117899487
Energy: 0.8361342410428961
Energy: 0.7924807387185981
Energy: 0.7925195169268472
Energy: 0.6605916413935116
Energy: 0.6306614139660532
Energy: 0.7735173814810521
Energy: 0.7698532774789784
Energy: 0.6612075438589387
Energy: 0.6602416444235363
Energy: 0.6460937830085155
Energy: 0.7770820500764121
Energy: 0.7070678894804667
Energy: 0.7107262330714118
Energy: 0.653133455346135
Energy: 0.6842812787738297
Energy: 0.7215249055845849
Energy: 0.6862143991795663
Energy: 0.7107734172912836
Energy: 0.6287499110176763
Energy: 0.6847796398369549
Energy: 0.7206732453807059
Energy: 0.6789079312773418
Energy: 0.6956702946865636
Energy: 0.715677826054114
Energy: 0.681290372756816
Energy: 0.6801672993057679
Energy: 0.7702323066881933
Energy: 0.7255034025248276
Energy: 0.7097556340873288
Energy: 0.6993022987232249
Energy: 0.6809807910625552
Energy: 0.7531052891473765
Energy: 0.7573429916235181
Energy: 0.7235297270403533
Energy: 0.7223240590584447
Energy: 0.704608077633579
Energy: 0.7511889100051778
Energy: 0.7566989739030336
Energy: 0.7228757487788305
Energy: 0.7263202504910012
Energy: 0.66367472622884
Energy: 0.6588533208095302
Energy: 0.698503565952896
Energy: 0.7314151824984593
Energy: 0.750374112072563
Energy: 0.8263112926633622
Energy: 0.6590485257525446
Energy: 0.7358905366810689
Energy: 0.735634222730977
Energy: 0.7158725929771044
Energy: 0.7292276214700862
Energy: 0.7210579949987507
Energy: 0.8205668885506768
Energy: 0.8067051205571826
Energy: 0.7079470230281949
Energy: 0.6352727480890583
Energy: 0.7124493684344564
Energy: 0.8215630784522903
Energy: 0.8106040913891338
Energy: 0.7092954320457405
Energy: 0.634765994040498
Energy: 0.6581973215062694
Energy: 0.7417667822898779
Energy: 0.7251981840941645
Energy: 0.651631427148206
Energy: 0.6350192154809888
Energy: 0.6598540549406838
Energy: 0.731750384652621
Energy: 0.6282643990899939
Energy: 0.6657412165285583
Energy: 0.6348814798176918
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Energy: 0.8184731202951835
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Energy: 0.6812227115673513
Energy: 0.8074811832975517
Energy: 0.6722595126940771
Energy: 0.6295558270796425
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Energy: 0.652245071269457
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Energy: 0.671761947256717
Energy: 0.6280809980982658
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Energy: 0.8039009739670434
Energy: 0.6855645899643625
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Energy: 0.6280865184628838
Energy: 0.7313467246255032
Energy: 0.7925461648459562
Energy: 0.6858056591893067
Energy: 0.6940136396203468
Energy: 0.6766701686100602
Energy: 0.7288662306447791
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Energy: 0.805397012181549
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Energy: 0.7541528097641761
Energy: 0.6942206653361508
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Energy: 0.7487613030709925
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Energy: 0.704997527725841
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Energy: 0.7837212301450827
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Energy: 0.7388856620105062
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Energy: 0.6851101362056974
Energy: 0.7244366860860856
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Energy: 0.7597560515113106
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Energy: 0.732603124279055
Energy: 1.0464106086616851
Energy: 0.6869558425774636
Energy: 0.7603281398693809
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Energy: 0.7074547618405526
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Energy: 0.8082827585256313
Energy: 0.8269492973145672
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Energy: 0.6346902011297528
Energy: 0.7128589070622042
Energy: 0.8099081408786565
Energy: 0.8169974181666795
Energy: 0.7005229819806313
Energy: 0.6348912667117153
Energy: 0.6579419160495262
Energy: 0.6989269312937225
Energy: 0.725351215843059
Energy: 0.6534545326771637
Energy: 0.6373949413684825
Energy: 0.658792884815531
Energy: 0.7296699343079023
Energy: 0.7250514391464483
Energy: 0.6545673292332285
Energy: 0.635007462530413
Energy: 0.6337940728198043
Energy: 0.8297293732657661
Energy: 0.73239910499192
Energy: 0.656527240346767
Energy: 0.6427579015214949
Energy: 0.6273728361884794
Energy: 0.8438201539500768
Energy: 0.6984658024076484
Energy: 0.6563190818777224
Energy: 0.6503322991604711
Energy: 0.6536023563527498
Energy: 0.6951707288577215
Energy: 0.6349754347765717
Energy: 0.6979536030472749
Energy: 0.6954628126985904
Energy: 0.717044418300939
Energy: 0.6950451867409186
Energy: 0.6350424392783305
Energy: 0.7182353662491867
Energy: 0.7282557831021577
Energy: 0.7020634733150182
Energy: 0.7227664137425491
Energy: 0.6514843610314136
Energy: 0.8393447535353331
Energy: 0.6605142342587198
Energy: 0.672425538082089
Energy: 0.6744134590491961
Energy: 0.6514978018950437
Energy: 0.8770706129394771
Energy: 0.6677021275558848
Energy: 0.6341355569319485
Energy: 0.6633406512065038
Energy: 0.6543195424279082
Energy: 0.7697101871048165
Energy: 0.6605756388992797
Energy: 0.6345599489685319
Energy: 0.6625407307087047
Energy: 0.6651863966078476
Energy: 0.7769910666953305
Energy: 0.6588324930680387
Energy: 0.6354367569511763
Energy: 0.709463087399034
Energy: 0.7738460972958896
Energy: 0.7298021424938923
Energy: 0.6820932383642593
Energy: 0.6352348916643346
Energy: 0.7092722052401875
Energy: 0.7374884085404356
Energy: 0.7127777958937372
Energy: 0.6811967753871385
Energy: 0.6975426945049523
Energy: 0.7137879102838692
Energy: 0.7388684266583394
Energy: 0.6971688865214801
Energy: 0.6588850658757845
Energy: 0.6714591743647169
Energy: 0.7140038326293806
Energy: 0.7572512573353498
Energy: 0.6633372515226832
Energy: 0.6486527707918854

minimum gb energy = 0.626636527460633 eV
minimum distance =  2.56391326942966 Angstroms
sigma value = 437


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

Energy: 0.9853102723585502
Energy: 0.5879887639302004
Energy: 0.6322973635629695
Energy: 0.6285875082549504
Energy: 0.6974369809571469
Energy: 0.9855935089091182
Energy: 0.6477623423273352
Energy: 0.638972342664627
Energy: 0.6273580775779423
Energy: 0.681689572191157
Energy: 0.671145749573195
Energy: 0.7356421605709669
Energy: 0.6929826488313244
Energy: 0.7234236759644024
Energy: 0.648164168068311
Energy: 0.6412891294042765
Energy: 0.7356422082181194
Energy: 0.6944512387166288
Energy: 0.824540133930527
Energy: 0.6734381225125594
Energy: 0.6536818387579609
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Energy: 0.8006976899348147
Energy: 0.6315613312541296
Energy: 0.685107717180102
Energy: 0.6621187506662869
Energy: 0.673222337242465
Energy: 0.771103850100703
Energy: 0.639408243021122
Energy: 0.6823548612931777
Energy: 0.6340443521719827
Energy: 0.6508695632696885
Energy: 0.8329976651238669
Energy: 0.6662865191253721
Energy: 0.6806036037858689
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Energy: 0.7065024398346927
Energy: 0.6661507639205361
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Energy: 0.6404149474830949
Energy: 0.7518364503750987
Energy: 0.5897288937009644
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Energy: 0.7289060112928092
Energy: 0.7074757096503137
Energy: 0.5899714957993182
Energy: 0.6486107450281701
Energy: 0.7224682760683319
Energy: 0.6875956839187191
Energy: 0.6252964007637447
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Energy: 0.7103393992219229
Energy: 0.628508061553666
Energy: 0.5880848579177786
Energy: 0.6475767137038667
Energy: 0.6407506044844449
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Energy: 0.6405207290017133
Energy: 0.7315165976620528
Energy: 0.6450066051271591
Energy: 0.6412856473531954
Energy: 0.6683145667680727
Energy: 0.6433351883239833
Energy: 0.6698805603127125
Energy: 0.646187891760934
Energy: 0.5988141425086816
Energy: 0.636039862311599
Energy: 0.684554611800587
Energy: 0.7058849904555425
Energy: 0.6455760470603246
Energy: 0.5941812186227672
Energy: 0.6517270382286212
Energy: 0.6970867215390656
Energy: 0.7501759529156719
Energy: 0.6027223312230506
Energy: 0.8447282809522351
Energy: 0.5992584178430695
Energy: 0.8622252983507347
Energy: 0.6408510445903368
Energy: 0.6036788048960297
Energy: 0.8430105965895149
Energy: 0.7169194775173644
Energy: 0.8452176726566433
Energy: 0.6336628029384559
Energy: 0.6157776962824567
Energy: 0.5909233150513767
Energy: 0.5938078818471594
Energy: 0.5912198633353406
Energy: 0.7128517049435329
Energy: 0.7107642069459371
Energy: 0.5915065915453511
Energy: 0.5940090042787818
Energy: 0.5911104820066452
Energy: 0.7076132030827362
Energy: 0.6399286245483302
Energy: 0.6114356519402272
Energy: 0.600417436849224
Energy: 0.8831224934307109
Energy: 0.5956207514855444
Energy: 0.6058347217645947
Energy: 0.6154951196774522
Energy: 0.6004042480890088
Energy: 0.8850254757338034
Energy: 0.5932850473623863
Energy: 0.6148993723411471
Energy: 0.5990865000139023
Energy: 0.627213749022574
Energy: 0.7958605021824318
Energy: 0.6405727100719192
Energy: 0.6152754862671114
Energy: 0.5992083290108938
Energy: 0.6280780569227284
Energy: 0.8045389388713065
Energy: 0.6353407266877097
Energy: 0.6206935950553617
Energy: 0.6216495148290822
Energy: 0.7552418269505201
Energy: 0.6503663527701579
Energy: 0.6463226707081394
Energy: 0.6195699862206616
Energy: 0.6220177265006132
Energy: 0.6516729703448014
Energy: 0.7532244851137256
Energy: 0.64416361744969
Energy: 0.5998963239515015
Energy: 0.6396781557501404
Energy: 0.6938001441642573
Energy: 0.6256240495989973
Energy: 0.5895461092180846
Energy: 0.6837371265054981
Energy: 0.6426784205393679
Energy: 0.7469890896033876
Energy: 0.6257980564692119
Energy: 0.6504109765244418

minimum gb energy = 0.5879887639302004 eV
minimum distance =  2.53143715311619 Angstroms
sigma value = 33