Model name: model_name=EAM_Dynamo_HaleWongZimmerman_2008PairMorse_PdAgH__MO_108983864770_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=4.08997417986393
cohesive_energy=2.8502318916679323
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, -4.6354815245541595e-18, -6.168620367395099e-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: 0.009715422988465896
Energy: 0.07060091868031228
Energy: 0.07193997036505727
Energy: 0.07183822072463515
Energy: 0.012246199781494715
Energy: 0.010643969833573408
Energy: 0.07041604958097848
Energy: 0.07216180243140799
Energy: 0.07135130703711115
Energy: 0.011644883162601764
Energy: 0.07061278354061618
Energy: 0.070293732044834
Energy: 0.07060274524271198
Energy: 0.07192865905273428
Energy: 0.0720721851349771
Energy: 0.07090657519672956
Energy: 0.0703341789266869
Energy: 0.07045147760455019
Energy: 0.07202844940593381
Energy: 0.07181935840224685
Energy: 0.07219074171645536
Energy: 0.012195597829767023
Energy: 0.010045254458199744
Energy: 0.07077701475621337
Energy: 0.07127281267097985
Energy: 0.0721644581176007
Energy: 0.011792495953472079
Energy: 0.009927224212412657
Energy: 0.0705703740371477
Energy: 0.07192075367335461
Energy: 0.07149797638052088
Energy: 0.010669132390553056
Energy: 0.010614272223201915
Energy: 0.07081021737582757
Energy: 0.07064115443667104
Energy: 0.07227865390119154
Energy: 0.010868775359699474
Energy: 0.010122140611579887
Energy: 0.07062776548261493
Energy: 0.07044302840149065
Energy: 0.07129429154182258
Energy: 0.07114458860702297
Energy: 0.07254984697427386
Energy: 0.010902192608513852
Energy: 0.010253094608544637
Energy: 0.07089438595729612
Energy: 0.0716458618519157
Energy: 0.07253775769271265
Energy: 0.011671144774235524
Energy: 0.07027135357793365
Energy: 0.07266500262438537
Energy: 0.07070075582088163
Energy: 0.0713295069363576
Energy: 0.010424091147606973
Energy: 0.010048297445453554
Energy: 0.07056728503576423
Energy: 0.07035253998101536
Energy: 0.07159966618617183
Energy: 0.010851303623991842
Energy: 0.01017261983712073
Energy: 0.010100607220195604
Energy: 0.07259065443818265
Energy: 0.07127069142728351
Energy: 0.07113786866673502
Energy: 0.07299790500702609
Energy: 0.0101272002341294
Energy: 0.0730376873087113
Energy: 0.0711881386924136
Energy: 0.07147801345142878
Energy: 0.0726648326864038

minimum gb energy = 0.009715422988465896 eV
minimum distance =  2.85148880134839 Angstroms
sigma value = 3


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

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Energy: 0.6042510133569454
Energy: 0.6410129513776772
Energy: 0.6037661708337639
Energy: 0.6031722512056872
Energy: 0.6277768435790827
Energy: 0.6056283932139767
Energy: 0.6289186578821024
Energy: 0.6272841056889417
Energy: 0.5979350493430743
Energy: 0.641309512178934
Energy: 0.6578026393578054
Energy: 0.6291931476527803
Energy: 0.5621439785262076
Energy: 0.4909706265026482
Energy: 0.4907987474426243
Energy: 0.6454449907152655
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Energy: 0.5607016121061884
Energy: 0.518779194130807
Energy: 0.5602994334467671
Energy: 0.717003331810553
Energy: 0.5475306398641402
Energy: 0.5653293294649495
Energy: 0.48990606378993734
Energy: 0.48968880285237865
Energy: 0.5479053164509441
Energy: 0.5472355755726245
Energy: 0.5408254389338426
Energy: 0.6031658247072722
Energy: 0.5392763652408001
Energy: 0.6872433765695231
Energy: 0.6755244654990609
Energy: 0.4895136885520708
Energy: 0.4897963986420547
Energy: 0.4901312349004116
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Energy: 0.6437514823186824
Energy: 0.5653248103159179
Energy: 0.6033857854357929
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Energy: 0.6278402972451869
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Energy: 0.6511833475208734
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Energy: 0.627193057637308
Energy: 0.6795794331077685
Energy: 0.5189655784633236
Energy: 0.5641465467948142
Energy: 0.6729368995222577
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Energy: 0.6207896236695104
Energy: 0.5170190601200326
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Energy: 0.6257832524058762
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Energy: 0.6469034084739241
Energy: 0.6568169096950992
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Energy: 0.6211387101167068
Energy: 0.6997507202267612
Energy: 0.64596427463667
Energy: 0.6470620250044469
Energy: 0.6485580288937501
Energy: 0.6483866539516094
Energy: 0.6539193754328044
Energy: 0.6534416876455779
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Energy: 0.6463900942325728
Energy: 0.6449760781587975
Energy: 0.6533854481227233
Energy: 0.6431807149657035
Energy: 0.6507113601760417
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Energy: 0.7112464736235113
Energy: 0.6448901762171827
Energy: 0.703526498769253
Energy: 0.5177937999813267
Energy: 0.5607704524358166
Energy: 0.6572948373748018
Energy: 0.6566343035220441
Energy: 0.5798682163921806
Energy: 0.5171132662063767
Energy: 0.5149720970802553
Energy: 0.5190465389936864
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Energy: 0.62238670895545
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Energy: 0.6602993975102026
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Energy: 0.6457924218420706
Energy: 0.5913383962577896
Energy: 0.6784916003500365
Energy: 0.6415917246935079
Energy: 0.7012843954516509
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Energy: 0.6465314093910299
Energy: 0.7013744452136123
Energy: 0.5761642677068632
Energy: 0.5180409761399716
Energy: 0.6095136926249051
Energy: 0.6462492295089309
Energy: 0.518708405670456
Energy: 0.5180168753545321
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Energy: 0.5353352766515311
Energy: 0.5456666553913894
Energy: 0.5771580490973945
Energy: 0.5181173766916816
Energy: 0.5170530851316699
Energy: 0.585333055942522
Energy: 0.5449064018044129
Energy: 0.534066369971259
Energy: 0.5803608090270608
Energy: 0.5386835954146901
Energy: 0.5893610406576146
Energy: 0.5505506359733336
Energy: 0.49464473260388936
Energy: 0.5173661883718709
Energy: 0.594201227417655
Energy: 0.5384799845738268
Energy: 0.5449319742782388
Energy: 0.6735052972228612
Energy: 0.5712623552276591
Energy: 0.5724888046971243
Energy: 0.6761154512073568
Energy: 0.6378611020213631
Energy: 0.4930286889161512
Energy: 0.4936108682980496
Energy: 0.5210069925612574
Energy: 0.7790403159262534
Energy: 0.6425305286722837
Energy: 0.6947961509656841
Energy: 0.6400344774558704
Energy: 0.624570420247589
Energy: 0.6538569202671766
Energy: 0.6627940677111792
Energy: 0.6258942583167395
Energy: 0.5139634266415196
Energy: 0.5773502059875489
Energy: 0.6323529902242918
Energy: 0.6619623538618281
Energy: 0.5748608658189639
Energy: 0.6074028594553634
Energy: 0.6898009727810511
Energy: 0.6252593616329103
Energy: 0.652393457134827
Energy: 0.4934057470250912
Energy: 0.49196746471274494
Energy: 0.692625397038479
Energy: 0.6081858542002775
Energy: 0.6456888018876228
Energy: 0.6718399019441302
Energy: 0.6059334192361729
Energy: 0.6426752957932736
Energy: 0.6043240127867665
Energy: 0.6034341280788168
Energy: 0.6020886309355666
Energy: 0.605932835410501
Energy: 0.6284712626765433
Energy: 0.6270091551348573
Energy: 0.5999013279160225

minimum gb energy = 0.4895136885520708 eV
minimum distance =  2.60432886131507 Angstroms
sigma value = 75


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

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Energy: 0.7287090102598226
Energy: 0.6336287425490209
Energy: 0.6273843922764131
Energy: 0.7056912084536869
Energy: 0.6144332040095613
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Energy: 0.6320645564887127
Energy: 0.6492519347378475
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Energy: 0.5840520373189367
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Energy: 0.6401519424475635
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minimum gb energy = 0.556891749995571 eV
minimum distance =  2.63372950189003 Angstroms
sigma value = 105


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

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Energy: 0.6315303463018153
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Energy: 0.6485602416880433
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Energy: 0.6414481984497502
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Energy: 0.6516765543242233
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Energy: 0.6540386095690527
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Energy: 0.6471899582476184
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Energy: 0.6241757506281574
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Energy: 0.6679534253368854
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Energy: 0.6434476433551893
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Energy: 0.6264527903836049
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Energy: 0.6580996361347643
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Energy: 0.665345451903811
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Energy: 0.6310473645777706
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Energy: 0.6626784129442669
Energy: 0.6342298232493025
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Energy: 0.6978647622865833
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Energy: 0.6527153681456619
Energy: 0.6294860044956533
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Energy: 0.6658839833577953
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Energy: 0.6155212260944841
Energy: 0.6373076053244647
Energy: 0.6296871644592734
Energy: 0.6465145254908053
Energy: 0.626553858361842
Energy: 0.615359265980042
Energy: 0.6151358763263645
Energy: 0.6291826693542183
Energy: 0.6608156931433536
Energy: 0.6293415461295547
Energy: 0.617926816691334
Energy: 0.6532975254575276
Energy: 0.6393708757458947
Energy: 0.6561526963208675
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Energy: 0.6183210844027235
Energy: 0.6532636935843559
Energy: 0.637920626479511
Energy: 0.6507874538706061
Energy: 0.6244989519801762
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Energy: 0.6543810043410687
Energy: 0.6476002528157329
Energy: 0.6245358419926882
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Energy: 0.6547823794131012
Energy: 0.6532388555391191
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Energy: 0.6250474789591036
Energy: 0.6248217771138708
Energy: 0.6287413941638875
Energy: 0.653273926962212
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Energy: 0.6252343929426538
Energy: 0.6302928474476294
Energy: 0.6412583227528135
Energy: 0.6887602693883481
Energy: 0.6516027708173988
Energy: 0.6482862957099783
Energy: 0.6520645012210562
Energy: 0.6528599711582833
Energy: 0.6703580277281322
Energy: 0.6503492529177372
Energy: 0.6539052072885795
Energy: 0.6520635360428049
Energy: 0.6536576899206322
Energy: 0.6548064922769115
Energy: 0.6530611424266092
Energy: 0.6470764158427412
Energy: 0.6127810179914904
Energy: 0.6865337222005852
Energy: 0.6376534242006727
Energy: 0.653844180232842
Energy: 0.6530411131330335
Energy: 0.6124323624766358
Energy: 0.610601880459148
Energy: 0.6554782471915515
Energy: 0.6529797814855892
Energy: 0.6523719175399487
Energy: 0.640606710534992
Energy: 0.6763904317909518
Energy: 0.6126063308570854
Energy: 0.6507300692219933
Energy: 0.6525879411013643
Energy: 0.6392066272604113
Energy: 0.6789061529727476
Energy: 0.6528894312280459
Energy: 0.6547369848404837
Energy: 0.6447056473524508
Energy: 0.6589625288258973
Energy: 0.6762032212465734
Energy: 0.6528675107692908
Energy: 0.6501551695040385
Energy: 0.6469568693492056
Energy: 0.6485364528270499
Energy: 0.6814838715832501
Energy: 0.6515637441666031
Energy: 0.6479645322413553
Energy: 0.6512442038487787
Energy: 0.645697902040306
Energy: 0.6534992198375194
Energy: 0.6670370061740956
Energy: 0.6469017619913195
Energy: 0.6304409656120266
Energy: 0.6545699348206986
Energy: 0.6530928425580144
Energy: 0.6486480554189352
Energy: 0.6481435971017401
Energy: 0.6680551854161685
Energy: 0.6433466397597908
Energy: 0.6523689635962692
Energy: 0.6431314509385361
Energy: 0.6625411529351768
Energy: 0.6346679965965201
Energy: 0.6469644129292375
Energy: 0.6285386882547614
Energy: 0.6922952692282861
Energy: 0.6233213052100774
Energy: 0.6535490291988801
Energy: 0.6416770688370506
Energy: 0.6288113885143904
Energy: 0.6534724914570599
Energy: 0.6090498126377647
Energy: 0.6524827622727956
Energy: 0.6453363220096254
Energy: 0.6515268570674805
Energy: 0.6275810752106786
Energy: 0.6230891151564661
Energy: 0.6431576511283095
Energy: 0.6471159750728216
Energy: 0.610462731297921
Energy: 0.6454097454696557
Energy: 0.6274408001576184
Energy: 0.6529552344914845
Energy: 0.6515855050885497
Energy: 0.6608173019358436
Energy: 0.6405616660644038
Energy: 0.6516735465166954
Energy: 0.6577740107954794
Energy: 0.6518089454336744
Energy: 0.6531973514523396
Energy: 0.6263641271628816
Energy: 0.6515240524212151
Energy: 0.6671922277474979
Energy: 0.651822567203819
Energy: 0.6912570608993238
Energy: 0.6524343600399785
Energy: 0.6342045221869307
Energy: 0.620301952379782
Energy: 0.610873354744702
Energy: 0.6474143021993302
Energy: 0.6154950610562179
Energy: 0.6221245410990127
Energy: 0.6223432639827927
Energy: 0.6168746781502666
Energy: 0.6517479055222747
Energy: 0.6317864258480121
Energy: 0.6155777770986045
Energy: 0.6158039286893492
Energy: 0.6146878195748318
Energy: 0.6173822007055492
Energy: 0.6160776703663247
Energy: 0.6153123913885434
Energy: 0.6192372533298344
Energy: 0.6146788243697634
Energy: 0.656952386458287

minimum gb energy = 0.5997522839663708 eV
minimum distance =  2.65379411241392 Angstroms
sigma value = 165


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

Energy: 0.8167086956908618
Energy: 0.5943284037465781
Energy: 0.5935218337990965
Energy: 0.6218956804773043
Energy: 0.587936886617728
Energy: 0.8158295067073261
Energy: 0.5943785691952183
Energy: 0.5933419454443548
Energy: 0.6212649738269401
Energy: 0.5877440073725311
Energy: 0.6167333608100226
Energy: 0.6220935759778715
Energy: 0.6160490310787582
Energy: 0.6147626808380596
Energy: 0.6143355224102923
Energy: 0.617117783321284
Energy: 0.6186389353949495
Energy: 0.6167916161045629
Energy: 0.6155070653104592
Energy: 0.6195723133616247
Energy: 0.6182066369081163
Energy: 0.6401528233633618
Energy: 0.5930245904815197
Energy: 0.6192691765651005
Energy: 0.6314470254210738
Energy: 0.6178663788616617
Energy: 0.5943858940896152
Energy: 0.6194844231259363
Energy: 0.6194106913750173
Energy: 0.630882090579765
Energy: 0.5871557842613373
Energy: 0.6205011802252227
Energy: 0.6172306949753785
Energy: 0.6191465040286489
Energy: 0.6308674978273545
Energy: 0.6391167669762255
Energy: 0.6188017121250557
Energy: 0.61745233129425
Energy: 0.6191485076550775
Energy: 0.6295046895440822
Energy: 0.6243585765891041
Energy: 0.6219332995699254
Energy: 0.6144679654245668
Energy: 0.6145354831425945
Energy: 0.6167274292864445
Energy: 0.6205122054631782
Energy: 0.5904140536797047
Energy: 0.6141556088174558
Energy: 0.6159840020602271
Energy: 0.6172058074268933
Energy: 0.6559590272423534
Energy: 0.6168528014607797
Energy: 0.5937011627642226
Energy: 0.5897677168793445
Energy: 0.5966011176172166
Energy: 0.6566280459388535
Energy: 0.6166278498088527
Energy: 0.5942188540382316
Energy: 0.5889220051384599
Energy: 0.5967937454898733
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Energy: 0.6159041622480905
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Energy: 0.5932777708202174
Energy: 0.621177654831022
Energy: 0.6408038227372823
Energy: 0.5936582590360926
Energy: 0.6211065281316
Energy: 0.592752653107918
Energy: 0.621600499255478
Energy: 0.6311602103107443
Energy: 0.6139118654925962
Energy: 0.6151876032091751
Energy: 0.6145473174706214
Energy: 0.6165496843764158
Energy: 0.5917113675144876
Energy: 0.6137123269729583
Energy: 0.6156837860064717
Energy: 0.6147630718522664
Energy: 0.5892621676844773
Energy: 0.5924891540455832
Energy: 0.6159724744163125
Energy: 0.5933120835865621
Energy: 0.6147753393856608
Energy: 0.614203208331804
Energy: 0.5914539648848374
Energy: 0.596773467601108
Energy: 0.5937219825701385
Energy: 0.6143993234273681
Energy: 0.6301668752187236
Energy: 0.6430517214327581
Energy: 0.6221929991772316
Energy: 0.6194767944881527
Energy: 0.6173666826664778
Energy: 0.615836616535179
Energy: 0.6421238254201045
Energy: 0.6210130317860991
Energy: 0.6181160089183325
Energy: 0.617656006995351
Energy: 0.6165543578271282
Energy: 0.6170843540053743
Energy: 0.6179202015153592
Energy: 0.6191005120413845
Energy: 0.6190704489899631
Energy: 0.6299852488857807
Energy: 0.6199203053268191
Energy: 0.6175368059148587
Energy: 0.6199301818740703
Energy: 0.6400640742903152
Energy: 0.6307941826469484
Energy: 0.6166677870067523
Energy: 0.6141430371613013
Energy: 0.6175246814947083
Energy: 0.6167415798070104
Energy: 0.6274394730083971
Energy: 0.6208214489471822
Energy: 0.6262011693269148
Energy: 0.6174612666037063
Energy: 0.6178799426435371
Energy: 0.6261682873560749
Energy: 0.6659699400281082
Energy: 0.590028074710109
Energy: 0.6148794453030789
Energy: 0.6176916776144374
Energy: 0.5925467075521708
Energy: 0.5906616655249346
Energy: 0.6161049931724106
Energy: 0.6148646678581178
Energy: 0.6179349802749635
Energy: 0.5925797049312828
Energy: 0.6153578984931838
Energy: 0.6212327926455306
Energy: 0.6139582453490418
Energy: 0.5877936760819089
Energy: 0.6143828563600054
Energy: 0.6407288211035709
Energy: 0.6202432326941415
Energy: 0.5959798971055019
Energy: 0.5880526549153196
Energy: 0.6137958598316683
Energy: 0.5883941668524084
Energy: 0.6168458321039286
Energy: 0.6222545366761895
Energy: 0.5938918016983968
Energy: 0.6227101971913971
Energy: 0.6160171607052635
Energy: 0.6158220475703765
Energy: 0.6220926524507961
Energy: 0.5935652420384152
Energy: 0.6223987825980074

minimum gb energy = 0.5871557842613373 eV
minimum distance =  2.66978866204009 Angstroms
sigma value = 41


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

Energy: 0.5659292666468995
Energy: 0.5318325075329761
Energy: 0.5568665806631421
Energy: 0.5378972500917726
Energy: 0.5267433343250248
Energy: 0.5475214260020055
Energy: 0.5297130573410028
Energy: 0.5563293583183662
Energy: 0.5751727957461018
Energy: 0.548912765531374
Energy: 0.5383622399407769
Energy: 0.5848307271976867
Energy: 0.5543517652756709
Energy: 0.5596515536030572
Energy: 0.5359770518826987
Energy: 0.5406302910106756
Energy: 0.5266895962412999
Energy: 0.5639464884746856
Energy: 0.5646045406834909
Energy: 0.5558430438753725
Energy: 0.5401590507072642
Energy: 0.6028037014273278
Energy: 0.5918805566403318
Energy: 0.5511752485425293
Energy: 0.5646549495873108
Energy: 0.5459110625840049
Energy: 0.5412158175599213
Energy: 0.6090826621669994
Energy: 0.5713652725410837
Energy: 0.5683808613165198
Energy: 0.5724170788794567
Energy: 0.5819934147723665
Energy: 0.5836540856333094
Energy: 0.5609306047571291
Energy: 0.6202806410873092
Energy: 0.5811001608357949
Energy: 0.536247547344725
Energy: 0.5436616207071526
Energy: 0.5413953294026175
Energy: 0.626381731562154
Energy: 0.5901410186268509
Energy: 0.581738040431484
Energy: 0.5854886540357656
Energy: 0.578047971283009
Energy: 0.546981511058725
Energy: 0.5713187885784943
Energy: 0.564312043351971
Energy: 0.5416085870874402
Energy: 0.5397857609392687
Energy: 0.6335647789541
Energy: 0.5512967145622163
Energy: 0.5820568840689935
Energy: 0.5574485939106317
Energy: 0.552474001112254
Energy: 0.5647981551914563
Energy: 0.5898040990304221
Energy: 0.5636432512623405
Energy: 0.593185432824602
Energy: 0.5684429063613324
Energy: 0.5487780565310302
Energy: 0.591231381664805
Energy: 0.5919283035740436
Energy: 0.5823800446772308
Energy: 0.5643149119187185
Energy: 0.5795552450590613
Energy: 0.5698756511117959
Energy: 0.5699334178256515
Energy: 0.5569601800911221
Energy: 0.567481120495459
Energy: 0.5615720732791591
Energy: 0.5631090239492099
Energy: 0.5533393539494672
Energy: 0.5705432985797982
Energy: 0.5756473007943245
Energy: 0.5407812645448962
Energy: 0.5609187649174238
Energy: 0.5794017331490664
Energy: 0.568340810870644
Energy: 0.555527882397019
Energy: 0.5753112612517781
Energy: 0.5617729115152852
Energy: 0.5434480960592883
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Energy: 0.5656105454689513
Energy: 0.5790144283132882
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Energy: 0.573295868303412
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Energy: 0.5770523186481954
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Energy: 0.6059194866658568
Energy: 0.5375400174762394
Energy: 0.5377499294052559
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Energy: 0.5689989644334211
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Energy: 0.5615590673255831
Energy: 0.551920352278838
Energy: 0.5625539002069442
Energy: 0.5472657645549031
Energy: 0.5348412687933711
Energy: 0.5793472924807721
Energy: 0.5745208762944496
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Energy: 0.530924561935228
Energy: 0.5783286992628016
Energy: 0.5629298265052916
Energy: 0.5571617076677723
Energy: 0.5256651102656752
Energy: 0.5526458442957869
Energy: 0.5449024281821139
Energy: 0.562200338435289
Energy: 0.5610073928084225
Energy: 0.5259933199487207
Energy: 0.5606755649446324
Energy: 0.5498488516345208
Energy: 0.5285727313379636
Energy: 0.5630149343336149
Energy: 0.5327200592587529
Energy: 0.5385313920176563
Energy: 0.5689457765412145
Energy: 0.5298715834572413
Energy: 0.5654886117135738
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Energy: 0.5412369919411637
Energy: 0.5598443025537796
Energy: 0.5312800521479915
Energy: 0.5663376003655034
Energy: 0.5593558494220506
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Energy: 0.5571688918013848
Energy: 0.5252256486967384
Energy: 0.5756418565880528
Energy: 0.5710148513270376
Energy: 0.5433736477040632
Energy: 0.5666768468059556
Energy: 0.5635972324352951
Energy: 0.5765413182407727
Energy: 0.5649466477983542
Energy: 0.5632806632695229
Energy: 0.5703319293789262
Energy: 0.6162078377616562
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Energy: 0.5653328046201336
Energy: 0.562719955081717
Energy: 0.5994027507286888
Energy: 0.5702730684536615
Energy: 0.5667664171001786
Energy: 0.5638096054541274
Energy: 0.5638776932071105
Energy: 0.566572976054419
Energy: 0.5556806037679904
Energy: 0.5532060419806952
Energy: 0.5638039792602864
Energy: 0.563414835385047
Energy: 0.5545375225393487
Energy: 0.5661964565926433
Energy: 0.5853897218891201
Energy: 0.5735092261495737
Energy: 0.5835873506524347
Energy: 0.5847644543501049
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Energy: 0.574222780140821
Energy: 0.5799528911379552
Energy: 0.5916626145108823
Energy: 0.5791638608553198
Energy: 0.5677275254121281
Energy: 0.5792371654510595
Energy: 0.580626634449764
Energy: 0.6229189941156584
Energy: 0.5811656811455653
Energy: 0.5710844747367265
Energy: 0.5797236039433364
Energy: 0.567128795639216
Energy: 0.6261700100114075
Energy: 0.5855173844856905
Energy: 0.5776779332090508
Energy: 0.5533936365651172
Energy: 0.5878971644295603
Energy: 0.567511241106365
Energy: 0.5848987485419297
Energy: 0.5682954958068613
Energy: 0.5745166601644052
Energy: 0.567892577317144
Energy: 0.5809553507415169
Energy: 0.5701459094988385
Energy: 0.580742705560014
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Energy: 0.5753867392793999
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Energy: 0.5514805318076829
Energy: 0.5814164906401477
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Energy: 0.578350225379846
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Energy: 0.5620448771039408
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Energy: 0.5548429040034424
Energy: 0.526023495755459
Energy: 0.5259824728033834
Energy: 0.5686467048565295
Energy: 0.5384829948815814
Energy: 0.5649909882804738
Energy: 0.5710281545925254
Energy: 0.5694057660393641
Energy: 0.5241627139338222
Energy: 0.5390495250981842
Energy: 0.5573527667813195
Energy: 0.528162082724342
Energy: 0.5271525425720386
Energy: 0.5521323287030462
Energy: 0.5391136878191829
Energy: 0.5565605939787867
Energy: 0.5754288528567262
Energy: 0.5727429919043168
Energy: 0.5661063843578
Energy: 0.5475252850438014
Energy: 0.5684416546932082
Energy: 0.5553579354543611
Energy: 0.5292972827056965
Energy: 0.5256844261312686
Energy: 0.5524043455108872
Energy: 0.5614222915117876
Energy: 0.5640995130453191
Energy: 0.5279254306188749
Energy: 0.5781850879687007
Energy: 0.562212449162797
Energy: 0.5382450605519089
Energy: 0.556057722065105
Energy: 0.5760778523140915
Energy: 0.5468577809138988
Energy: 0.5456578242163607
Energy: 0.5375070275985535
Energy: 0.5526937643896098
Energy: 0.5536936002927754
Energy: 0.563516983429935

minimum gb energy = 0.5241627139338222 eV
minimum distance =  2.68200475556704 Angstroms
sigma value = 185


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

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Energy: 0.41636081341339604
Energy: 0.4130406164552715
Energy: 0.4015723629541945
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Energy: 0.3140550254908645
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Energy: 0.40474074445589564
Energy: 0.3974133613475458
Energy: 0.3345065875259377
Energy: 0.3987770565171232
Energy: 0.4464105175595804
Energy: 0.39865239195812535
Energy: 0.2683042566040749
Energy: 0.2593766335098134
Energy: 0.40812065077910487
Energy: 0.45329382261577167
Energy: 0.4738804369786379
Energy: 0.33532416754561534
Energy: 0.34423807947463536
Energy: 0.40724185118633155
Energy: 0.4215906806018731
Energy: 0.410051672502798
Energy: 0.3902573594682467
Energy: 0.3953622610430584
Energy: 0.41522889181707245
Energy: 0.3943532103928426
Energy: 0.4010051990908904
Energy: 0.40232542976580027
Energy: 0.3963369966286189
Energy: 0.41035083248647686
Energy: 0.40416165074356686
Energy: 0.4022234161260224
Energy: 0.4059450219084648
Energy: 0.39860667895967294
Energy: 0.4914205815507307
Energy: 0.4010332369267385
Energy: 0.397131368577934
Energy: 0.2357339054409362
Energy: 0.39938036226457385
Energy: 0.3941795917339228
Energy: 0.41126924188894354
Energy: 0.4005544716669648

minimum gb energy = 0.22778761536066575 eV
minimum distance =  2.70960554339274 Angstroms
sigma value = 33


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

Energy: 0.5150746859715936
Energy: 0.4872073557718797
Energy: 0.5191007426816001
Energy: 0.5092775933681482
Energy: 0.47752924338309943
Energy: 0.47539448001333556
Energy: 0.4858301214277547
Energy: 0.5035402675858837
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Energy: 0.5082569654422973
Energy: 0.5087825287149105
Energy: 0.4883917085891105
Energy: 0.48859329290594844
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Energy: 0.4955308950520462
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Energy: 0.486839537484612
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Energy: 0.5139156638561582
Energy: 0.4909923559504788

minimum gb energy = 0.4736698240193509 eV
minimum distance =  2.67398392329391 Angstroms
sigma value = 219


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

Energy: 0.645047656669422
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Energy: 0.6425558030512433
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Energy: 0.6424048885984727
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Energy: 0.6407080506373457
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Energy: 0.6390597330737314
Energy: 0.6440836872965362
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Energy: 0.6360042082962131
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Energy: 0.6373295406708478
Energy: 0.6487881515112146
Energy: 0.6419716818283332
Energy: 0.6429791837892973
Energy: 0.641222106985472

minimum gb energy = 0.6344182587825153 eV
minimum distance =  2.67626140506126 Angstroms
sigma value = 15


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

Energy: 1.1173144492169145
Energy: 0.7255295955316389
Energy: 0.7341483924807017
Energy: 0.7312177648923218
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Energy: 0.7352938741243746
Energy: 0.7421438623607278
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Energy: 0.7335992534854692
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Energy: 0.7295561028617046
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Energy: 0.7239770743369367
Energy: 0.7472911725891812
Energy: 0.7440527386871177
Energy: 0.7472694342474043
Energy: 0.7221626321730521
Energy: 0.7233179851385912
Energy: 0.7471440082444674
Energy: 0.7298771331383832
Energy: 0.738891411948601
Energy: 0.7371943837708584
Energy: 0.7427307245856111
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minimum gb energy = 0.7138957275693294 eV
minimum distance =  2.63175338338209 Angstroms
sigma value = 293


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

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Energy: 0.738144667912373
Energy: 0.7211920062800039
Energy: 0.7411810869654857
Energy: 0.7708599656073811
Energy: 0.720893127874298
Energy: 0.7384123402255535
Energy: 0.721176250735063
Energy: 0.7697227872204975
Energy: 0.7705387134174332
Energy: 0.7209724221962726
Energy: 0.7247776539360222
Energy: 0.7220744685945365
Energy: 0.7393920650756037
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Energy: 0.7219537068006511
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Energy: 0.7337467751934149
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Energy: 0.7255057686814589
Energy: 0.7202651709263991
Energy: 0.7218950435369613
Energy: 0.7261888917565015
Energy: 0.7052352739770249
Energy: 0.7268300079351002
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Energy: 0.7222059910856992
Energy: 0.7257400881114573
Energy: 0.729051318377783
Energy: 0.7178266645980546
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Energy: 0.7202494282337012
Energy: 0.7210629822938792
Energy: 0.7182465463223854
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Energy: 0.7354475024243077
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Energy: 0.7173346937554415
Energy: 0.7171736553991356
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Energy: 0.720861498389772
Energy: 0.732914887122196
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Energy: 0.7159958394351682
Energy: 0.7279874828321418
Energy: 0.7189239428084695
Energy: 0.7342092069871864
Energy: 0.7517193385355107
Energy: 0.7295600134861189
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Energy: 0.7404298669397995
Energy: 0.7325590973367281
Energy: 0.7389236092679028
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Energy: 0.736812789250528
Energy: 0.7573993071290261
Energy: 0.7358552004384042
Energy: 0.7328402378465694
Energy: 0.7466448867839045
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Energy: 0.7214033764520121
Energy: 0.7529147103813326
Energy: 0.733015918750243
Energy: 0.7217452851863683
Energy: 0.7448298382630983
Energy: 0.7209966465471854
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Energy: 0.7280579792238396
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Energy: 0.7038231374809721
Energy: 0.7319766418804111
Energy: 0.718718657292198
Energy: 0.7281901400953705
Energy: 0.7110433235998768
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Energy: 0.7298857252742021
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Energy: 0.7343443064939972
Energy: 0.7193386335343045
Energy: 0.7535094119850883
Energy: 0.7263107557239004
Energy: 0.7319228453909121
Energy: 0.7342266826776179
Energy: 0.7202444136763455
Energy: 0.7102958544130533
Energy: 0.7354410595614743
Energy: 0.7306299240814139
Energy: 0.7213123200594617
Energy: 0.7088956151967819
Energy: 0.7263059890337124
Energy: 0.7214303362683565
Energy: 0.740486535463919
Energy: 0.7609847968061081
Energy: 0.7113258386396029
Energy: 0.754109751071631
Energy: 0.7214317019646446
Energy: 0.718594509673684
Energy: 0.7358776369321889
Energy: 0.7300260172345825
Energy: 0.7527537882278913
Energy: 0.7211496392359703
Energy: 0.7188171734083642
Energy: 0.7270684291910486
Energy: 0.7089919895019339
Energy: 0.7342786532735256
Energy: 0.7285875787748974
Energy: 0.7200677688097574
Energy: 0.738258351924059
Energy: 0.7209447970035792
Energy: 0.7341124358127188
Energy: 0.7296908280494284
Energy: 0.7191802768758123
Energy: 0.7292397801810412
Energy: 0.7296209630481092
Energy: 0.734004162413636
Energy: 0.737628811884613
Energy: 0.7279506734276634
Energy: 0.7160192640395078
Energy: 0.7196336855569646
Energy: 0.721423381875981
Energy: 0.7389082204177272
Energy: 0.7270676464071679
Energy: 0.7160059532239762
Energy: 0.7172445066220132
Energy: 0.7208819104115495
Energy: 0.7488970354097472
Energy: 0.7660786251768087
Energy: 0.7210706989498598
Energy: 0.7376180888532815
Energy: 0.7513386285965666
Energy: 0.7504686913707754
Energy: 0.7574915316040736
Energy: 0.7212513106863468
Energy: 0.7379497632146685
Energy: 0.72846613069589
Energy: 0.7510933446647957
Energy: 0.7762216172945784
Energy: 0.7229802549511531
Energy: 0.7376450562213731
Energy: 0.7222661718482608
Energy: 0.7201648274163939
Energy: 0.7755833087613885
Energy: 0.720173219836651
Energy: 0.7382746949665712
Energy: 0.7053265307243486
Energy: 0.7400368206740773
Energy: 0.7209111064387853
Energy: 0.7305583896709039
Energy: 0.7393879551003689
Energy: 0.7290252346755312
Energy: 0.7298737503785332
Energy: 0.7200415967452433
Energy: 0.7308737123322802
Energy: 0.7339152163749816

minimum gb energy = 0.7036435358223961 eV
minimum distance =  2.6415003162232 Angstroms
sigma value = 293


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

Energy: 0.6965488096156761
Energy: 0.708590804161929
Energy: 0.7505008617935368
Energy: 0.7089204912205976
Energy: 0.6966457398896626
Energy: 0.6956781686503856
Energy: 0.7094447373107333
Energy: 0.750031015677056
Energy: 0.7089283117896334
Energy: 0.6958202200478151
Energy: 0.7438989767735784
Energy: 0.7041530291805849
Energy: 0.7036014570709156
Energy: 0.7024083872236146
Energy: 0.7039875890524484
Energy: 0.7431126036207412
Energy: 0.7045857048463136
Energy: 0.696477061404864
Energy: 0.703247303710898
Energy: 0.7106678023777026
Energy: 0.7039880851426009
Energy: 0.7040885046028823
Energy: 0.7056280367390707
Energy: 0.7119397050783218
Energy: 0.7458809511190712
Energy: 0.7033250432964907
Energy: 0.7033584047134485
Energy: 0.7051477282544645
Energy: 0.7511964089805799
Energy: 0.7451237173765376
Energy: 0.7526327242195164
Energy: 0.6954621324519651
Energy: 0.6950514111047938
Energy: 0.7037232708264484
Energy: 0.7530250495540188
Energy: 0.752470740574535
Energy: 0.6960095284312461
Energy: 0.695547870450508
Energy: 0.7036891038640034
Energy: 0.6962151839330112
Energy: 0.7042106806815442
Energy: 0.6971043241581174
Energy: 0.6957507118688854
Energy: 0.7077521574827741
Energy: 0.709386024478806
Energy: 0.7035065655452089
Energy: 0.6968722585544909
Energy: 0.6952668459907467
Energy: 0.7044847345444658
Energy: 0.7045981683248167
Energy: 0.7043555006246647
Energy: 0.7517255525088459
Energy: 0.7097903232672454
Energy: 0.7046082639268821
Energy: 0.6976279320474482
Energy: 0.7044040959558145
Energy: 0.7502922803382867
Energy: 0.7090905218993961
Energy: 0.7062538505481639
Energy: 0.7008425881313525
Energy: 0.7546596340638048
Energy: 0.693361024513099
Energy: 0.7066804504518209
Energy: 0.7047503508505666
Energy: 0.7048884668352892
Energy: 0.7111196368579012
Energy: 0.6921600672355533
Energy: 0.712356485496022
Energy: 0.7045710219956938
Energy: 0.7045464353560543
Energy: 0.7087926764912671
Energy: 0.7436853176747268
Energy: 0.7099007702572755
Energy: 0.6960053824432735
Energy: 0.6980793708513809
Energy: 0.7152224789930742
Energy: 0.7435191847860563
Energy: 0.7086542694154193
Energy: 0.6971400522443009
Energy: 0.6961894961890422
Energy: 0.7045047062553955
Energy: 0.6961883587294533
Energy: 0.7029120214523809
Energy: 0.6950402186165965
Energy: 0.7437139640157162
Energy: 0.7042598091018545
Energy: 0.7029913831803954
Energy: 0.7022752835843687
Energy: 0.6948930348751855
Energy: 0.7484180917679464
Energy: 0.7066794534984082
Energy: 0.705974578974851
Energy: 0.7437521726808154
Energy: 0.7529109331058177
Energy: 0.7076268486734564
Energy: 0.7117313512718368
Energy: 0.7081543157190939
Energy: 0.7447316180242205
Energy: 0.7149926522730241
Energy: 0.7041919145564269
Energy: 0.6954824300310021
Energy: 0.7113126211491732
Energy: 0.7059055379572983
Energy: 0.7111672174657504
Energy: 0.7468521603166474
Energy: 0.6955546052651921
Energy: 0.7124860335921598
Energy: 0.6919345111983102
Energy: 0.752341297848846
Energy: 0.7470009033006775
Energy: 0.6965442729451224
Energy: 0.7086490728748545
Energy: 0.749768695139014
Energy: 0.7088629375381454
Energy: 0.6962751198220659
Energy: 0.6962561909322603
Energy: 0.7091232015590583
Energy: 0.7509834152287346
Energy: 0.7087217487063581
Energy: 0.6960438654383199
Energy: 0.7435436498266433
Energy: 0.7046132589514987
Energy: 0.7033366451381025
Energy: 0.7030242531889048
Energy: 0.7038424630892529
Energy: 0.7436764837291494
Energy: 0.7044727607114449
Energy: 0.6960940625919605
Energy: 0.7035279463792798
Energy: 0.7121316147780414
Energy: 0.704001013919201
Energy: 0.7042304174912493
Energy: 0.7060214874112253
Energy: 0.7505086992383168
Energy: 0.745473311578682
Energy: 0.7032079219411362
Energy: 0.7045057982366968
Energy: 0.7050126358609414
Energy: 0.7503999858039055
Energy: 0.7450373959435856
Energy: 0.7530999729736155
Energy: 0.6955823225298459
Energy: 0.6951365519789239
Energy: 0.7037336356377112
Energy: 0.7529886335403702
Energy: 0.7524543881139484
Energy: 0.6960041204087891
Energy: 0.6954309744169692
Energy: 0.7034390211289033
Energy: 0.7454082723820564
Energy: 0.7043928998385468
Energy: 0.697107457493077
Energy: 0.6958287295680572
Energy: 0.7055570016522905
Energy: 0.7096557240129809
Energy: 0.7034485291509847
Energy: 0.6958075190688282
Energy: 0.6953761807327369
Energy: 0.7050411041163529
Energy: 0.7045882810281718
Energy: 0.7042359174251172
Energy: 0.7517322360969605
Energy: 0.7097125216349593
Energy: 0.7041358102154315
Energy: 0.696738706413274
Energy: 0.7044916596598204
Energy: 0.7508712286867291
Energy: 0.7089634079893876
Energy: 0.7047815948798292
Energy: 0.7009917622754243
Energy: 0.7524166469222066
Energy: 0.6933081350059374
Energy: 0.7088271342681939
Energy: 0.7048455051461244
Energy: 0.7058306391142191
Energy: 0.7538387762355732
Energy: 0.6920685752791995
Energy: 0.7125853562834075
Energy: 0.7044599370797003
Energy: 0.7047870463388382
Energy: 0.7161784712846236
Energy: 0.7429337783126639
Energy: 0.7129219831829116
Energy: 0.6957345273069656
Energy: 0.697559216539631
Energy: 0.7247522071579405
Energy: 0.7423186058496649
Energy: 0.7095330082923339
Energy: 0.6971322351058821
Energy: 0.6962069333088674
Energy: 0.7048093542985223
Energy: 0.6962009067012594
Energy: 0.7023059834744683
Energy: 0.6951765092949381
Energy: 0.7452970230918994
Energy: 0.7046100122954565
Energy: 0.7030806869111161
Energy: 0.7024791377478437
Energy: 0.6951576490482176
Energy: 0.7053484044256944
Energy: 0.7058247957704327
Energy: 0.7056186336109131
Energy: 0.7426323653576434
Energy: 0.7542410340655079
Energy: 0.7072689459594577
Energy: 0.7086509836172648
Energy: 0.7078777098810489
Energy: 0.7444589237105399
Energy: 0.716180890251963
Energy: 0.7045249700265378
Energy: 0.6953339333740696
Energy: 0.7111881233801931
Energy: 0.7058699911974107
Energy: 0.7095847726281737
Energy: 0.7460291340776528
Energy: 0.6954366103252121
Energy: 0.7121997106837842
Energy: 0.6917364411082627
Energy: 0.7102314916160232
Energy: 0.7462528132885348

minimum gb energy = 0.6917364411082627 eV
minimum distance =  2.66987701745593 Angstroms
sigma value = 15


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

Energy: 1.2293728815481086
Energy: 0.7756803713965353
Energy: 0.742874813153012
Energy: 0.6953375777701137
Energy: 0.7264756115290976
Energy: 0.6971181259537358
Energy: 0.7663886834494699
Energy: 0.7486657860095688
Energy: 0.7047754135759345
Energy: 0.7767225775391353
Energy: 0.6977165209165176
Energy: 0.7352476417552876
Energy: 0.7218737609270612
Energy: 0.7221746004942025
Energy: 0.7268360532866626
Energy: 0.6825428380835222
Energy: 0.7459157458859225
Energy: 0.7217924414171635
Energy: 0.7454150449874527
Energy: 0.6990772008971461
Energy: 0.7779307737209102
Energy: 0.7255715196622057
Energy: 0.7444986136138948
Energy: 0.7398614075252504
Energy: 0.7064976095143327
Energy: 0.780953343436796
Energy: 0.7361544513909872
Energy: 0.6940689170202987
Energy: 0.7307203485048197
Energy: 0.7964395035774775
Energy: 0.7320289018634112
Energy: 0.6959842256544767
Energy: 0.7414115111400768
Energy: 0.785294983557806
Energy: 0.8024946614124148
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Energy: 0.6913755795170713
Energy: 0.7416779498397423
Energy: 0.7978036258217898
Energy: 0.7972077803159644
Energy: 0.8028159522913414
Energy: 0.7232817310218308
Energy: 0.6902894952382657
Energy: 0.6950015918569711
Energy: 0.682041182237048
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Energy: 0.7636269837792727
Energy: 0.7175301636492989
Energy: 0.6953162402075567
Energy: 0.6800552816560235
Energy: 0.6805572801871701
Energy: 0.6946001196751104
Energy: 0.6952595077898115
Energy: 0.7630026202843272
Energy: 0.852240485145586
Energy: 0.6991490283429272
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Energy: 0.6951226088783813
Energy: 0.8088453242140782
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Energy: 0.6970036183268519
Energy: 0.6953633464547933
Energy: 0.6955061437812669
Energy: 0.7047818009709104
Energy: 0.7434322839269112
Energy: 0.6963418037739422
Energy: 0.6948099824041181
Energy: 0.6950533703079645
Energy: 0.6993604014261682
Energy: 0.7782660992599548
Energy: 0.6972716467717693
Energy: 0.697546961569569
Energy: 0.7005559444091155
Energy: 0.6913180029865876
Energy: 0.7735282526378794
Energy: 0.6964220324068733
Energy: 0.6954844714168124
Energy: 0.7251591573816882
Energy: 0.7443609396466162
Energy: 0.7306036713673787
Energy: 0.6979875113839297
Energy: 0.8508280750544761
Energy: 0.7464415304574127
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Energy: 0.7000473288906598
Energy: 0.6976457859662809
Energy: 0.8548050233412731
Energy: 0.7300595601886843
Energy: 0.7802125669542078
Energy: 0.7002038469134332
Energy: 0.7515993375101352
Energy: 0.6969080246506915
Energy: 0.7051118982567055
Energy: 0.7031342283171573
Energy: 0.7041647361581052
Energy: 0.7104125007879906
Energy: 0.6977813192789787
Energy: 0.7082225953336364
Energy: 0.7123635120862581
Energy: 0.7083589292458928
Energy: 0.7419524738673843
Energy: 0.7013424941562271
Energy: 0.7024836581637295
Energy: 0.7024976943829728
Energy: 0.7031826720506001
Energy: 0.7400721872716958
Energy: 0.711215691890805
Energy: 0.7036430966069507
Energy: 0.7069713018245575
Energy: 0.7074434682875385
Energy: 0.8187233314197615
Energy: 0.7390979754488555
Energy: 0.702711633614854
Energy: 0.6832042948133148
Energy: 0.7789734730745431
Energy: 0.8102560894456433
Energy: 0.7517125612849462
Energy: 0.683690503683743
Energy: 0.6834603695678636
Energy: 0.7370912330429468
Energy: 0.7570356882369764
Energy: 0.7304600014691383
Energy: 0.7196643754838639
Energy: 0.6981653277747997
Energy: 0.7343189559743996
Energy: 0.742402408653833
Energy: 0.7185767285354173
Energy: 0.7009066397177697
Energy: 0.7013653316501516
Energy: 0.7697925982515865
Energy: 0.7259982632730636
Energy: 0.7416357107286489
Energy: 0.7784733373787688
Energy: 0.7431031860434147
Energy: 0.7352811766867127
Energy: 0.7248324015398395
Energy: 0.7430188205521434
Energy: 0.6754000063100268
Energy: 0.7456901350175725
Energy: 0.7350635014127859
Energy: 0.6980604259094326
Energy: 0.7406343947354975
Energy: 0.7995711791236852
Energy: 0.7207722854793883
Energy: 0.7297575134947242
Energy: 0.6984298126821027
Energy: 0.7586742714518214
Energy: 0.8032993762888487
Energy: 0.7102331013084224
Energy: 0.7342672059189498
Energy: 0.7335006038688849
Energy: 0.8005600646050595
Energy: 0.7041904546870603
Energy: 0.7428352282030933
Energy: 0.7444193940861356
Energy: 0.7863189961299499
Energy: 0.8050043713394928
Energy: 0.7085526850403644
Energy: 0.7442610524587105
Energy: 0.697575180958087
Energy: 0.685188629302475
Energy: 0.7401281234431546
Energy: 0.8412211235304663
Energy: 0.8042600450810516
Energy: 0.7702546750744317
Energy: 0.6861334758632655
Energy: 0.7564324538158392
Energy: 0.8183907888783548
Energy: 0.7844721483423973
Energy: 0.7714283627898557
Energy: 0.7320459875162428
Energy: 0.8236688185547305
Energy: 0.8280288102189748
Energy: 0.7240824517720411
Energy: 0.6969958207051127
Energy: 0.7386600396726617
Energy: 0.8240291895230731
Energy: 0.8271876678059931
Energy: 0.7008182257044732
Energy: 0.6963953082942436
Energy: 0.6980587812550278
Energy: 0.731090080137886
Energy: 0.7108432519145264
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Energy: 0.6976577820785829
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Energy: 0.7214887772559568
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Energy: 0.8295694593600774
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Energy: 0.8128275864993433
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Energy: 0.6966230714773574
Energy: 0.6991727567642347
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Energy: 0.7083597576661605
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Energy: 0.7230960706081543
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Energy: 0.6811965114456169
Energy: 0.7283144806236248
Energy: 0.7092691636625807
Energy: 0.708434543285568
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Energy: 0.6815409456066636
Energy: 0.6906758345746302
Energy: 0.7051706246038892
Energy: 0.705014959763618
Energy: 0.7387989801799343
Energy: 0.7177963674684251
Energy: 0.7030756141105442
Energy: 0.7086155245822877
Energy: 0.7076408553313355
Energy: 0.7400860284140716
Energy: 0.7092420117564951
Energy: 0.7022917981235626
Energy: 0.7049446515608863
Energy: 0.7037429643939661
Energy: 0.8183719207505094
Energy: 0.7424775903409039
Energy: 0.6832989475881394
Energy: 0.6832951569249027
Energy: 0.7361651338555091
Energy: 0.8086667578158785
Energy: 0.7451255733977472
Energy: 0.6921567386640455
Energy: 0.6902030716229034
Energy: 0.7368928168847008
Energy: 0.7408064312478289
Energy: 0.6840185884583874
Energy: 0.7002584044851181
Energy: 0.699739797936723
Energy: 0.7390790119983272
Energy: 0.7421942954030302
Energy: 0.6949961824494084
Energy: 0.698078298758624
Energy: 0.6995474635227925
Energy: 0.7517062436599955
Energy: 0.7233473092363036
Energy: 0.7527379199292289
Energy: 0.7668606757681093
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Energy: 0.6977219982259157
Energy: 0.7217753880603084
Energy: 0.7537228618018805
Energy: 0.7029171548379005
Energy: 0.7083531448364015
Energy: 0.7116445933681953
Energy: 0.7200527846012647
Energy: 0.7422779135319576
Energy: 0.8029666238678006
Energy: 0.7107279881497951
Energy: 0.7309858433306158
Energy: 0.6990984909839595
Energy: 0.7373529576100536
Energy: 0.7995729734933364
Energy: 0.7192201341328162
Energy: 0.7331564214132114
Energy: 0.8195813120484452
Energy: 0.8030612666554401
Energy: 0.8049823091818142
Energy: 0.8011017668899303
Energy: 0.7193275319738167
Energy: 0.785108655345658
Energy: 0.7999354144660151
Energy: 0.8063661933637681
Energy: 0.8004131519186296
Energy: 0.6844181532944842
Energy: 0.6858381537498093
Energy: 0.7873533901691093
Energy: 0.7249790891597089
Energy: 0.7880428518116047
Energy: 0.7760241091800592
Energy: 0.6862609445269866
Energy: 0.7876444171422945
Energy: 0.7313366575449392
Energy: 0.7876459305785479
Energy: 0.746991945073028
Energy: 0.7409213509806128
Energy: 0.8252006838945175
Energy: 0.8252766073663813
Energy: 0.733250991405756
Energy: 0.6958084447188364
Energy: 0.7595295527401577
Energy: 0.8254610309164249
Energy: 0.8243413878139079
Energy: 0.7446563225736171
Energy: 0.6951260442821074
Energy: 0.6969722074178941
Energy: 0.7869263167523012
Energy: 0.6986577791909919
Energy: 0.6963875031851763
Energy: 0.6987404899968197
Energy: 0.6981903906907961
Energy: 0.8055122950926394
Energy: 0.6980242878092471
Energy: 0.6988283033592582
Energy: 0.6993010257840245
Energy: 0.7009985671554032
Energy: 0.7681260674168808
Energy: 0.7143049624911451
Energy: 0.6946101769752688
Energy: 0.6954851010725426
Energy: 0.6997656173223232
Energy: 0.7680570788331614
Energy: 0.7209723805641616
Energy: 0.6947824982515303
Energy: 0.6954897239194158
Energy: 0.735787008096594
Energy: 0.6916302118789691
Energy: 0.7072408581688581
Energy: 0.698640259620338
Energy: 0.7269159750079826
Energy: 0.7131175501439053
Energy: 0.6912944518652804
Energy: 0.7012748855654698
Energy: 0.7124862310265426
Energy: 0.7405929594796017
Energy: 0.6974268452221214
Energy: 0.6967270086598544
Energy: 0.7324273917124414
Energy: 0.8534110882324325
Energy: 0.6976225377868985
Energy: 0.6943355322759848
Energy: 0.7052086345072881
Energy: 0.7331890319177475
Energy: 0.8559068149142722
Energy: 0.6981686607175479
Energy: 0.7004148219796184
Energy: 0.6975457923120102
Energy: 0.6996690254706152
Energy: 0.6958342693554996
Energy: 0.7052745835798546
Energy: 0.7071966374883112
Energy: 0.7069118183743073
Energy: 0.7079762016813819
Energy: 0.7196240458929336
Energy: 0.7028522432385014
Energy: 0.700757866556759
Energy: 0.6866810201628007
Energy: 0.8072456072560092
Energy: 0.8052530615466297
Energy: 0.7196548450092936
Energy: 0.6833417070658728
Energy: 0.7177902268145143
Energy: 0.8080562651238352
Energy: 0.7454940875498229
Energy: 0.7167515956394424
Energy: 0.6979429933692648
Energy: 0.7578732533202256
Energy: 0.744680711514505
Energy: 0.6950926839187843
Energy: 0.6759290248571187
Energy: 0.6988683236864093
Energy: 0.7412273590553361
Energy: 0.7870730522575181
Energy: 0.6959790472794678
Energy: 0.6835848161307542

minimum gb energy = 0.6754000063100268 eV
minimum distance =  2.62549156948896 Angstroms
sigma value = 437


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

Energy: 0.969195715180278
Energy: 0.6787410957722855
Energy: 0.7224686251985218
Energy: 0.6906901938683259
Energy: 0.6530654263788432
Energy: 0.6933147828918466
Energy: 0.6802665411657056
Energy: 0.7216798621096185
Energy: 0.6467467491201558
Energy: 0.6629087317861364
Energy: 0.6413123427592207
Energy: 0.7337967706275433
Energy: 0.642289480741946
Energy: 0.7748021437497311
Energy: 0.6594143395982456
Energy: 0.6406440634916611
Energy: 0.6890808584533505
Energy: 0.6425181485982449
Energy: 0.7332236791110568
Energy: 0.6586155093716812
Energy: 0.7109474060459092
Energy: 0.719116752776171
Energy: 0.7320804389579706
Energy: 0.6605321976071523
Energy: 0.644053439651901
Energy: 0.7112224382186846
Energy: 0.7200430568133465
Energy: 0.7324725595404736
Energy: 0.6596486353722245
Energy: 0.7115835587551883
Energy: 0.6591554509386123
Energy: 0.6616584520286544
Energy: 0.7292997251763014
Energy: 0.7092059313053253
Energy: 0.7113628386656374
Energy: 0.6598211180580987
Energy: 0.6595343424395483
Energy: 0.7296366901820918
Energy: 0.7090422946605628
Energy: 0.6410242402604895
Energy: 0.6509913653039379
Energy: 0.6818507203193696
Energy: 0.6576744487735999
Energy: 0.6598396300458463
Energy: 0.6926565540669264
Energy: 0.6556796727603051
Energy: 0.7353260417626104
Energy: 0.6582451767888979
Energy: 0.6578544743475214
Energy: 0.6379584724577856
Energy: 0.6740273884239224
Energy: 0.6599331725190821
Energy: 0.6394526820334864
Energy: 0.6582322683775262
Energy: 0.6890512706460852
Energy: 0.6743552119052644
Energy: 0.659478272070801
Energy: 0.6393481667773787
Energy: 0.6584610895879481
Energy: 0.6895439897315369
Energy: 0.7130952805321333
Energy: 0.7068999703143672
Energy: 0.7084929085269531
Energy: 0.6602577636993857
Energy: 0.6671549645311652
Energy: 0.7109050324952318
Energy: 0.7071237291961697
Energy: 0.707710927218601
Energy: 0.6602108562041542
Energy: 0.6678802706635802
Energy: 0.718625737916459
Energy: 0.7076306663081406
Energy: 0.6592480103951831
Energy: 0.6572926231842552
Energy: 0.7334889590551629
Energy: 0.7187296427206745
Energy: 0.7077930274810589
Energy: 0.6594052214118454
Energy: 0.65753699528762
Energy: 0.7336773462511359
Energy: 0.6582758667507346
Energy: 0.7289586315709278
Energy: 0.6780415040084175
Energy: 0.7329044816101462
Energy: 0.6591675093322216
Energy: 0.657473209424833
Energy: 0.7289157872771957
Energy: 0.6783973919948456
Energy: 0.6666614966507962
Energy: 0.6583377520742422
Energy: 0.6416013041675019
Energy: 0.6574451410620923
Energy: 0.6426092933107296
Energy: 0.6408218836804048
Energy: 0.681214481408342
Energy: 0.7107740124288716
Energy: 0.661198333305506
Energy: 0.6430825300337442
Energy: 0.6411164193195401
Energy: 0.6800879804791863
Energy: 0.6415317981968187
Energy: 0.6398358889156747
Energy: 0.6444073713043297
Energy: 0.6893039148092501
Energy: 0.6389507943231001
Energy: 0.6412311555688456
Energy: 0.639632713687795
Energy: 0.6781977397942514
Energy: 0.6893664533294281
Energy: 0.6619042595229792
Energy: 0.6407622852894025
Energy: 0.642311882014663
Energy: 0.6426501636214276
Energy: 0.7154692132595998
Energy: 0.6416074991024875
Energy: 0.6413864315805784
Energy: 0.6434384413765025
Energy: 0.642800757728841
Energy: 0.7410405709654101
Energy: 0.6408137112465391
Energy: 0.6409899736270294
Energy: 0.6417847930125669
Energy: 0.6719687836151766
Energy: 0.7311136141202724
Energy: 0.640811508932409
Energy: 0.6412014013857422
Energy: 0.6422866702593457
Energy: 0.6715436091540156
Energy: 0.7306528921465013
Energy: 0.640782833571029
Energy: 0.6398438025729757
Energy: 0.6455133025307626
Energy: 0.7637615275322004
Energy: 0.6453618262447233
Energy: 0.6425323602619183
Energy: 0.6729911092361841
Energy: 0.6429817338561344
Energy: 0.7988572381206782
Energy: 0.6451558961276205
Energy: 0.6727875311543443

minimum gb energy = 0.6379584724577856 eV
minimum distance =  2.69233598155437 Angstroms
sigma value = 33