Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.0501993894577035
cohesive_energy=3.5802841752733885
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=[2.12357297600262e-19, 2.8429823282013e-19, 3.3137498885695197e-19, 3.69139894296966e-19, 4.0317012600312595e-19, 4.3350093186138e-19, 4.590892948829939e-19, 4.799672586006479e-19, 4.96905469975296e-19, 5.107242434435459e-19, 5.220852779552399e-19, 5.31483646090284e-19, 5.393070745941059e-19, 5.458631813804339e-19, 5.51403508180806e-19, 5.56126724897838e-19, 5.60186640488394e-19, 5.636825899037819e-19, 5.66662638443022e-19, 5.69131592636016e-19, 5.710750328930579e-19, 5.724705287412719e-19, 5.73305262767586e-19, 5.735792349719999e-19, 5.7328763882461195e-19, 5.72364785083428e-19, 5.7076741497933e-19, 5.68489119805782e-19, 5.65142172817356e-19, 5.603084059125779e-19, 5.5382439707478e-19, 5.455203155807579e-19, 5.352135132942359e-19, 5.22684492016356e-19, 5.07651268659534e-19, 4.89726116478342e-19, 4.68341864944344e-19, 4.426493604415199e-19, 4.1143094872803e-19, 3.73036387870854e-19, 3.2537323518598797e-19, 2.6584916887962e-19, 1.9120696385482797e-19, 9.712635081803099e-20, -2.256665788989e-20, -1.7674091102644197e-19, -3.7763944134033597e-19, -6.432723163743659e-19, -1.0025347917227218e-18, -1.502623786669776e-18, -2.23665460283034e-18, -3.3806567848053597e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.012446087153028019
Energy: 0.05607877225245411
Energy: 0.05563250706073002
Energy: 0.056027003701355736
Energy: 0.012992609054272727
Energy: 0.013255016781035413
Energy: 0.05572683511917429
Energy: 0.05573883284650365
Energy: 0.05601900104352674
Energy: 0.012959479999930103
Energy: 0.05612749743632742
Energy: 0.055587967833324946
Energy: 0.05707929403653471
Energy: 0.055541424351381714
Energy: 0.055746096556526424
Energy: 0.05614219698135102
Energy: 0.05580042452378421
Energy: 0.05712469086026356
Energy: 0.05568157453081599
Energy: 0.055838055373306134
Energy: 0.05536002455021707
Energy: 0.012867156298486308
Energy: 0.012752411614035663
Energy: 0.055841719137571286
Energy: 0.0557755578478776
Energy: 0.056669358556670144
Energy: 0.012927285378760731
Energy: 0.012735985792950896
Energy: 0.055790249860441746
Energy: 0.055983865438286026
Energy: 0.055515832888982646
Energy: 0.012790294512445363
Energy: 0.012757375496155583
Energy: 0.05543704016418698
Energy: 0.056010431932362034
Energy: 0.055530898910565805
Energy: 0.012870630209409876
Energy: 0.01275844801674186
Energy: 0.055456907102965206
Energy: 0.05588682140776924
Energy: 0.055618912300068706
Energy: 0.05625083304997936
Energy: 0.05543560528432538
Energy: 0.012892727633699575
Energy: 0.012788116596282213
Energy: 0.05545964499783975
Energy: 0.05625115793699033
Energy: 0.05546790334415435
Energy: 0.012940545206052263
Energy: 0.055698686108753885
Energy: 0.055434354938819985
Energy: 0.055645174705362725
Energy: 0.05573733147882742
Energy: 0.012743154762776465
Energy: 0.012924106997416567
Energy: 0.055555367525267074
Energy: 0.3844240170295326
Energy: 0.05585013424124278
Energy: 0.012785196935313875
Energy: 0.01290777810466885
Energy: 0.013032169144736894
Energy: 0.0557159519865494
Energy: 0.05554417415496921
Energy: 0.056277469531056466
Energy: 0.0555202132258998
Energy: 0.013060444010400954
Energy: 0.05580625166421999
Energy: 0.05562989690305589
Energy: 0.05640887776302654
Energy: 0.05554181350815317

minimum gb energy = 0.012446087153028019 eV
minimum distance =  2.83123798277968 Angstroms
sigma value = 3


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

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Energy: 0.33785670502890136
Energy: 0.3327768905812908
Energy: 0.3324725386130415
Energy: 0.34933093595659237
Energy: 0.45739137554609927
Energy: 0.34311052184443086
Energy: 0.33316470937782794
Energy: 0.3332942695199271
Energy: 0.3383735469664426
Energy: 0.29733172213552295
Energy: 0.3724125057685775
Energy: 0.3347068686047519
Energy: 0.3405615616505217
Energy: 0.30248498211581676
Energy: 0.31552151525206107
Energy: 0.36447358914155925
Energy: 0.37256069806306563
Energy: 0.3412473064725
Energy: 0.31810535819726865
Energy: 0.32463941550182573
Energy: 0.347571969530738
Energy: 0.2868923059847675
Energy: 0.3143729617248945
Energy: 0.28702880497685573
Energy: 0.28645736419792067
Energy: 0.3482468141871318
Energy: 0.34004742885247585
Energy: 0.28590211951779715
Energy: 0.34340620151394263
Energy: 0.28503109918786146
Energy: 0.3371681736446321
Energy: 0.2987049463246692
Energy: 0.2885424540390212
Energy: 0.2588110690032982
Energy: 0.284828176366437
Energy: 0.3464018843836328
Energy: 0.3397950117786514
Energy: 0.3189126258783041
Energy: 0.31047264015375703
Energy: 0.3567001059591361
Energy: 0.39869499172914435
Energy: 0.3510697705202176
Energy: 0.3057837813588004
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Energy: 0.35751886873059097
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Energy: 0.35256577095933034
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Energy: 0.2936539880121896
Energy: 0.3516144290004151
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Energy: 0.358875906076083
Energy: 0.3079239690291215
Energy: 0.3402078736657703
Energy: 0.352138751001665
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Energy: 0.2810554634193818
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Energy: 0.3536178555881721
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Energy: 0.3560761470745398
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Energy: 0.36040656592785525
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Energy: 0.3459749015377835
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Energy: 0.33864896425786034
Energy: 0.3738495954243888
Energy: 0.25939795963708867
Energy: 0.317013016109773
Energy: 0.35546918764613405
Energy: 0.3628780145572019
Energy: 0.36774944036225865
Energy: 0.39444697667793144
Energy: 0.3480659963095235
Energy: 0.35028252427854445
Energy: 0.34689964106189536
Energy: 0.34385909953548427
Energy: 0.39471863223199105
Energy: 0.3464496005249005
Energy: 0.3503202859890813
Energy: 0.3495136156626533
Energy: 0.3436768154994302
Energy: 0.28175171563141155
Energy: 0.37579444011962493
Energy: 0.3533764369069587
Energy: 0.35735606860312324
Energy: 0.31038838061576274
Energy: 0.2819167581169182
Energy: 0.3572003187366371
Energy: 0.3928653287635934
Energy: 0.3583281488967402
Energy: 0.2611763649478877
Energy: 0.31451556453285234
Energy: 0.3470864583043401
Energy: 0.28657599937918654
Energy: 0.31228762244534636
Energy: 0.3048843287387822
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Energy: 0.3473796784929746
Energy: 0.28801426155664694
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Energy: 0.3511728109984549
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Energy: 0.3510682084384569
Energy: 0.365917018784331
Energy: 0.3856223101934118
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Energy: 0.4038404606868614
Energy: 0.35754453439593287
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Energy: 0.28537594581501
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Energy: 0.3766657465273785
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Energy: 0.28127341288948177
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Energy: 0.37112549050158966
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Energy: 0.3663597106686776
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Energy: 0.3525726200768289
Energy: 0.3567075682874087
Energy: 0.31667134734013197
Energy: 0.2752323443035045
Energy: 0.36434090080502
Energy: 0.35018361316828184
Energy: 0.35519322225160693
Energy: 0.316512494132613
Energy: 0.2978078423595028
Energy: 0.3669035362856879
Energy: 0.34827924942445276
Energy: 0.3214759363096703
Energy: 0.31001311045368146
Energy: 0.2885633099943104
Energy: 0.3124745510250856
Energy: 0.2929495304976128
Energy: 0.3235038852560859
Energy: 0.2893066458317925
Energy: 0.3042723488179108
Energy: 0.3193411663539897
Energy: 0.2982189989963012
Energy: 0.3124707780065715
Energy: 0.29039718827192124
Energy: 0.2832171791395782
Energy: 0.2896663606027754
Energy: 0.30290429323046897
Energy: 0.3131379676564618
Energy: 0.304226147299861
Energy: 0.28357566892189
Energy: 0.3175680808100048
Energy: 0.29731712530449883
Energy: 0.3772728381718794
Energy: 0.28423855165712253
Energy: 0.2861909964586317
Energy: 0.34031701770519135
Energy: 0.3295116805313685
Energy: 0.3839413833531551
Energy: 0.26372896086008984
Energy: 0.29893278454922845
Energy: 0.35484233336788423
Energy: 0.33157138528632646
Energy: 0.3789620016896064
Energy: 0.3853308988526309
Energy: 0.33505371628512903
Energy: 0.33117115174119516
Energy: 0.35057932120006247
Energy: 0.3373131379557412
Energy: 0.40137054153343915
Energy: 0.3344132769571105
Energy: 0.39156986666517996
Energy: 0.3502212160764681
Energy: 0.3181932397459099
Energy: 0.3221412489190411
Energy: 0.3376133071611292
Energy: 0.3746123617947517
Energy: 0.37062138204876227
Energy: 0.2867583786919429
Energy: 0.30127490889580005
Energy: 0.33847775096667804
Energy: 0.37866462447260985
Energy: 0.36900311840641287
Energy: 0.3821594974839346
Energy: 0.3390776129942502
Energy: 0.3340340414862619
Energy: 0.33412489013307656
Energy: 0.3461551335509817
Energy: 0.4049646856248619
Energy: 0.34929369468929017
Energy: 0.33336210714166903
Energy: 0.3341696058406902
Energy: 0.3487667277257808

minimum gb energy = 0.2588110690032982 eV
minimum distance =  2.55854841231871 Angstroms
sigma value = 75


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

Energy: 0.7171022827941428
Energy: 0.3008546141270776
Energy: 0.3121535781377785
Energy: 0.3584744383857356
Energy: 0.30105876459335057
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Energy: 0.30707100999891596
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Energy: 0.30441108393093264
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Energy: 0.2948929697765448
Energy: 0.374760527755311
Energy: 0.32965900395359554
Energy: 0.3178859776971555
Energy: 0.3110099134732151
Energy: 0.30938018195789174
Energy: 0.31837334524911215
Energy: 0.3029409609101319
Energy: 0.2867443260437612
Energy: 0.31605982899792284
Energy: 0.3163603319396082
Energy: 0.3138380167307929
Energy: 0.2872938091423718
Energy: 0.348057104955336
Energy: 0.32171551040995455
Energy: 0.35211131787975825
Energy: 0.30755823277507016
Energy: 0.3523001987140788
Energy: 0.37260866972988943
Energy: 0.29741265987099075
Energy: 0.34146675566506046
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minimum gb energy = 0.28515437300665447 eV
minimum distance =  2.54042425197746 Angstroms
sigma value = 105


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

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Energy: 0.307995907030455
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Energy: 0.3181690673992442
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Energy: 0.3487982818382602
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Energy: 0.3369407912803058
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Energy: 0.298565287429059
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Energy: 0.30967667325154724
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Energy: 0.3603608652608719
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Energy: 0.31459696529659875
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Energy: 0.34041992623169026
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Energy: 0.36704441573691854
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Energy: 0.3313304454575156
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Energy: 0.3466447212450296
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Energy: 0.3299823523701376
Energy: 0.316352173981525
Energy: 0.3461817950815865
Energy: 0.3456227664501792
Energy: 0.3525758884815275
Energy: 0.3234833703915024
Energy: 0.33124369590701996
Energy: 0.3423587212196628
Energy: 0.32970986219891607
Energy: 0.3314781613736524
Energy: 0.3227740401093342
Energy: 0.32961382603428135
Energy: 0.35259498108328946
Energy: 0.33340932685876956
Energy: 0.3422682250303285
Energy: 0.3332587265196289
Energy: 0.34090208486588797
Energy: 0.3328845677647166
Energy: 0.3382810617339791
Energy: 0.3385256167891428
Energy: 0.32384288216033824
Energy: 0.33589512675400557
Energy: 0.31128708881983824
Energy: 0.3468268235231455
Energy: 0.3288618137556952
Energy: 0.333961341215095
Energy: 0.33620876288736895
Energy: 0.3134158149321312
Energy: 0.3408991383970193
Energy: 0.32534413402374196
Energy: 0.3297456186125444
Energy: 0.3337677692120026
Energy: 0.32912213841821314
Energy: 0.35768050061413914
Energy: 0.31256375922803303
Energy: 0.3446646875852991
Energy: 0.34815861175358226
Energy: 0.3146292198930984
Energy: 0.3561832111701932
Energy: 0.31345266938351934
Energy: 0.34586199819680635
Energy: 0.354893409831313
Energy: 0.34308048389097834
Energy: 0.34976351989633214
Energy: 0.3483468688789081
Energy: 0.3457236459317045
Energy: 0.3283835006960034
Energy: 0.3327127212759917
Energy: 0.34892118569813585
Energy: 0.34716478427443587
Energy: 0.35665310997933386
Energy: 0.3283677022806413
Energy: 0.33954095053388217
Energy: 0.3323333206622075
Energy: 0.356246061933476
Energy: 0.30370099855696286
Energy: 0.299694459785509
Energy: 0.34817421658412523
Energy: 0.3193555742943801
Energy: 0.35525596990741054
Energy: 0.3093731026928051
Energy: 0.3050537177741242
Energy: 0.36480080432920875
Energy: 0.35462783341467674
Energy: 0.31588708915827
Energy: 0.3143589275274792
Energy: 0.30737152460769246
Energy: 0.31639093122650175
Energy: 0.3127323824657904
Energy: 0.3076519072347799
Energy: 0.3079056162097353
Energy: 0.3067873505113831
Energy: 0.3440755279064669

minimum gb energy = 0.29182510197032374 eV
minimum distance =  2.53294367391357 Angstroms
sigma value = 165


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

Energy: 0.4315801256054069
Energy: 0.31807481460627285
Energy: 0.2913527065798976
Energy: 0.3159017252318142
Energy: 0.3456762403819861
Energy: 0.3923121642069623
Energy: 0.31064919042439376
Energy: 0.2935289778289754
Energy: 0.3273701865633977
Energy: 0.34327747609267584
Energy: 0.2975763290141411
Energy: 0.32592248433195836
Energy: 0.31551461598429015
Energy: 0.32085021737342667
Energy: 0.32702083435682233
Energy: 0.293504577956444
Energy: 0.29835547214037705
Energy: 0.3214742506027141
Energy: 0.32302545169541125
Energy: 0.34596367767684216
Energy: 0.3280960503592851
Energy: 0.35013417627609594
Energy: 0.33688549089603814
Energy: 0.34013174926569417
Energy: 0.32668857131808426
Energy: 0.3213521627849465
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Energy: 0.34864876918858306
Energy: 0.32556144178101315
Energy: 0.35324149145464023
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Energy: 0.3315779805541666
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Energy: 0.31612682081859445
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Energy: 0.34616061039819207
Energy: 0.2813280293442506
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Energy: 0.29433021496759965
Energy: 0.3220587628054585
Energy: 0.34697567433484844
Energy: 0.3416873918665872
Energy: 0.28581000971596354
Energy: 0.29352296376186005
Energy: 0.3186130169950791
Energy: 0.34562522147342434
Energy: 0.33622950852689404
Energy: 0.3287732624580777
Energy: 0.30700638127627494
Energy: 0.3477238599365923
Energy: 0.3529813689103212
Energy: 0.33740901114900784
Energy: 0.3490218212449122
Energy: 0.2945928247965117
Energy: 0.3433175784770154
Energy: 0.34392706190238637
Energy: 0.3522430752320789
Energy: 0.3488407487184501
Energy: 0.354652092380153
Energy: 0.30757627439382706
Energy: 0.3543420903987492
Energy: 0.3436860742002361
Energy: 0.3133800786696901
Energy: 0.3367027231847944
Energy: 0.30636716454539814
Energy: 0.3554168761951657
Energy: 0.3605519317459079
Energy: 0.3460098541212212
Energy: 0.32207840174285224
Energy: 0.3097476728283643
Energy: 0.2933754372838464
Energy: 0.30128709021084904
Energy: 0.3573005042374285
Energy: 0.315259812876014
Energy: 0.3073227346921025
Energy: 0.32540917843210093
Energy: 0.30182944825082175
Energy: 0.3578737547383641
Energy: 0.3336894447539596
Energy: 0.31604407053096173
Energy: 0.295953856354837
Energy: 0.32083018192611473
Energy: 0.33984956329537225
Energy: 0.334994729115323
Energy: 0.29371366797965953
Energy: 0.32048430870347916
Energy: 0.29325942565160135
Energy: 0.3591271734939153
Energy: 0.30087149518748174
Energy: 0.29397908092609654
Energy: 0.29683022981255536
Energy: 0.29269732987576064
Energy: 0.3391767047187152
Energy: 0.30182549353241545
Energy: 0.3032632256312246
Energy: 0.2952911936305027
Energy: 0.2962648386016175
Energy: 0.30290506358664
Energy: 0.3511639611837571
Energy: 0.3154430557686431
Energy: 0.293559717626265
Energy: 0.3197665449235515
Energy: 0.29734899282289345
Energy: 0.33230233312360724
Energy: 0.3240035416967192
Energy: 0.29316862648460806
Energy: 0.3325586496978168

minimum gb energy = 0.2785356331641882 eV
minimum distance =  2.5411993567219 Angstroms
sigma value = 41


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

Energy: 0.28817638625573144
Energy: 0.25342953527707507
Energy: 0.25949235595975023
Energy: 0.26155068916025304
Energy: 0.25461640203513625
Energy: 0.26466851205637437
Energy: 0.253572518288993
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Energy: 0.27158685559443746
Energy: 0.28546663534370065
Energy: 0.31339528025727453
Energy: 0.29948911908265186
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Energy: 0.267701030259749
Energy: 0.2700411033540673
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Energy: 0.2540624144963081
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Energy: 0.28469621707606474
Energy: 0.29013889802990755
Energy: 0.2736720340895121
Energy: 0.31901748339589703
Energy: 0.3016116876956506
Energy: 0.30458494252896173
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Energy: 0.28778978699452734
Energy: 0.29771147585118896
Energy: 0.32117182698324415
Energy: 0.2857270007012781
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Energy: 0.31915985639850214
Energy: 0.31687718171042145
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Energy: 0.28353998159405946
Energy: 0.28806288501609545
Energy: 0.3064315356014513
Energy: 0.3215541511045105
Energy: 0.28875509871402116
Energy: 0.30682035329170726
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Energy: 0.31015155065533917
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Energy: 0.316713255252142
Energy: 0.32318242705302425
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Energy: 0.3246804519615346
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Energy: 0.31759413822096705
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Energy: 0.2771521503619531
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Energy: 0.281111992514398
Energy: 0.2528097978810523
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Energy: 0.2992328735588905
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Energy: 0.2745546032698417
Energy: 0.27994531949969986
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Energy: 0.31166749212059147
Energy: 0.32262855803533436
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Energy: 0.27446470016169794
Energy: 0.2989152004681641
Energy: 0.2999161720453044
Energy: 0.2792431837659081
Energy: 0.2816275833196161
Energy: 0.2805760313573367
Energy: 0.3074179853103853
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Energy: 0.293109659091289
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Energy: 0.29703084690791726
Energy: 0.3199579149699432
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Energy: 0.30819112761165773
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Energy: 0.31469366375355373
Energy: 0.28608918857635557
Energy: 0.2953398347954162
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Energy: 0.32255176470315244
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Energy: 0.2893371055697665
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Energy: 0.29658342914213837
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Energy: 0.3168860675421333
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Energy: 0.28863526558723573
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Energy: 0.31375994995585493
Energy: 0.29973235210545035
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Energy: 0.29797478803308075
Energy: 0.2695470981106983
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Energy: 0.2971862770618577
Energy: 0.28595268485185726
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Energy: 0.30430276793608807
Energy: 0.30947783127567424
Energy: 0.2529017492225268
Energy: 0.25405775855850404
Energy: 0.27621619138393
Energy: 0.2794726930471592
Energy: 0.3736783607989609
Energy: 0.28226896016675923
Energy: 0.2815563319793575
Energy: 0.28807889645690776
Energy: 0.27726944486510124
Energy: 0.3009140884894377
Energy: 0.2757453047117735
Energy: 0.25879075116581246
Energy: 0.2619441372380955
Energy: 0.27753661468861635
Energy: 0.2857846322489867
Energy: 0.27698558667507367
Energy: 0.28276679281283557
Energy: 0.2690407003691907
Energy: 0.3161485628697206
Energy: 0.30995732766802553
Energy: 0.26612868327166633
Energy: 0.2612539672233376
Energy: 0.25391173405052997
Energy: 0.30570713980801684
Energy: 0.30268450598565416
Energy: 0.2695524679229542
Energy: 0.25716851088880754
Energy: 0.27744125672747755
Energy: 0.2633418227882383
Energy: 0.2791974716134917
Energy: 0.2863409507200575
Energy: 0.28728866569604616
Energy: 0.27537267419225236
Energy: 0.3122350375084214
Energy: 0.26938420166778754
Energy: 0.2823480776418518
Energy: 0.2685624154585699
Energy: 0.29497290665203457

minimum gb energy = 0.2526999347317394 eV
minimum distance =  2.61545500372058 Angstroms
sigma value = 185


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

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Energy: 0.1790698122685355
Energy: 0.2618016475913059
Energy: 0.2425219307563612
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Energy: 0.18711326983322904
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Energy: 0.20664292594511657
Energy: 0.2589530284457963
Energy: 0.19703757636350375
Energy: 0.14466085767460493
Energy: 0.14888521286945958
Energy: 0.1712515155023739
Energy: 0.2502150598335533
Energy: 0.17718885986363445
Energy: 0.15336455441345767
Energy: 0.15467997639500425
Energy: 0.1656851563005344
Energy: 0.24348846971801277
Energy: 0.23725903270290252
Energy: 0.18964127217761792
Energy: 0.1965292451566372
Energy: 0.21550321314576967
Energy: 0.256718297681986
Energy: 0.2240562039173765
Energy: 0.16955266780907627
Energy: 0.20315534521689854
Energy: 0.19823014480307474
Energy: 0.218433139912415
Energy: 0.1894037166636888
Energy: 0.23221747920087465
Energy: 0.21661589163177355
Energy: 0.21171894353729656
Energy: 0.21857842716482997
Energy: 0.1949965955852501
Energy: 0.15609043758750296
Energy: 0.19991226097734546
Energy: 0.16351827250326145
Energy: 0.18238687841394013
Energy: 0.22331354118457633

minimum gb energy = 0.12038937554450366 eV
minimum distance =  2.64329572702553 Angstroms
sigma value = 33


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

Energy: 0.26087512636034765
Energy: 0.2387599265731623
Energy: 0.26242347747134903
Energy: 0.240854156338869
Energy: 0.2550747500443024
Energy: 0.2431123730870693
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Energy: 0.2719139709309361
Energy: 0.251536551473387
Energy: 0.22333204085518607
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Energy: 0.30286658401323524
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Energy: 0.24061507264616494
Energy: 0.280938131469543
Energy: 0.23654746641341218
Energy: 0.23728540329712372
Energy: 0.25076488619192444
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Energy: 0.23876790227053024
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Energy: 0.22427179620485602
Energy: 0.25865763191008995
Energy: 0.25823778295892075
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Energy: 0.27032242952665
Energy: 0.26080956068948896
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Energy: 0.26391003270943636
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Energy: 0.2731724756419743
Energy: 0.24853732985504887
Energy: 0.2593331237078826
Energy: 0.2641355358274006
Energy: 0.2788244813481506

minimum gb energy = 0.22272852589525544 eV
minimum distance =  2.56290637015172 Angstroms
sigma value = 219


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

Energy: 0.4974072966138094
Energy: 0.3292398526922871
Energy: 0.2981228670877232
Energy: 0.2985818067163807
Energy: 0.339210530903986
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Energy: 0.31732311932685914
Energy: 0.3273499863509603
Energy: 0.32215379911833036
Energy: 0.32528527648112515
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Energy: 0.3538546411014122
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Energy: 0.3295128133593913
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Energy: 0.3294312994400038
Energy: 0.32556447959360624
Energy: 0.3228437704712688
Energy: 0.3427959463872486
Energy: 0.27939457397874745
Energy: 0.3486912018499031
Energy: 0.3521872715407028
Energy: 0.3338055642030999
Energy: 0.3473762143405343
Energy: 0.2793011552522524
Energy: 0.3123360748609076
Energy: 0.3533767461791653
Energy: 0.2889001198407031
Energy: 0.3476175845793425
Energy: 0.34262945142415757
Energy: 0.3120781343560183
Energy: 0.31671215045867906
Energy: 0.3297247326558603
Energy: 0.3316293966480383
Energy: 0.3428448640007698
Energy: 0.3354183856601246
Energy: 0.3160036985293784
Energy: 0.3289368040877858
Energy: 0.33212213566231075
Energy: 0.33782499608965233
Energy: 0.3438637276673513
Energy: 0.3237953419848393
Energy: 0.32377330392097864
Energy: 0.32914617413167796
Energy: 0.3383933410278917
Energy: 0.35337810170748457
Energy: 0.3240403331410492
Energy: 0.29744979870243776
Energy: 0.3292728686596762

minimum gb energy = 0.2786146264815573 eV
minimum distance =  2.6260486316498 Angstroms
sigma value = 15


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

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minimum gb energy = 0.33935111015651487 eV
minimum distance =  2.57062258120936 Angstroms
sigma value = 293


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

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Energy: 0.3652037777701353
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Energy: 0.3573095909207482
Energy: 0.3381051049822753
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Energy: 0.3395766059341853
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Energy: 0.35322267309070493
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Energy: 0.34366951415043384
Energy: 0.347586195974484
Energy: 0.3801705765793153
Energy: 0.35582355891317
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Energy: 0.36213803488136653
Energy: 0.34482377232469447
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Energy: 0.3568845692829338
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Energy: 0.350524751716964
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Energy: 0.36376577442925767
Energy: 0.375236162397967
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Energy: 0.3833474646351348
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Energy: 0.36472482819648594
Energy: 0.3414375631043585
Energy: 0.34558085914267805
Energy: 0.3414601351028676
Energy: 0.3322868283684401
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Energy: 0.34584448053765227
Energy: 0.35211271532245036
Energy: 0.35505372662678036
Energy: 0.3470679083208034
Energy: 0.34636694937040474
Energy: 0.3399265826858156
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Energy: 0.35117366992375554
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Energy: 0.3568740960607994
Energy: 0.350876028149321
Energy: 0.3404923683059638
Energy: 0.34969503488535963
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Energy: 0.3615245567667544
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Energy: 0.3560827564713764
Energy: 0.36643986979170207
Energy: 0.34475022899859215
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Energy: 0.3454486077683568
Energy: 0.3567592282572864
Energy: 0.3513502186258661
Energy: 0.3823818343771926
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Energy: 0.3632991446076458
Energy: 0.3546792862579632
Energy: 0.3814625867354443
Energy: 0.3517039494475674
Energy: 0.37640885929076084
Energy: 0.3682131372053617
Energy: 0.36240316888740015
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Energy: 0.34038841886428256
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Energy: 0.3521373015200629
Energy: 0.36339046726398394
Energy: 0.352833115313377
Energy: 0.3405889485604051
Energy: 0.3564886729253445
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Energy: 0.3379407051461298
Energy: 0.34701496982749663
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Energy: 0.35323353254015816
Energy: 0.33256134989131086
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Energy: 0.3419779897778753
Energy: 0.3408181235955012
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Energy: 0.3512764570835759
Energy: 0.3480975551866285
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Energy: 0.34146811603903543
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Energy: 0.33923301785215043
Energy: 0.3654112476789722
Energy: 0.35074614784474584
Energy: 0.3510482340965844
Energy: 0.3387968247917184
Energy: 0.3431656923682895
Energy: 0.35708113752280585
Energy: 0.3522558778674765
Energy: 0.3442988328219963
Energy: 0.3501629062767722
Energy: 0.3573680785009983
Energy: 0.37951626868668675
Energy: 0.33488881523673325
Energy: 0.3515137086747035
Energy: 0.34557689774262224
Energy: 0.3570142950280487
Energy: 0.3796012777330294
Energy: 0.42488329532150854
Energy: 0.3458959050724357
Energy: 0.347708654709822
Energy: 0.3509646987243076
Energy: 0.35856752354205723
Energy: 0.33572133182295394
Energy: 0.3591927396256219
Energy: 0.3479884163938804
Energy: 0.3479864502993462
Energy: 0.3596075661293543
Energy: 0.3356914493105176
Energy: 0.34105417640971614
Energy: 0.33966185780186264
Energy: 0.3506934505085827
Energy: 0.3822071163324729
Energy: 0.3509242409077023
Energy: 0.3404146564864321
Energy: 0.3408399097717008
Energy: 0.35074265505915597
Energy: 0.38286503907510744
Energy: 0.3518978075338826
Energy: 0.35632597095034124
Energy: 0.35566678157913545
Energy: 0.35742508041716015
Energy: 0.34473779839309143
Energy: 0.3662373228777142
Energy: 0.3566062915899806
Energy: 0.3555538654123296
Energy: 0.35800852045807896
Energy: 0.34476581724825633
Energy: 0.3616192833311938
Energy: 0.35530090786199126
Energy: 0.344883196454448
Energy: 0.3778558482350323
Energy: 0.3561954087826652
Energy: 0.36226242459500846
Energy: 0.34395777919525256
Energy: 0.3465081597030761
Energy: 0.37842769687556493
Energy: 0.3579307664489648
Energy: 0.3693462033492321
Energy: 0.35599560959011395
Energy: 0.3569764305172402
Energy: 0.3413020322170402
Energy: 0.3533752822195369
Energy: 0.36383880460556745
Energy: 0.34525035017442907
Energy: 0.3569225579723833
Energy: 0.36772525512403237
Energy: 0.3506694901619473
Energy: 0.36333953619985765
Energy: 0.333241887297494
Energy: 0.3723424072520329
Energy: 0.3451908128177371
Energy: 0.33988478278760315
Energy: 0.37548244423716387
Energy: 0.35844031686715716
Energy: 0.37236377423326994
Energy: 0.3415888424214436
Energy: 0.34013642814110884
Energy: 0.36362022866397475

minimum gb energy = 0.3322868283684401 eV
minimum distance =  2.55819891690642 Angstroms
sigma value = 293


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

Energy: 0.33514323035474464
Energy: 0.3537338791253218
Energy: 0.3853325071920373
Energy: 0.34244361300446335
Energy: 0.3548237019832408
Energy: 0.33555334926527386
Energy: 0.3540415587467468
Energy: 0.3863428044783229
Energy: 0.34364531452824093
Energy: 0.3550522176881615
Energy: 0.3816339845674421
Energy: 0.3530548317068781
Energy: 0.34341797826409814
Energy: 0.3717472451284985
Energy: 0.3703408647142099
Energy: 0.3624704906884819
Energy: 0.3530419671556416
Energy: 0.3554836626954071
Energy: 0.3543555431512827
Energy: 0.3713586144507542
Energy: 0.35520487970809456
Energy: 0.3540351157571876
Energy: 0.35277083822299304
Energy: 0.3873118977798337
Energy: 0.36400352532806085
Energy: 0.37229507512619714
Energy: 0.3435067829808769
Energy: 0.34351231608818306
Energy: 0.3865116191317713
Energy: 0.34307599861861043
Energy: 0.3454074187300167
Energy: 0.3368360152581563
Energy: 0.33545330104483584
Energy: 0.3714681821663002
Energy: 0.3433386073640377
Energy: 0.34400112651432835
Energy: 0.3357188341396825
Energy: 0.3381897926773665
Energy: 0.3721687361368595
Energy: 0.34820074999591044
Energy: 0.3536878892446818
Energy: 0.36452816418532813
Energy: 0.3355718003426291
Energy: 0.3862268441268466
Energy: 0.3527458556411609
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Energy: 0.3541716708974393
Energy: 0.3357102228742966
Energy: 0.3458721789133984
Energy: 0.3531762884930997
Energy: 0.34406351840469884
Energy: 0.35416436549720864
Energy: 0.343192496603904
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Energy: 0.3635126184876141
Energy: 0.343308087609815
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Energy: 0.34350803125765605
Energy: 0.3526892647943484
Energy: 0.36209806434786695
Energy: 0.3435448415123394
Energy: 0.34995884993502013
Energy: 0.37164834542984476
Energy: 0.34287057219626893
Energy: 0.3694057385122263
Energy: 0.3431705155604574
Energy: 0.3388945813614247
Energy: 0.3707465664888134
Energy: 0.34363283827420443
Energy: 0.3694525770715876
Energy: 0.37126382424928633
Energy: 0.3628007269300996
Energy: 0.3530299722581663
Energy: 0.33572761262240963
Energy: 0.3621478419830361
Energy: 0.37114193959880903
Energy: 0.36104649465792715
Energy: 0.35383076665028435
Energy: 0.3398347933539801
Energy: 0.3617583891055335
Energy: 0.3428689024367353
Energy: 0.3621701864724881
Energy: 0.371513863674397
Energy: 0.33556932134655815
Energy: 0.35329298018999195
Energy: 0.3428557820989811
Energy: 0.3716269003472919
Energy: 0.37104798511906517
Energy: 0.3357174263654288
Energy: 0.35353485171170534
Energy: 0.35319671581081785
Energy: 0.3446507966107513
Energy: 0.3620650379312364
Energy: 0.35329610558152963
Energy: 0.4191418685650026
Energy: 0.35290650695965664
Energy: 0.3529271344353272
Energy: 0.36213118026623947
Energy: 0.34501973331053254
Energy: 0.35396696603900574
Energy: 0.3375596664750784
Energy: 0.3711193546865968
Energy: 0.35331273490411164
Energy: 0.35330097566440816
Energy: 0.34417817874224665
Energy: 0.33763652013326223
Energy: 0.37078304105552873
Energy: 0.3510800187068303
Energy: 0.35338105900085587
Energy: 0.3446858306879467
Energy: 0.3352624267732693
Energy: 0.34754521668245697
Energy: 0.3856050989949794
Energy: 0.34448180954940966
Energy: 0.3563394653108691
Energy: 0.33564069877961794
Energy: 0.3741387791376892
Energy: 0.3863951061285341
Energy: 0.3430306539821477
Energy: 0.3549964605530752
Energy: 0.38270378905015784
Energy: 0.3529838059686729
Energy: 0.3528641345696592
Energy: 0.37182471942606493
Energy: 0.3709871224613575
Energy: 0.3624151566096927
Energy: 0.35292367094078514
Energy: 0.354962213184161
Energy: 0.35445152979266853
Energy: 0.3716300389633477
Energy: 0.3545844324805123
Energy: 0.35414817942409177
Energy: 0.3528833279839228
Energy: 0.38668557946015863
Energy: 0.3636746634425473
Energy: 0.37189674604854656
Energy: 0.3434230564180952
Energy: 0.3434944387184707
Energy: 0.38623839282901634
Energy: 0.34322870816686685
Energy: 0.34523012567241246
Energy: 0.33601697907627465
Energy: 0.3354868517509258
Energy: 0.37138458042598244
Energy: 0.3428832559732729
Energy: 0.3444685577263316
Energy: 0.3357417684769111
Energy: 0.3540884647028734
Energy: 0.37202932450404586
Energy: 0.34319931127587117
Energy: 0.3540381332489953
Energy: 0.36288610046792696
Energy: 0.33565049502426647
Energy: 0.36946494409368624
Energy: 0.353196794196957
Energy: 0.3537855699377531
Energy: 0.3544330474112101
Energy: 0.33559460381223843
Energy: 0.3450697569378998
Energy: 0.35250294912032865
Energy: 0.3440776990900023
Energy: 0.3533304235867895
Energy: 0.34382722156519335
Energy: 0.35383500978583815
Energy: 0.3622390664794433
Energy: 0.34347414750983923
Energy: 0.3864000615035673
Energy: 0.3431738666807104
Energy: 0.35255943379677857
Energy: 0.3621594687349991
Energy: 0.35317267981329614
Energy: 0.34965059073184995
Energy: 0.3705803412973262
Energy: 0.3429325875434705
Energy: 0.362511340599715
Energy: 0.35333259593749977
Energy: 0.3391840505008307
Energy: 0.37063962720096677
Energy: 0.34350548757833005
Energy: 0.3684778176417431
Energy: 0.3710654828567881
Energy: 0.36310819024473184
Energy: 0.353737275433414
Energy: 0.33558673567364405
Energy: 0.36252802113966615
Energy: 0.37130440200782755
Energy: 0.3619234639611535
Energy: 0.35332985551810475
Energy: 0.33879301244684185
Energy: 0.3619852693626048
Energy: 0.34324676791603576
Energy: 0.3622307697813239
Energy: 0.3719108945263801
Energy: 0.33570680828322275
Energy: 0.3432911651368575
Energy: 0.3434912005322778
Energy: 0.37201912010785804
Energy: 0.371154809467257
Energy: 0.3357656686805379
Energy: 0.353851394906337
Energy: 0.3536318189702762
Energy: 0.3438279407984161
Energy: 0.3616971382769542
Energy: 0.3529201232755505
Energy: 0.35352198971676385
Energy: 0.3533531130339487
Energy: 0.353607894973554
Energy: 0.4317817089274759
Energy: 0.372606686267146
Energy: 0.35385888299800483
Energy: 0.3367616533721555
Energy: 0.37058990962522353
Energy: 0.35320641506569156
Energy: 0.34326375702507395
Energy: 0.38385047052078325
Energy: 0.3366083821840888
Energy: 0.37063500714656955
Energy: 0.3513193547419217
Energy: 0.3529959744002043
Energy: 0.36296816020784545

minimum gb energy = 0.33514323035474464 eV
minimum distance =  2.56088360732813 Angstroms
sigma value = 15


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

Energy: 0.3449791568366717
Energy: 0.36237450832431145
Energy: 0.37442976147035845
Energy: 0.3496359297993578
Energy: 0.36618194764782225
Energy: 0.3625217246682314
Energy: 0.3806325145667656
Energy: 0.3748894447916384
Energy: 0.38317249650840074
Energy: 0.36370177390342673
Energy: 0.3445016825954034
Energy: 0.3762644869597299
Energy: 0.35762724745940483
Energy: 0.3635329127694941
Energy: 0.379402072463071
Energy: 0.33597723888108344
Energy: 0.3761749702130063
Energy: 0.3568777087182218
Energy: 0.3775127134547868
Energy: 0.3732783266527531
Energy: 0.4018380054041561
Energy: 0.3721293952610234
Energy: 0.3444698684598523
Energy: 0.3418323622732503
Energy: 0.35763288125814013
Energy: 0.3903606470320438
Energy: 0.3747314434819692
Energy: 0.3393506765283157
Energy: 0.35729975320977536
Energy: 0.36312907079650836
Energy: 0.36427216412368746
Energy: 0.35299063442842454
Energy: 0.3934682761534645
Energy: 0.39365487103787966
Energy: 0.35811756467078526
Energy: 0.37188330731414465
Energy: 0.3506838692137011
Energy: 0.36946505867739826
Energy: 0.39959611037756254
Energy: 0.36330002240268866
Energy: 0.36151101726133306
Energy: 0.3715006914597738
Energy: 0.35638664062094927
Energy: 0.33926004899769235
Energy: 0.33459666296849244
Energy: 0.3533754961299955
Energy: 0.37196118720061394
Energy: 0.3642796719919459
Energy: 0.33766217834324574
Energy: 0.3362529082493774
Energy: 0.3338570363883606
Energy: 0.34126620897059007
Energy: 0.3405552526108609
Energy: 0.403462931303354
Energy: 0.4043347659103249
Energy: 0.355141538581307
Energy: 0.3398264658601902
Energy: 0.34090902736838186
Energy: 0.4056182848052968
Energy: 0.43284538797394084
Energy: 0.3466872163997193
Energy: 0.338419649733372
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Energy: 0.3481394795682966
Energy: 0.35749733996313066
Energy: 0.34576383924729276
Energy: 0.34047531509888046
Energy: 0.3448903395329582
Energy: 0.35337342125285265
Energy: 0.3966134945262152
Energy: 0.3693530282660211
Energy: 0.33771906160991305
Energy: 0.3506374415052065
Energy: 0.33803982208833105
Energy: 0.38764814932230074
Energy: 0.34684925526562654
Energy: 0.33996045582227646
Energy: 0.3533846361571677
Energy: 0.3519626667804922
Energy: 0.38056551146869877
Energy: 0.366281504719618
Energy: 0.4165731601922947
Energy: 0.3763962579922624
Energy: 0.3536082446044119
Energy: 0.3549001080684639
Energy: 0.36714495210948994
Energy: 0.4186562240147919
Energy: 0.3696963653053121
Energy: 0.38340545214495847
Energy: 0.35235570236179564
Energy: 0.37428128435734626
Energy: 0.34610777646139357
Energy: 0.36023637893617616
Energy: 0.3332097172019526
Energy: 0.34607627521394974
Energy: 0.3836301098621529
Energy: 0.33997536013816726
Energy: 0.35907300030797296
Energy: 0.33615131146287347
Energy: 0.34848166550991494
Energy: 0.36339535763705905
Energy: 0.3618230896369665
Energy: 0.3357948325257602
Energy: 0.34233512870559
Energy: 0.34365826951290024
Energy: 0.37248313123761556
Energy: 0.36341485589177047
Energy: 0.34824132328529206
Energy: 0.3459589545116108
Energy: 0.3363466290961675
Energy: 0.403037465409581
Energy: 0.3879478625272816
Energy: 0.3427839273841459
Energy: 0.3330503052804694
Energy: 0.38640541975734377
Energy: 0.4033373123145951
Energy: 0.37662678686768947
Energy: 0.34615449352489336
Energy: 0.3738367534802898
Energy: 0.3856683251146241
Energy: 0.33818879215723
Energy: 0.3847259227906328
Energy: 0.36294891722704625
Energy: 0.3627166831934849
Energy: 0.36083198016505574
Energy: 0.37552907084622134
Energy: 0.3749318856892193
Energy: 0.36347775313732555
Energy: 0.36302641627788323
Energy: 0.3614413083271171
Energy: 0.3528973448450556
Energy: 0.37911742640915685
Energy: 0.37531551502824984
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Energy: 0.3679598720554668
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Energy: 0.3672389639815579
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Energy: 0.3821467542711077
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Energy: 0.3356444333344984
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Energy: 0.3709656738313981
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Energy: 0.336858404854826
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Energy: 0.3339488823741598
Energy: 0.38316218151010845
Energy: 0.3686248971282571
Energy: 0.4057784402171563
Energy: 0.3963577604712567
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Energy: 0.3752781836007698
Energy: 0.3458142829918821
Energy: 0.38140726281373627
Energy: 0.4112234935023241
Energy: 0.40826677797340344
Energy: 0.3748499039863006
Energy: 0.34035257723310003
Energy: 0.34748115106170147
Energy: 0.3483924120293537
Energy: 0.3583212344550246
Energy: 0.34281865965269875
Energy: 0.34715298809116174
Energy: 0.34588066155431374
Energy: 0.3423163462910258
Energy: 0.35474430061042694
Energy: 0.34225227124891494
Energy: 0.35137762131420514
Energy: 0.35211267369148813
Energy: 0.3530911987525405
Energy: 0.37513946029442513
Energy: 0.3371289877806755
Energy: 0.3414994736209019
Energy: 0.36246269391689767
Energy: 0.36188089903217646
Energy: 0.36409285991282825
Energy: 0.33831067805854553
Energy: 0.339886325533596
Energy: 0.3782379540734328
Energy: 0.3366110624687962
Energy: 0.35232868135559475
Energy: 0.34267508479908537
Energy: 0.37042818330116223
Energy: 0.36588836431183247
Energy: 0.3372334343850293
Energy: 0.35652658343781013
Energy: 0.3723040143984826
Energy: 0.37651505090314025
Energy: 0.34092751219902945
Energy: 0.3382938847357875
Energy: 0.3671059416997255
Energy: 0.4186240680298849
Energy: 0.3631312491410334
Energy: 0.33440842568542395
Energy: 0.33400815858463706
Energy: 0.3755210082009755
Energy: 0.4173788135147074
Energy: 0.36601843731838407
Energy: 0.354570763140813
Energy: 0.3423059152254647
Energy: 0.34648372431906055
Energy: 0.3679273931332042
Energy: 0.33748078519088204
Energy: 0.3388618737274729
Energy: 0.35214340364394076
Energy: 0.35511232005062643
Energy: 0.3551608583173799
Energy: 0.34167916874632426
Energy: 0.34515880126037835
Energy: 0.35341166601546603
Energy: 0.3508324608017427
Energy: 0.400357988463328
Energy: 0.3860927297148961
Energy: 0.3389265602292391
Energy: 0.3546257302476961
Energy: 0.34960950903912713
Energy: 0.37431451789903414
Energy: 0.3820832599331781
Energy: 0.3483944954729021
Energy: 0.3758515744144301
Energy: 0.3600905331663851
Energy: 0.36558534015233307
Energy: 0.3332088907329772
Energy: 0.35431721642560804
Energy: 0.3713717386566115
Energy: 0.36959905756631384
Energy: 0.3636634570125644
Energy: 0.3339998014930135

minimum gb energy = 0.33042898007588417 eV
minimum distance =  2.53461861236543 Angstroms
sigma value = 437


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

Energy: 0.49368431411884484
Energy: 0.3501221142248141
Energy: 0.3467009878406151
Energy: 0.34198351785116654
Energy: 0.3967074059164549
Energy: 0.49382236270758134
Energy: 0.35088298952340546
Energy: 0.34680015270954045
Energy: 0.3575615734304522
Energy: 0.36394651674629114
Energy: 0.31958109433950177
Energy: 0.3485201490191611
Energy: 0.3316085421339025
Energy: 0.3739594566768374
Energy: 0.32683355363799343
Energy: 0.3196478591164806
Energy: 0.3486571403008143
Energy: 0.32961659250017655
Energy: 0.34808727117864374
Energy: 0.32597964585983147
Energy: 0.35111513247628595
Energy: 0.3573449319805795
Energy: 0.31890060428204237
Energy: 0.3301675785114452
Energy: 0.3565035645568584
Energy: 0.35162430188671484
Energy: 0.3578225277196331
Energy: 0.3204981471931002
Energy: 0.3286280851033683
Energy: 0.34656404159739174
Energy: 0.32851138861818197
Energy: 0.33294404187501336
Energy: 0.34398589328628876
Energy: 0.3518528027579758
Energy: 0.3216687827743026
Energy: 0.32903629821221436
Energy: 0.32728447082210094
Energy: 0.3548196089779278
Energy: 0.35099932816386176
Energy: 0.3209250180906372
Energy: 0.39601842837193957
Energy: 0.3586311277840282
Energy: 0.3311207386534192
Energy: 0.3306931140895125
Energy: 0.319222434367333
Energy: 0.39515131839525175
Energy: 0.3585254818317615
Energy: 0.32968070336512045
Energy: 0.33242966799738777
Energy: 0.3197498667556791
Energy: 0.33208662150247376
Energy: 0.327141319882393
Energy: 0.3177081250456491
Energy: 0.36108823488609026
Energy: 0.31751707658143125
Energy: 0.33200472491695654
Energy: 0.3267142038813792
Energy: 0.3175664742856141
Energy: 0.3602335938082684
Energy: 0.3177855853810977
Energy: 0.3577137429067674
Energy: 0.34908217095707256
Energy: 0.3479058572762604
Energy: 0.3307285304257258
Energy: 0.32026501470268565
Energy: 0.3578578279766031
Energy: 0.34847891089979705
Energy: 0.34817566844619446
Energy: 0.3654069394140058
Energy: 0.3195606318341487
Energy: 0.36344108596954267
Energy: 0.3246682195600295
Energy: 0.32576758087034974
Energy: 0.3290828607485585
Energy: 0.3568501110363476
Energy: 0.3619552804101706
Energy: 0.32727501100063083
Energy: 0.32659840479325725
Energy: 0.37878568971562615
Energy: 0.3566408165342558
Energy: 0.3276143914871792
Energy: 0.3234523023272815
Energy: 0.35740325380002747
Energy: 0.34428790386000996
Energy: 0.32811289341672256
Energy: 0.32753387684975044
Energy: 0.3196735746261009
Energy: 0.35702686894739954
Energy: 0.3450693822391779
Energy: 0.3271843966933874
Energy: 0.33166997060548215
Energy: 0.3433392209880001
Energy: 0.324769021323726
Energy: 0.397614048783736
Energy: 0.35814850448456137
Energy: 0.3588403415583776
Energy: 0.3645109393925472
Energy: 0.32541657571990257
Energy: 0.3997557836381116
Energy: 0.3579651226180808
Energy: 0.31975703073749395
Energy: 0.31870579347624584
Energy: 0.35838170546101544
Energy: 0.3179375320537016
Energy: 0.32373998980882884
Energy: 0.3183586019850677
Energy: 0.318227436120298
Energy: 0.35901526497502567
Energy: 0.31797893402160804
Energy: 0.32841642454609316
Energy: 0.3218517812066538
Energy: 0.3217748873275297
Energy: 0.3220105157388838
Energy: 0.34343209177926937
Energy: 0.3199207551453618
Energy: 0.32247913603295425
Energy: 0.32215253380814884
Energy: 0.32332798099277127
Energy: 0.3584300530420159
Energy: 0.31945375731093323
Energy: 0.31907035840785625
Energy: 0.3204208718292765
Energy: 0.33050013874896683
Energy: 0.34756896344766863
Energy: 0.3599026237521887
Energy: 0.3190049397441737
Energy: 0.32107212379525524
Energy: 0.3237923248143789
Energy: 0.346958058052853
Energy: 0.36008662363493105
Energy: 0.32242054547364085
Energy: 0.332049552533551
Energy: 0.3627520985663769
Energy: 0.367442655249431
Energy: 0.3238579463861352
Energy: 0.3744124610066438
Energy: 0.35775996613976463
Energy: 0.35924902056350444
Energy: 0.3287159100669066
Energy: 0.33101407532986676

minimum gb energy = 0.31751707658143125 eV
minimum distance =  2.63015150825447 Angstroms
sigma value = 33