Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
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=60.0
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: 0.013473284452859453
Energy: 0.16178549584460555
Energy: 0.1624910480166746
Energy: 0.25783134175258476
Energy: 0.2581724211174806
Energy: 0.10172862634763657
Energy: 0.013886144211409159
Energy: 0.06056670143492987
Energy: 0.2587657008775268
Energy: 0.07807939759875052
Energy: 0.16175296948874796
Energy: 0.2060342473637273
Energy: 0.014099657158100581
Energy: 0.06067311968296305
Energy: 0.01377484722286947
Energy: 0.2571079957662362
Energy: 0.19403608410241288
Energy: 0.16199600777064077
Energy: 0.23135178253182595
Energy: 0.060478573423541834
Energy: 0.06182828487152439
Energy: 0.01509247556287534
Energy: 0.2065657119782625
Energy: 0.17555636212854087
Energy: 0.2578181395782173
Energy: 0.2590818051753523
Energy: 0.0607003117288057
Energy: 0.01379936955043111
Energy: 0.10184397519978589
Energy: 0.25920464041321645
Energy: 0.07789295016375421
Energy: 0.16201394708380581
Energy: 0.20674030554294442
Energy: 0.01422107532713383
Energy: 0.06065272011485612
Energy: 0.013785473323751388
Energy: 0.2321770126769218
Energy: 0.17605417662188544
Energy: 0.18588901837054497
Energy: 0.23166036385693126
Energy: 0.06038863032641249
Energy: 0.06137729491535265

minimum gb energy = 0.013473284452859453 eV
minimum distance =  2.83717606942358 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 0.38345963043447445
Energy: 0.42351490124666435
Energy: 0.397357876414795
Energy: 0.3870547880404917
Energy: 0.38343156272888784
Energy: 0.4096242761761569
Energy: 0.3458710790871737
Energy: 0.32275485578381363
Energy: 0.3637657801431809
Energy: 0.33592793382860336
Energy: 0.3739088997200367
Energy: 0.33638312566686596
Energy: 0.3369430090381176
Energy: 0.361864561632655
Energy: 0.43497105870208846
Energy: 0.3880030173273921
Energy: 0.3503197764860721
Energy: 0.3761642677489848
Energy: 0.361570714503136
Energy: 0.3788687499462901
Energy: 0.3892007781250643
Energy: 0.33670098110454943
Energy: 0.40714099313780405
Energy: 0.3284411838012119
Energy: 0.33172821422005105
Energy: 0.34632853481533266
Energy: 0.32359776800875134
Energy: 0.37136175188212067
Energy: 0.3850932716168136
Energy: 0.3646096968643956
Energy: 0.3587946956122896
Energy: 0.33801042665484315
Energy: 0.36519895982438877
Energy: 0.37509475198643194
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Energy: 0.3689077210211644
Energy: 0.3460132498349717
Energy: 0.3641640836199835
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Energy: 0.3723155013558273
Energy: 0.33586198056072897
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Energy: 0.3617176458487232
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Energy: 0.3343871452246077
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Energy: 0.3383547858198168
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Energy: 0.3571962868276487
Energy: 0.3373298590827944
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Energy: 0.3761375774274571
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Energy: 0.3760753565024839
Energy: 0.37335059164053286
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Energy: 0.37733196039999506
Energy: 0.3458058253121795
Energy: 0.3400994214185723
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Energy: 0.3551268930364343
Energy: 0.36867727240744286
Energy: 0.3604140460880826
Energy: 0.37842951299266164
Energy: 0.3663373688905682
Energy: 0.38151678788935145
Energy: 0.38245300021570844
Energy: 0.3978569097416632
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Energy: 0.3568657945996618
Energy: 0.3732874185309808
Energy: 0.3242227378109233
Energy: 0.3581865195983471
Energy: 0.3543136917208177
Energy: 0.3300155857207229
Energy: 0.36477157994523435
Energy: 0.37835601690258996
Energy: 0.3357481684755091
Energy: 0.3889344562800245
Energy: 0.3675469250604593
Energy: 0.36146581303429015
Energy: 0.3589706100365495
Energy: 0.3743528875191529
Energy: 0.3263266155394773
Energy: 0.3510287135980191
Energy: 0.3275766838619207
Energy: 0.36365014107078514
Energy: 0.3355655444400795
Energy: 0.3533809296836689
Energy: 0.34347741718256114
Energy: 0.4106147447825046
Energy: 0.37808644178170464
Energy: 0.37310071667858197
Energy: 0.36256073218738394
Energy: 0.38539132619584177
Energy: 0.4070600129790307
Energy: 0.37343089646829447
Energy: 0.33408945625749187
Energy: 0.36476242344504556
Energy: 0.36093985961222175
Energy: 0.38836180082242533
Energy: 0.3300498322038894
Energy: 0.33113163268599244
Energy: 0.36155995436882366
Energy: 0.36007196886611176
Energy: 0.351273279885544
Energy: 0.35203274433289583
Energy: 0.3638248766852772
Energy: 0.34152562230624
Energy: 0.37962968882484416
Energy: 0.3504371346412945

minimum gb energy = 0.3199405525251174 eV
minimum distance =  2.56381896428191 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 0.3558154113968024
Energy: 0.42039864011481987
Energy: 0.36108345913729767
Energy: 0.3619587495976629
Energy: 0.4776855271660607
Energy: 0.3510429423021237
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Energy: 0.33709962742286104
Energy: 0.3242064600415754
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Energy: 0.3327769753490368
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Energy: 0.3291579105361614
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Energy: 0.3387767760062916
Energy: 0.3646414088923771
Energy: 0.361759323154666
Energy: 0.3900839282893312
Energy: 0.3442629629967743
Energy: 0.33086668386813245
Energy: 0.3325759319145867
Energy: 0.33779724787771265
Energy: 0.3367783048077261
Energy: 0.34479838328730145
Energy: 0.37195661566982086
Energy: 0.3495281053479195
Energy: 0.33719510494178057
Energy: 0.33428109384738536
Energy: 0.32963277623315557
Energy: 0.3325466140804655
Energy: 0.365301720594615
Energy: 0.4055137336362251
Energy: 0.3566664788392376
Energy: 0.385885330672724
Energy: 0.3365581799687177
Energy: 0.33187257748598903
Energy: 0.41947799347507425
Energy: 0.3858518436532594
Energy: 0.3378047442692842
Energy: 0.3488161499588535
Energy: 0.3584491334749799
Energy: 0.3333421562619833
Energy: 0.35562970178923897
Energy: 0.36965011115469465
Energy: 0.3410907560369691
Energy: 0.3298256238583719
Energy: 0.35590008402342743
Energy: 0.34902644027975327
Energy: 0.3408611284821096
Energy: 0.3451333856948816
Energy: 0.324513230432461
Energy: 0.32403466374863593
Energy: 0.32374074310614714
Energy: 0.32387815649680013
Energy: 0.35274639589023027
Energy: 0.361527157702902
Energy: 0.3305085792315429
Energy: 0.339050938697382
Energy: 0.3404650474607683
Energy: 0.32124279977252346
Energy: 0.33112662320854425
Energy: 0.364074637434014
Energy: 0.35249266545349006
Energy: 0.3750696718988553
Energy: 0.33809312628141847
Energy: 0.323654570584341
Energy: 0.32749352667119885
Energy: 0.3213443281315268
Energy: 0.345670242242958
Energy: 0.33138905711401095
Energy: 0.3542219165034526
Energy: 0.3527003067156812
Energy: 0.32555447324057896
Energy: 0.39660043735877715
Energy: 0.3835182675522327
Energy: 0.33009283562799796
Energy: 0.3509007882633474
Energy: 0.35467802136537824
Energy: 0.357793253155756
Energy: 0.38628427414699584
Energy: 0.34585981487726764
Energy: 0.3582283136923062
Energy: 0.34077842327232555
Energy: 0.36914921267308354
Energy: 0.35088037143298123
Energy: 0.3519478725722578
Energy: 0.36045107377689617
Energy: 0.38974743701259557
Energy: 0.34648966046801655
Energy: 0.3409057742268041
Energy: 0.3352596771609011
Energy: 0.3352622431374617
Energy: 0.334057352108387
Energy: 0.38357999979363266
Energy: 0.35636263815074
Energy: 0.3543078675226844
Energy: 0.33325572776418066
Energy: 0.33434491929507276
Energy: 0.3299605445900102
Energy: 0.3297999112241785
Energy: 0.38997667038380907
Energy: 0.39457538820109195
Energy: 0.3834881204246913
Energy: 0.36868072898462634
Energy: 0.33754593753392437
Energy: 0.33473777566803015
Energy: 0.3509465441207541
Energy: 0.36468048701736583
Energy: 0.3334945502206978
Energy: 0.3470419045332554
Energy: 0.33005998105956885
Energy: 0.3285311176872407
Energy: 0.35825969211926706
Energy: 0.37882712503716576
Energy: 0.33476277949451866
Energy: 0.3298512378456715
Energy: 0.3602881486138604
Energy: 0.35109479458802506
Energy: 0.3407778496595992
Energy: 0.3895644034703094
Energy: 0.33446891842608134
Energy: 0.32802843476306054
Energy: 0.3246790399993956
Energy: 0.33252016112747584
Energy: 0.341150001423169
Energy: 0.3677837240951463
Energy: 0.35741740174427544
Energy: 0.33786405758863364
Energy: 0.3370121539987583

minimum gb energy = 0.31909401861499653 eV
minimum distance =  2.55170383412467 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 0.3493890841172541
Energy: 0.3394129969258272
Energy: 0.3583498953025317
Energy: 0.3255249279274331
Energy: 0.355762202585714
Energy: 0.36498005150469176
Energy: 0.3559651990685994
Energy: 0.34187316902034187
Energy: 0.3656801276672545
Energy: 0.3366604678292276
Energy: 0.32565970233060115
Energy: 0.36475364398181154
Energy: 0.32608282317376525
Energy: 0.37714554506579157
Energy: 0.3357195373275073
Energy: 0.341336961238219
Energy: 0.3268109902399198
Energy: 0.35007473986325693
Energy: 0.3415245565683636
Energy: 0.3289130901398086
Energy: 0.3470379967184065
Energy: 0.33874017553974217
Energy: 0.36336863770550415
Energy: 0.33774952846151163
Energy: 0.3687578531383935
Energy: 0.3575037604172651
Energy: 0.34553985005762
Energy: 0.3694367778771705
Energy: 0.3450573345828388
Energy: 0.36358227742093396
Energy: 0.346590805087363
Energy: 0.34441207715383576
Energy: 0.3446936075606948
Energy: 0.33671321605335525
Energy: 0.3479375844962606
Energy: 0.3344678362505345
Energy: 0.3622026126716004
Energy: 0.34474545857704714
Energy: 0.33444655620596825
Energy: 0.34224569712843966
Energy: 0.3256347223855639
Energy: 0.3547371257428625
Energy: 0.3725309050216307
Energy: 0.3456379538066151
Energy: 0.36193283619696737
Energy: 0.3305334447782443
Energy: 0.34545390558458366
Energy: 0.3555281361821293
Energy: 0.3371154532876539
Energy: 0.3381835541141604
Energy: 0.3441807020275966
Energy: 0.3424532954770603
Energy: 0.32959045855399993
Energy: 0.3359529585553731
Energy: 0.3286679045132351
Energy: 0.3523689702618774
Energy: 0.35881102543017784
Energy: 0.3529575845272333
Energy: 0.3412052568407402
Energy: 0.34547991463288114
Energy: 0.342406816099631
Energy: 0.34006169472244896
Energy: 0.3368707345019513
Energy: 0.3337962120709396
Energy: 0.36059651635492435
Energy: 0.33569641951397555
Energy: 0.3551911516334864
Energy: 0.37147288716238874
Energy: 0.3648177696969897
Energy: 0.37398756355601775
Energy: 0.34119588256484085
Energy: 0.33538104423139736
Energy: 0.3354658688627276
Energy: 0.3372183169255295
Energy: 0.34293305851936035
Energy: 0.33508844152585426
Energy: 0.34351104253630105
Energy: 0.3371152791214665
Energy: 0.34854137395061374
Energy: 0.33558145382307664
Energy: 0.3366963817328136
Energy: 0.3482319433799515
Energy: 0.32914235026224425
Energy: 0.367593240052985
Energy: 0.3722218065790373
Energy: 0.34335273589351084
Energy: 0.3603138488550538
Energy: 0.3307077011495642
Energy: 0.34838028721783165
Energy: 0.357367609268361
Energy: 0.3188172809918418
Energy: 0.3375221604378497
Energy: 0.36492016404585653
Energy: 0.34789079922564864
Energy: 0.35733366075516804
Energy: 0.36543622116924834
Energy: 0.3531848472657183
Energy: 0.3584200180614245
Energy: 0.3389837967845376
Energy: 0.3376512048281064
Energy: 0.34219973334918985
Energy: 0.3461509279576964
Energy: 0.3450937603957166
Energy: 0.3326038740046313
Energy: 0.3811759730125131
Energy: 0.3508821610117757
Energy: 0.3644868311484917
Energy: 0.3218297388877496
Energy: 0.33692828214798776
Energy: 0.35886282227949184
Energy: 0.3361115036128386
Energy: 0.36047550588067645
Energy: 0.3409232479091812
Energy: 0.3485617128389188
Energy: 0.33784684283624594
Energy: 0.35430082292991083
Energy: 0.3559953870211731
Energy: 0.3330794678016463
Energy: 0.3423058786143472
Energy: 0.32897652998150345
Energy: 0.3623921781656253
Energy: 0.3431914787362143
Energy: 0.33191735916961923
Energy: 0.3405648719230079
Energy: 0.3286268212723102
Energy: 0.3418916988856824
Energy: 0.3757469179218078
Energy: 0.33019874957899936
Energy: 0.3339386464905133
Energy: 0.344536972197024
Energy: 0.3399531835176744
Energy: 0.33467665185980844
Energy: 0.32568724016745576
Energy: 0.33359575737216474
Energy: 0.3913035836976233
Energy: 0.34607544918014904
Energy: 0.3511788317259411
Energy: 0.36431292319970005
Energy: 0.35297809871225877
Energy: 0.3637606226706884
Energy: 0.3599599370171634
Energy: 0.33914542448244434
Energy: 0.3407963527045613
Energy: 0.3342576990294258
Energy: 0.36021532385586025
Energy: 0.3281479421154864
Energy: 0.34145674695940864
Energy: 0.3427406755951491
Energy: 0.35952908022794805
Energy: 0.3560962696926365
Energy: 0.34671211449648603
Energy: 0.35969492539226056
Energy: 0.3328322430308537
Energy: 0.3593131307432914
Energy: 0.34087380912718634
Energy: 0.3308486545983192
Energy: 0.3383440031809044
Energy: 0.36066377351628287
Energy: 0.3403986164832641
Energy: 0.38314099452492595
Energy: 0.36588802651767816
Energy: 0.34899065117778283
Energy: 0.3715314964452055
Energy: 0.3425815689935894
Energy: 0.3305259463251544
Energy: 0.34755270340013883
Energy: 0.33168801630861516
Energy: 0.36713659215587796
Energy: 0.3595897166182935
Energy: 0.3340796595714349
Energy: 0.3654317985026729
Energy: 0.3346281632820259
Energy: 0.33687919089189355
Energy: 0.3498933563217936
Energy: 0.32494319300221536
Energy: 0.3350661606655965
Energy: 0.3683509651967624
Energy: 0.3368482674506619
Energy: 0.361151488826662
Energy: 0.364117458797519
Energy: 0.3538808338611088
Energy: 0.35716254676783404
Energy: 0.35965793650070543
Energy: 0.3326270756756796
Energy: 0.33687719897208407
Energy: 0.3268405245124733
Energy: 0.3508462428073041
Energy: 0.35429690408146397
Energy: 0.32256376910743423
Energy: 0.34173399852902586
Energy: 0.35790645294701506
Energy: 0.3384543786309561
Energy: 0.3427517525128546
Energy: 0.3555468788828965
Energy: 0.33487550641213304
Energy: 0.374131308108787
Energy: 0.3382812097169745
Energy: 0.3636182116075073
Energy: 0.346845735623445
Energy: 0.3331572383328577
Energy: 0.34135373143622644
Energy: 0.3338688942988559
Energy: 0.3511009839866762
Energy: 0.34142749599063177
Energy: 0.3629889837696928
Energy: 0.3551236593740254
Energy: 0.3608928015041819
Energy: 0.3465615045674045
Energy: 0.36396799002317404
Energy: 0.36654544069715306
Energy: 0.36656793026183504
Energy: 0.36693889205924834
Energy: 0.35419288448391323
Energy: 0.3505826592826783
Energy: 0.3477162765638293
Energy: 0.3329209469628817
Energy: 0.38842616615239356
Energy: 0.34499834195172774
Energy: 0.3913402939612155
Energy: 0.343831710352142
Energy: 0.35862451968403464
Energy: 0.3651142185451401
Energy: 0.34089247744650825
Energy: 0.3663167724638532
Energy: 0.3576447689749224
Energy: 0.3361093726949041
Energy: 0.3444419408665787
Energy: 0.33199916968688603
Energy: 0.33926810093946347
Energy: 0.3429149470684639
Energy: 0.34967812302000706
Energy: 0.34338675757205017
Energy: 0.35470916759026955
Energy: 0.3421185705783073
Energy: 0.34317698636735844
Energy: 0.35232098547388546
Energy: 0.3366923383974921
Energy: 0.3560158037826929
Energy: 0.33866873933534947
Energy: 0.36289795871328406
Energy: 0.3452248935046601
Energy: 0.32951777805072924
Energy: 0.34543965294130097
Energy: 0.35498865510984273
Energy: 0.34335083198033794
Energy: 0.3531831824768053
Energy: 0.35635485433721814
Energy: 0.34865863952916654
Energy: 0.3610003455310995
Energy: 0.3406966271586705
Energy: 0.3628977693935937
Energy: 0.3690745558829377

minimum gb energy = 0.3188172809918418 eV
minimum distance =  2.58426688332268 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.31249869778250056
Energy: 0.3712326368976517
Energy: 0.45330165868805267
Energy: 0.3900473421639714
Energy: 0.3704159855138395
Energy: 0.36817883200908985
Energy: 0.302980824200243
Energy: 0.33400295616564984
Energy: 0.3315605669957209
Energy: 0.37360892643277943
Energy: 0.3716445005178865
Energy: 0.3411839747165364
Energy: 0.3337483299247786
Energy: 0.3462584551037351
Energy: 0.33589753835240216
Energy: 0.33868463075722494
Energy: 0.3565046255282562
Energy: 0.3823284385842373
Energy: 0.3322632997480861
Energy: 0.3308392376024489
Energy: 0.3339058051340588
Energy: 0.3368229082938383
Energy: 0.33786425050301344
Energy: 0.3726413142121654
Energy: 0.348519197326042
Energy: 0.36302085424766234
Energy: 0.3652128592344859
Energy: 0.3358597325783697
Energy: 0.33624975002314067
Energy: 0.33950334319757314
Energy: 0.35579468731752767
Energy: 0.3508397266952915
Energy: 0.3656136900478964
Energy: 0.3438013983656909
Energy: 0.3338522261377634
Energy: 0.3034364833869607
Energy: 0.3410632186695315
Energy: 0.34086716021349733
Energy: 0.34216579886250914
Energy: 0.33152708441109424
Energy: 0.3334968027047696
Energy: 0.3334504002317822
Energy: 0.3379148590773676
Energy: 0.36551270436047545
Energy: 0.3409621365725665
Energy: 0.3527529494570468
Energy: 0.30326686164337296
Energy: 0.30484102436101684
Energy: 0.3474879230543348
Energy: 0.30392492775981744
Energy: 0.3351009465784625
Energy: 0.36380537813876906
Energy: 0.3390024907031562
Energy: 0.36443332359328034
Energy: 0.35561485611484084
Energy: 0.3355670879673066
Energy: 0.30384759719703053
Energy: 0.3358936370902339
Energy: 0.37847535818812306
Energy: 0.33852700450808254
Energy: 0.34000150750447644
Energy: 0.35612227198434293
Energy: 0.33549159360686
Energy: 0.3367810567905661
Energy: 0.3576807455295619
Energy: 0.35793358180378937
Energy: 0.3837060516940107
Energy: 0.36088880280878183
Energy: 0.3337107687175573
Energy: 0.33323011006475095
Energy: 0.33579702132499006
Energy: 0.33900088133542916
Energy: 0.3667611873356859
Energy: 0.3370215034067542
Energy: 0.3403541583143768
Energy: 0.3419231959309558
Energy: 0.37133563286637833
Energy: 0.33541180581412444
Energy: 0.34182375259731956
Energy: 0.3353499315576371
Energy: 0.36094900594945317
Energy: 0.3695864022552294
Energy: 0.3416310415685922
Energy: 0.3357681067670142
Energy: 0.3085555649862561
Energy: 0.3394972762228389
Energy: 0.36306622367854935
Energy: 0.3444971537824991
Energy: 0.3531488846037622
Energy: 0.3643318650258551
Energy: 0.33405134758643734
Energy: 0.3758116965075353
Energy: 0.33563067813431724
Energy: 0.3484742890155685
Energy: 0.3555168560018485
Energy: 0.30308094301351524
Energy: 0.3048461355724643
Energy: 0.3475951805506281
Energy: 0.3032978861631395
Energy: 0.34238517770753296
Energy: 0.34758585980126105
Energy: 0.35846112175745387
Energy: 0.3036854936830581
Energy: 0.30323644967623725
Energy: 0.34658559566218283
Energy: 0.3125943661258627
Energy: 0.36209809076623395
Energy: 0.34846581714621655
Energy: 0.34319736878119844
Energy: 0.38848194597231567
Energy: 0.37423374889530164
Energy: 0.30347370846487115
Energy: 0.33392156260409606
Energy: 0.3314288879794103
Energy: 0.36638194398139673
Energy: 0.3712001485019791
Energy: 0.34140044801400843
Energy: 0.33364639062116236
Energy: 0.3462427200604526
Energy: 0.3385255529213271
Energy: 0.3380241405875049
Energy: 0.3558832608144412
Energy: 0.38228768762328863
Energy: 0.33213378679667305
Energy: 0.3306435731433005
Energy: 0.3338240892487208
Energy: 0.336790272027849
Energy: 0.3419455071469938
Energy: 0.3727062238074742
Energy: 0.3488123209258586
Energy: 0.3719978085684186
Energy: 0.36575357764591737
Energy: 0.3354235779997743
Energy: 0.3322103728001739
Energy: 0.3394507472508023
Energy: 0.35653529157639063
Energy: 0.34083146979893364
Energy: 0.3539372992576095
Energy: 0.3442857506238652
Energy: 0.3346173408756177
Energy: 0.30323465244262515
Energy: 0.34138353775599317
Energy: 0.3408875410160057
Energy: 0.3422600325654038
Energy: 0.33159601855602955
Energy: 0.3045457560119551
Energy: 0.3716156893181184
Energy: 0.35568198158926406
Energy: 0.3500509252528277
Energy: 0.34064229263070167
Energy: 0.3894804617284836
Energy: 0.3034777122888516
Energy: 0.3050186167773448
Energy: 0.3473219518508548
Energy: 0.304235436559181
Energy: 0.33502993984777635
Energy: 0.36348922991633054
Energy: 0.33893397885396387
Energy: 0.36445981973658903
Energy: 0.3573698900753485
Energy: 0.33358642982626285
Energy: 0.30387906609076687
Energy: 0.33614654483220174
Energy: 0.3598655242041495
Energy: 0.33805204024540964
Energy: 0.34009001784301535
Energy: 0.3510072445135691
Energy: 0.3754035810070276
Energy: 0.33665504740245195
Energy: 0.357673738978647
Energy: 0.3574383164479686
Energy: 0.3836198705257567
Energy: 0.36061973424610627
Energy: 0.3338751816532189
Energy: 0.33342592685007005
Energy: 0.335698174245717
Energy: 0.33816556463585395
Energy: 0.36391856835019953
Energy: 0.3359057436080018
Energy: 0.34048865111825966
Energy: 0.34250543243987686
Energy: 0.37087737685836625
Energy: 0.33570821879305235
Energy: 0.3417522086687332
Energy: 0.336026557112853
Energy: 0.36065593587591144
Energy: 0.3697019876409406
Energy: 0.3417277564035832
Energy: 0.3356241446102058
Energy: 0.30377033816215643
Energy: 0.3389214768923244
Energy: 0.36348707570231054
Energy: 0.344756355323603
Energy: 0.35315705829223637
Energy: 0.35464273146473296
Energy: 0.3339900020302228
Energy: 0.3745703745271696
Energy: 0.3357945953553417
Energy: 0.3490251829099463
Energy: 0.3760938104627515
Energy: 0.30322661748231505
Energy: 0.3048376905203401
Energy: 0.34787468602909605
Energy: 0.30328803699469353
Energy: 0.34225811292403185
Energy: 0.3474565662037021
Energy: 0.3422347149817511
Energy: 0.30378631679752993
Energy: 0.30347701912677316
Energy: 0.3468148061084839

minimum gb energy = 0.302980824200243 eV
minimum distance =  2.65450849883038 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 0.4118935762706166
Energy: 0.3817451029160339
Energy: 0.3898872878046191
Energy: 0.4615990358777827
Energy: 0.3183450260507876
Energy: 0.31934423094726316
Energy: 0.36036549390470846
Energy: 0.32362347870206376
Energy: 0.32930311912832444
Energy: 0.3757251626241493
Energy: 0.38271229577144367
Energy: 0.31011383815447896
Energy: 0.3633120654991235
Energy: 0.39857937188400444
Energy: 0.31780222599291763
Energy: 0.3448641242684568
Energy: 0.34326660310457097
Energy: 0.3431987999691674
Energy: 0.3187831563972477
Energy: 0.32713247983593163
Energy: 0.34663598751865526
Energy: 0.37003738611654097
Energy: 0.33896121822262376
Energy: 0.3421961503023958
Energy: 0.3442689659420537
Energy: 0.33377660641709433
Energy: 0.3225051962193828
Energy: 0.3408313122369522
Energy: 0.3182554791410859
Energy: 0.3144056603460625
Energy: 0.3380821009758945
Energy: 0.3316896615536916
Energy: 0.33093898849561604
Energy: 0.3359678573962902
Energy: 0.3337528011760926
Energy: 0.3056624843931124
Energy: 0.31636968126776566
Energy: 0.3433805987155118
Energy: 0.32434571313996435
Energy: 0.33681738804826866
Energy: 0.3174843743610878
Energy: 0.3325319796844188
Energy: 0.3857640748442581
Energy: 0.32366793347707923
Energy: 0.3224124962175038
Energy: 0.3405678020091628
Energy: 0.3058093647122376
Energy: 0.3066131608142226
Energy: 0.3322025986293353
Energy: 0.32050189090668224
Energy: 0.32988334906921307
Energy: 0.3479242984713347
Energy: 0.37476321476709823
Energy: 0.3480556784603243
Energy: 0.3175201619842086
Energy: 0.3493725955637259
Energy: 0.3262514059731096
Energy: 0.3445689466248255
Energy: 0.3446786453897081
Energy: 0.350347887477357
Energy: 0.377596289472942
Energy: 0.32761860988052743
Energy: 0.345829590779719
Energy: 0.32212340327466404
Energy: 0.3238583205747056
Energy: 0.3906039708916577
Energy: 0.34501285992763236
Energy: 0.3206143274311374
Energy: 0.3462133569482822
Energy: 0.3684791653508279
Energy: 0.3592430146789587
Energy: 0.3272439129365898
Energy: 0.3333862226153746
Energy: 0.3773051088077178
Energy: 0.30876124513144027
Energy: 0.30807649406217463
Energy: 0.3872329669420716
Energy: 0.3461837908209457
Energy: 0.3472560789011953
Energy: 0.39452799283452317
Energy: 0.337951165423763
Energy: 0.30587394379370936
Energy: 0.30583977581039823
Energy: 0.38414806828136006
Energy: 0.4037788576820052
Energy: 0.34684748946691163
Energy: 0.3476565889300303
Energy: 0.3817659659765715
Energy: 0.3363408809790014
Energy: 0.3459964266046304
Energy: 0.30553767581563146
Energy: 0.3068794082028594
Energy: 0.37541299210060475
Energy: 0.33553383844859325
Energy: 0.3360512682046605
Energy: 0.351028198548468
Energy: 0.3457239492763862
Energy: 0.3434765526814408
Energy: 0.31823781416401836
Energy: 0.3219224886226551
Energy: 0.33079362722754624
Energy: 0.34119174623281867
Energy: 0.3732936055005943
Energy: 0.3692914977626487
Energy: 0.40761365268398153
Energy: 0.34850026008953927
Energy: 0.33422348580407474
Energy: 0.35210262171508244
Energy: 0.3523594140157062
Energy: 0.3408724181466581
Energy: 0.35772647645666505
Energy: 0.3581983116973706
Energy: 0.3208894053473715
Energy: 0.33823413055391177
Energy: 0.33626498495345714
Energy: 0.3517630019571681
Energy: 0.3233936884567249
Energy: 0.32390323332830273
Energy: 0.3338826705627169
Energy: 0.30634222902277464
Energy: 0.3392901123133023
Energy: 0.36833312154836634
Energy: 0.3388526932610741
Energy: 0.3592815876827312
Energy: 0.36208001491304836
Energy: 0.3219119694163777
Energy: 0.306070469813785
Energy: 0.3411544684052151
Energy: 0.33134187325314624
Energy: 0.3432870927556888
Energy: 0.30555141147234616
Energy: 0.3054182610899734
Energy: 0.34086870252926854
Energy: 0.35399889223184255
Energy: 0.3294419970913019
Energy: 0.3330784958270984
Energy: 0.3360548389631728
Energy: 0.3294628465272938
Energy: 0.3175529494536381
Energy: 0.3457079135861427
Energy: 0.3182989777931801
Energy: 0.34239138570211375
Energy: 0.33515431926050715
Energy: 0.4035846767954478
Energy: 0.40716819223697615
Energy: 0.37714607012754814
Energy: 0.34617757128885374
Energy: 0.3280253618991008
Energy: 0.3244171431908397
Energy: 0.3321612785716261
Energy: 0.35195548237226276
Energy: 0.33581030208079227
Energy: 0.32372463389992234
Energy: 0.32892620945731704
Energy: 0.3185806408630256
Energy: 0.3377677950032681
Energy: 0.3410783132994026
Energy: 0.3472790357355353
Energy: 0.3367037734953556
Energy: 0.340261357806458
Energy: 0.32031644871719134
Energy: 0.317879290985049
Energy: 0.32464060405052386
Energy: 0.34041078092161087
Energy: 0.3542771798052307
Energy: 0.34052346815491313
Energy: 0.40573848461450895
Energy: 0.40774715332158384
Energy: 0.305197580089299
Energy: 0.37184963954976225
Energy: 0.36751544676970754
Energy: 0.3532114423103521
Energy: 0.33328792649865474
Energy: 0.3632331267266158
Energy: 0.32055322528618796

minimum gb energy = 0.305197580089299 eV
minimum distance =  2.54690439058545 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 0.41164263242188254
Energy: 0.4652010016930228
Energy: 0.42080066761277785
Energy: 0.4365188689496093
Energy: 0.41838674478600635
Energy: 0.4021007691270046
Energy: 0.43625788416757977
Energy: 0.394300259055442
Energy: 0.3739731831181636
Energy: 0.4085785499826349
Energy: 0.37785875861130264
Energy: 0.39628897741357627
Energy: 0.3232326722982626
Energy: 0.38382271178128946
Energy: 0.42388750394006214
Energy: 0.40295479327890044
Energy: 0.399363201305364
Energy: 0.3583309275792899
Energy: 0.34980953203409376
Energy: 0.38613454907137496
Energy: 0.4041271790902258
Energy: 0.3767625722338629
Energy: 0.43302251001472974
Energy: 0.368806358690086
Energy: 0.42103217988120095
Energy: 0.41483757916917385
Energy: 0.39881789254668587
Energy: 0.41638419446296915
Energy: 0.36388139339951026
Energy: 0.39646091934162847
Energy: 0.4050904514668506
Energy: 0.40822312579167136
Energy: 0.3570531960752432
Energy: 0.37736016658175886
Energy: 0.39357911851958016
Energy: 0.3667427325674613
Energy: 0.4025115835438484
Energy: 0.3708973587050461
Energy: 0.39516326754544717
Energy: 0.38408180626704586
Energy: 0.3700654623229895
Energy: 0.3782215441298077
Energy: 0.3800873570669369
Energy: 0.33718759968991574
Energy: 0.3798672299471037
Energy: 0.38648974373849654
Energy: 0.35351849662412893
Energy: 0.38188321562406563
Energy: 0.3572305646653692
Energy: 0.3625610667987342
Energy: 0.37314775258752836
Energy: 0.3808694378716518
Energy: 0.39535225274877306
Energy: 0.3391899709279533
Energy: 0.37443192722837715
Energy: 0.36374585455770564
Energy: 0.33350456308093374
Energy: 0.3546896886849987
Energy: 0.37304780228283246
Energy: 0.37691939976829714
Energy: 0.38597984034957267
Energy: 0.38404731028274447
Energy: 0.3837532926926752
Energy: 0.3628693227945414
Energy: 0.35235842517729077
Energy: 0.32487933278901837
Energy: 0.3527296272470747
Energy: 0.35181750207784107
Energy: 0.32760588757590037
Energy: 0.3569706377925228
Energy: 0.3607719223622421
Energy: 0.36106921055858276
Energy: 0.40230062001873707
Energy: 0.34003490929925534
Energy: 0.3718306989039483
Energy: 0.3465221652369339
Energy: 0.3962577356025371
Energy: 0.33642083052363675
Energy: 0.35247791124983097
Energy: 0.383915011801355
Energy: 0.39385878659463947
Energy: 0.3762258653370765
Energy: 0.4002667746599401
Energy: 0.35499602414229836
Energy: 0.3655251988762674
Energy: 0.3840828106708265
Energy: 0.3795407537256685
Energy: 0.41499592135614405
Energy: 0.39553402314093616
Energy: 0.3898980396696174
Energy: 0.3645716586198363
Energy: 0.3955311350967816
Energy: 0.3609181873510086
Energy: 0.37512214209636385
Energy: 0.36629065402311645
Energy: 0.3411575049671067
Energy: 0.3669100387344886
Energy: 0.34243109276173417
Energy: 0.35002079434731154
Energy: 0.40721540566824505
Energy: 0.3767282937650464
Energy: 0.3734368124629913
Energy: 0.3804041037130741
Energy: 0.37691176653199404
Energy: 0.4062519113646699
Energy: 0.35971568553141675
Energy: 0.3884883764620843
Energy: 0.3827798426967746
Energy: 0.36222963086643833
Energy: 0.37776794273863995
Energy: 0.3859546933746602
Energy: 0.389394550229362
Energy: 0.37353430509518265
Energy: 0.3875548676541416
Energy: 0.3623237339395939
Energy: 0.4057921392290985
Energy: 0.40274186097369796
Energy: 0.4123663302344412
Energy: 0.3879316902538586
Energy: 0.37178846399255633
Energy: 0.41107518442970287
Energy: 0.3860792052079255
Energy: 0.3946969704873777
Energy: 0.37123792686510504
Energy: 0.37215271083384727
Energy: 0.418858751835949
Energy: 0.32528995226105734
Energy: 0.3869709879894749
Energy: 0.40181290405874476
Energy: 0.3631710012626733
Energy: 0.3562623874334846
Energy: 0.3838929687460546
Energy: 0.3909605938258586
Energy: 0.3948873151701569
Energy: 0.3995244962131244
Energy: 0.3845481318317187
Energy: 0.4102669791700752
Energy: 0.4200935128355901
Energy: 0.4192175054421514
Energy: 0.3784323457116214
Energy: 0.4117158638967126
Energy: 0.4212814017477966
Energy: 0.4017534929289579
Energy: 0.40775714360257664
Energy: 0.40472812300590433
Energy: 0.39269231607216354
Energy: 0.4082472163061743
Energy: 0.4292381526510448
Energy: 0.37524806996943727
Energy: 0.3902036366095644
Energy: 0.3736655307874862
Energy: 0.3871212652675581
Energy: 0.36929257517382086
Energy: 0.40931545958293
Energy: 0.4183938640980836
Energy: 0.38525697943586257
Energy: 0.42506449161718046
Energy: 0.4187341336437385
Energy: 0.33547840428472475
Energy: 0.42153186894095107
Energy: 0.3908502369914128
Energy: 0.4181829037011943
Energy: 0.37312067470146054
Energy: 0.35575880919447844
Energy: 0.36139516614682093
Energy: 0.3682845534964221
Energy: 0.33869990664225935
Energy: 0.4016551691812656
Energy: 0.3774655833393343
Energy: 0.44473621788854323
Energy: 0.3929296779431347
Energy: 0.40869017523705176
Energy: 0.3602350314434259
Energy: 0.3888888019270167
Energy: 0.4104340595365096
Energy: 0.37782969696833724
Energy: 0.39732459952709537
Energy: 0.407942567372026
Energy: 0.4228807204443002
Energy: 0.41506432214120975
Energy: 0.39633927757856696
Energy: 0.4077938260474736
Energy: 0.3635564627683517
Energy: 0.3702861197853852
Energy: 0.3946778935766601
Energy: 0.361282994149567
Energy: 0.386574457738808
Energy: 0.39761275803365037
Energy: 0.4087008965845154
Energy: 0.3615574311426876
Energy: 0.40828038805649913
Energy: 0.36723422824141205
Energy: 0.38454691618974535
Energy: 0.38278194066757854
Energy: 0.3735015732958171
Energy: 0.3786854117728678
Energy: 0.3911848341352591
Energy: 0.36793466218012355
Energy: 0.3790741482293279
Energy: 0.36728628762983884
Energy: 0.3553310921033856
Energy: 0.3665661556410312
Energy: 0.3842056328272737
Energy: 0.3684314239444541
Energy: 0.3723690156042549
Energy: 0.3862688759175637
Energy: 0.4176309004984016
Energy: 0.3654108629840367
Energy: 0.37430224697957837
Energy: 0.3706320227492182
Energy: 0.3356232181930183
Energy: 0.36541112536892895
Energy: 0.3939512663479431
Energy: 0.3882661913088855
Energy: 0.39437556556362896
Energy: 0.3830604804664284
Energy: 0.3775598591550068
Energy: 0.3682704205358459
Energy: 0.36275296640463783
Energy: 0.39315108580805574
Energy: 0.35499772890893855
Energy: 0.3531056139342996
Energy: 0.3347587708819557
Energy: 0.3528184982686502
Energy: 0.358797788882258
Energy: 0.3653463476212218
Energy: 0.39806031384360846
Energy: 0.33706424836554477
Energy: 0.36513186381558926
Energy: 0.3458810623831448
Energy: 0.39173765161732743
Energy: 0.34197305017067825
Energy: 0.359026831842669
Energy: 0.3976201743078925
Energy: 0.39844365302954715
Energy: 0.3974943927337563
Energy: 0.40157161699041094
Energy: 0.3501845221424113
Energy: 0.3666362382904855
Energy: 0.37604731183558426
Energy: 0.37559370457210506
Energy: 0.3716313168996002
Energy: 0.3950763933917951
Energy: 0.3728360621478626
Energy: 0.3649492990211663
Energy: 0.39730478376968253
Energy: 0.3398514333586751
Energy: 0.3663640139061394
Energy: 0.3571301033252657
Energy: 0.35277337256998936
Energy: 0.38785614269822355
Energy: 0.3360650358891431
Energy: 0.3499563359362274
Energy: 0.4043971581455758
Energy: 0.3630998272024085
Energy: 0.3747946792193923
Energy: 0.3779570516258804
Energy: 0.36396382636901436
Energy: 0.36291353406118615
Energy: 0.3534213603592579
Energy: 0.3797231736997373
Energy: 0.3812402259991733
Energy: 0.35653427372501595
Energy: 0.3677259000691053
Energy: 0.38202230838921863
Energy: 0.39819232065692567
Energy: 0.37159123862209004
Energy: 0.40114844011724
Energy: 0.3966194395301057
Energy: 0.41530804996061993
Energy: 0.40912055084799276
Energy: 0.41407609104630777
Energy: 0.40508368858491633
Energy: 0.37242633576747064
Energy: 0.399685429536549
Energy: 0.3968087365666769
Energy: 0.3956445130453556
Energy: 0.42199138426965527
Energy: 0.36206931249420343
Energy: 0.3686401826948113
Energy: 0.41789579387521464
Energy: 0.39143518344888023
Energy: 0.3701107021166442
Energy: 0.3882401340027452
Energy: 0.3618269796245475
Energy: 0.36720953625430197
Energy: 0.3678938478743917
Energy: 0.4030597243977904
Energy: 0.4147677073822768
Energy: 0.4220676382512972
Energy: 0.40217413596973184
Energy: 0.4090362505519793
Energy: 0.41678854125152875
Energy: 0.39011238088391426
Energy: 0.4124102132756914
Energy: 0.38966771007165557
Energy: 0.4009621195566212
Energy: 0.3810240013607831
Energy: 0.35661194106501337
Energy: 0.3418692427672532
Energy: 0.41436865419891117
Energy: 0.35411471781340237
Energy: 0.4135456341249746
Energy: 0.4106506778730543
Energy: 0.3555940513501392
Energy: 0.4080453853823257
Energy: 0.39640643703079
Energy: 0.40670112507565287
Energy: 0.4194777390416432
Energy: 0.4118850219742418
Energy: 0.3818448932181525
Energy: 0.4248797664867533
Energy: 0.4223496783110132
Energy: 0.4144152194500278
Energy: 0.3994568630501526

minimum gb energy = 0.3232326722982626 eV
minimum distance =  2.47479691843448 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.389311469855441
Energy: 0.49858218354590916
Energy: 0.3832580015021934
Energy: 0.3842991893904652
Energy: 0.3832460733750993
Energy: 0.38222331153786654
Energy: 0.3969788045119201
Energy: 0.3713672193565315
Energy: 0.48168900326544023
Energy: 0.36884901902877487
Energy: 0.36731372171996973
Energy: 0.37109373907199805
Energy: 0.3701371699589575
Energy: 0.4813640963879584
Energy: 0.369668478131447
Energy: 0.505504994220846
Energy: 0.36974939086677255
Energy: 0.3701769451359751
Energy: 0.3703779432076414
Energy: 0.3704150908554205
Energy: 0.3888097547177674
Energy: 0.37031987339150557
Energy: 0.5057367517754003
Energy: 0.3693461175557062
Energy: 0.3727015579398307
Energy: 0.371786350637384
Energy: 0.37036472169631224
Energy: 0.395626694851508
Energy: 0.3655604980146272
Energy: 0.48130242380027705
Energy: 0.36263907922366334
Energy: 0.4827028803134132
Energy: 0.36766502160030673
Energy: 0.3628130384630819
Energy: 0.4817400280504907
Energy: 0.3731046350201853
Energy: 0.5025258917967811
Energy: 0.3638133151323699
Energy: 0.3647292492206459
Energy: 0.36741697812722096
Energy: 0.36463051706543637
Energy: 0.39749986769388534
Energy: 0.3711354504025922
Energy: 0.48458932262540166
Energy: 0.3717231773657629
Energy: 0.37027968915733495
Energy: 0.3704048074280995
Energy: 0.3690713685112642
Energy: 0.4815291034887814
Energy: 0.3700936313786008
Energy: 0.5067285438689446
Energy: 0.37058480493548346
Energy: 0.37008066927538824
Energy: 0.3700801625261548
Energy: 0.371420617150039
Energy: 0.4850596904582619
Energy: 0.37187498771308536
Energy: 0.5055013160316655
Energy: 0.37033975632518895
Energy: 0.36373729647172737
Energy: 0.36452969463633067
Energy: 0.3709220032242174
Energy: 0.39779207603538885
Energy: 0.3652609188117197
Energy: 0.4816320619578689
Energy: 0.3625407032218623
Energy: 0.4841734743673533
Energy: 0.4832362948743344
Energy: 0.36326012499726407
Energy: 0.48155475110202545
Energy: 0.3709113109872232
Energy: 0.5056528895774098
Energy: 0.369586544378464
Energy: 0.36382423874551634
Energy: 0.3642615814328687
Energy: 0.37023921924472886
Energy: 0.3983153027926392
Energy: 0.3702380810898404
Energy: 0.5056294868193181
Energy: 0.3700160000563348
Energy: 0.3702651108518563
Energy: 0.3701772382823306
Energy: 0.37057854796727685
Energy: 0.4767602757011846
Energy: 0.37072420577033927
Energy: 0.4812966402654506
Energy: 0.37064241734078157
Energy: 0.37073723854080853
Energy: 0.3702296551185935
Energy: 0.3691158192054642
Energy: 0.4816836472182917
Energy: 0.3815150001562347
Energy: 0.51927280581232
Energy: 0.3635929068156838
Energy: 0.3639807328192554
Energy: 0.36530391724491496
Energy: 0.3642831673270564
Energy: 0.3973010604991203
Energy: 0.36574726954187425
Energy: 0.4817073901274017
Energy: 0.3628867066314087
Energy: 0.36787606052635213
Energy: 0.3709471678360108
Energy: 0.3700438111971005
Energy: 0.48158308157178076
Energy: 0.3698088063297329
Energy: 0.5054876021430467
Energy: 0.3692975272708225
Energy: 0.37110938847764463
Energy: 0.37094232625472573
Energy: 0.37008891745105454
Energy: 0.39551772156526743
Energy: 0.3702693040766327
Energy: 0.5059140349653408
Energy: 0.3695465379524887
Energy: 0.37079056407346267
Energy: 0.37432293018647483
Energy: 0.3705135552988778
Energy: 0.3948211789675797
Energy: 0.3659243281192227
Energy: 0.48146011180162035
Energy: 0.36991522202594646
Energy: 0.3715616519983842
Energy: 0.3686935510298042
Energy: 0.37032235612334435
Energy: 0.48158830463008334
Energy: 0.3864497383363216
Energy: 0.4943544672750552
Energy: 0.363528338927157
Energy: 0.3835094640009442
Energy: 0.381596952519333
Energy: 0.36423645371319086
Energy: 0.39723562013414937
Energy: 0.3710897341057889
Energy: 0.48160591467316943
Energy: 0.3690546151718628
Energy: 0.3689307238671354
Energy: 0.3707150593733337
Energy: 0.3699741426915435
Energy: 0.48190112191416573

minimum gb energy = 0.3625407032218623 eV
minimum distance =  2.51620985009996 Angstroms
sigma value = 23