Model name: model_name=EAM_Dynamo_Olsson_2009_Fe__MO_024705128470_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.678452149033547
cohesive_energy=4.224994686759812
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: -1e-07 eV

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

Energy: 0.017840837852001613
Energy: 0.3381322263695178
Energy: 0.3381322263695178
Energy: 0.017840837852001613
Energy: 0.33813222636812174
Energy: 0.3381322263695178
Energy: 0.017840837852001613
Energy: 0.3381322263695178
Energy: 0.33813222636812174
Energy: 0.017840837852001613
Energy: 0.3347774315590708
Energy: 0.021394008525546408
Energy: 0.33517051590820945
Energy: 0.3347774315590708
Energy: 0.021394008525546408
Energy: 0.33517051590820945
Energy: 0.3347774315590708
Energy: 0.021394008525546408
Energy: 0.33517051590820945
Energy: 0.3347774315590708
Energy: 0.7906323924254693
Energy: 0.19102369766248387
Energy: 0.19102369766108782
Energy: 0.7906316093216603
Energy: 0.19102369766248387
Energy: 0.19102369766108782
Energy: 0.790359765048654
Energy: 0.5619389623772804
Energy: 0.19102369766108782
Energy: 0.7903602471353738
Energy: 0.3347774315590708
Energy: 0.3351705159068134
Energy: 0.021394008525546408
Energy: 0.3347774315590708
Energy: 0.3351705159068134
Energy: 0.021394008525546408
Energy: 0.3347774315590708
Energy: 0.3351705159068134
Energy: 0.021394008525546408
Energy: 0.3347774315590708
Energy: 0.017840837852001613
Energy: 0.3381322263695178
Energy: 0.3381322263695178
Energy: 0.017840837852001613
Energy: 0.33813222636812174
Energy: 0.3381322263695178
Energy: 0.017840837852001613
Energy: 0.3381322263695178
Energy: 0.3381322263695178
Energy: 0.017840837852001613
Energy: 0.3347774315590708
Energy: 0.021394008525546408
Energy: 0.3351705159068134
Energy: 0.3347774315590708
Energy: 0.021394008525546408
Energy: 0.3351705159068134
Energy: 0.3347774315590708
Energy: 0.021394008525546408
Energy: 0.3351705159068134
Energy: 0.3347774315590708
Energy: 0.7904139213058919
Energy: 0.19102369766108782
Energy: 0.19102369766248387
Energy: 0.7905390668622349
Energy: 0.19102369766108782
Energy: 0.19102369766248387
Energy: 0.7903589143784377
Energy: 0.19102369766108782
Energy: 0.19102369766248387
Energy: 0.7903894453522645

minimum gb energy = 0.017840837852001613 eV
minimum distance =  2.31472247740621 Angstroms
sigma value = 3


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

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Energy: 0.8181311456506546
Energy: 0.8186001101179028
Energy: 0.6467529878843762
Energy: 0.8181311456499707
Energy: 0.8186001101172188
Energy: 0.7086849826671893
Energy: 0.8181311456568099
Energy: 0.8186001101165349
Energy: 0.646752987947298
Energy: 0.718396748714416
Energy: 0.6897909520291562
Energy: 0.8035501155778203
Energy: 0.7183967487178357
Energy: 0.6897909520291562
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Energy: 0.718396748714416
Energy: 0.6897909520325758
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Energy: 0.7183967487212551
Energy: 0.7508563662829395
Energy: 0.7910745600280269
Energy: 0.6675357530583763
Energy: 0.7662133744303908
Energy: 0.7910745600293948
Energy: 0.6675357649159026
Energy: 0.7508563662829395
Energy: 0.7910745600300788
Energy: 0.6675357554203065
Energy: 0.7662133744269711
Energy: 0.825389810654517
Energy: 0.8195629097187674
Energy: 0.6447867807111055
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Energy: 0.8253898106542061
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Energy: 0.6125551701848441
Energy: 0.8488662152617986
Energy: 0.7915002978829672
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Energy: 0.6560354811543336
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Energy: 0.6416669847207036
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Energy: 0.7485666724551847
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Energy: 0.8499435709477533
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Energy: 0.8127659201346047
Energy: 0.6447379060339048
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Energy: 0.8403253741782156
Energy: 0.8199150661357717
Energy: 0.6906379248788961
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Energy: 0.8199150661391914
Energy: 0.6909016539835998
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Energy: 0.8199150661391914
Energy: 0.6906379248856733
Energy: 0.8403253741747958
Energy: 0.6888552541748747
Energy: 1.0139526697683323
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Energy: 1.013952669771752
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Energy: 0.6976556178400184
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Energy: 0.8168298402081265
Energy: 0.8040288070446041
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Energy: 0.8168298402098674
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Energy: 0.8633690189955652
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Energy: 0.612367323396475
Energy: 0.8633690190024045
Energy: 0.8489676710850571
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Energy: 0.8202586936822525
Energy: 0.6448800497982097
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Energy: 0.6448800497985826
Energy: 0.7536167703937898
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Energy: 0.6448800497965308
Energy: 0.7536167703954686
Energy: 0.8202586936795166
Energy: 0.7811701280786156
Energy: 0.9602909293823318
Energy: 0.7066386430192911
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Energy: 0.7066386430021928
Energy: 0.7811701281777237
Energy: 0.9602909293789123
Energy: 0.7066386430056125
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Energy: 0.6867191723751742
Energy: 0.8395193609991215
Energy: 0.6911823300727427
Energy: 0.6867191723724385
Energy: 0.8395193609991215
Energy: 0.6911041401086931
Energy: 0.6867191723734954
Energy: 0.8395193609991215
Energy: 0.6911823300761624
Energy: 0.6867191723769152
Energy: 0.7546986482635306
Energy: 0.8181311456492867
Energy: 0.818600110116224
Energy: 0.7555917911396444
Energy: 0.8181311456495975
Energy: 0.818600110116224
Energy: 0.7546986482614788
Energy: 0.8181311456561261
Energy: 0.8186001101185867
Energy: 0.7555917911372194
Energy: 0.718396748714416
Energy: 0.6897909520291562
Energy: 0.8035501155778203
Energy: 0.718396748714416
Energy: 0.6897909520291562
Energy: 0.8035501155778203
Energy: 0.7183967487178357
Energy: 0.6897909520291562
Energy: 0.8035501155744006
Energy: 0.718396748714416
Energy: 0.7468455669488385
Energy: 0.7910745600290839
Energy: 0.6675357551092415
Energy: 0.7361565519810214
Energy: 0.7910745600290839
Energy: 0.6675357590845687
Energy: 0.746845566904445
Energy: 0.7910745600307627
Energy: 0.6675357532565924
Energy: 0.7361565519844412
Energy: 0.82538981065489
Energy: 0.8195629097194514
Energy: 0.6447867807121624
Energy: 0.8253898106532114
Energy: 0.8195629097201353
Energy: 0.6447867807158929
Energy: 0.8253898106528382
Energy: 0.8195629097187674
Energy: 0.6447867807124733
Energy: 0.8253898106558849

minimum gb energy = 0.6123673233862161 eV
minimum distance =  2.4171916202241 Angstroms
sigma value = 75


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

Energy: 1.1705016092033567
Energy: 0.8214079249958126
Energy: 0.8218340192419803
Energy: 1.0680256670973634
Energy: 0.8214079249958126
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Energy: 1.0229704552096073
Energy: 0.9993864689998774
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minimum gb energy = 0.8177347946079183 eV
minimum distance =  2.30155368269498 Angstroms
sigma value = 105


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

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Energy: 0.9666992226013049
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Energy: 0.8452473508854903
Energy: 0.8448966658635085
Energy: 0.7977931330471328
Energy: 0.8098771255684356
Energy: 0.8091499594830499
Energy: 0.7977931330452503
Energy: 0.8098771255722005
Energy: 0.8091499594849324
Energy: 0.7977931330452503
Energy: 0.8098771255722005
Energy: 0.8091499594868148
Energy: 0.797793133043368
Energy: 0.7828730560358562
Energy: 0.8057169250734636
Energy: 0.9338336525074394
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Energy: 0.8058112191617329
Energy: 0.9338336525055572
Energy: 0.7828730560339737
Energy: 0.8057169250734636
Energy: 0.9338336525074394
Energy: 0.7828730560320912
Energy: 1.041984706251607
Energy: 0.8062041133946302
Energy: 0.9865445894098895
Energy: 1.0419847062497245
Energy: 0.806362544841891
Energy: 0.9865445894098895
Energy: 1.041984706251607
Energy: 0.8062041133927478
Energy: 0.9865445894080069
Energy: 1.0419847062534895
Energy: 0.8443063429266613
Energy: 0.8506154456322579
Energy: 0.9624136719513285
Energy: 0.8443063429285438
Energy: 0.8506154456322579
Energy: 0.9624136719475636
Energy: 0.8443063429247789
Energy: 0.8506154456322579
Energy: 0.9624136719513285
Energy: 0.8443063429247789
Energy: 0.8848262413601018
Energy: 0.9034938920308063
Energy: 0.9575579270878974
Energy: 0.8848262413544544
Energy: 0.9045724830216049
Energy: 0.9575579270860152
Energy: 0.8848262413544544
Energy: 0.9034938920308063
Energy: 0.9575579270878974
Energy: 0.8848262413582194
Energy: 1.0311402295888856
Energy: 0.8623473153861755
Energy: 0.9802575012279657
Energy: 1.0311402295888856
Energy: 0.8619497171935127
Energy: 0.9802575012279657
Energy: 1.0311402295870031
Energy: 0.8623473153861755
Energy: 0.9802575012279657
Energy: 1.0311402295888856
Energy: 0.8793031714236571
Energy: 0.8278177748615284
Energy: 0.9094811895436327
Energy: 0.8793031714255395
Energy: 0.8277778967882121
Energy: 0.9094811895398678
Energy: 0.8793031714236571
Energy: 0.8278177748615284
Energy: 0.9094811895436327
Energy: 0.8793031714236571

minimum gb energy = 0.7826628799474246 eV
minimum distance =  2.28565219760742 Angstroms
sigma value = 165


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

Energy: 1.0888183080678742
Energy: 1.0203660107903094
Energy: 1.0440293709423885
Energy: 1.0432098906447047
Energy: 1.0203660107896633
Energy: 1.044029370941742
Energy: 1.0888183080685205
Energy: 1.0203660107883705
Energy: 1.0440293709430346
Energy: 1.0432098906427658
Energy: 1.0596940652975597
Energy: 1.0255670063246825
Energy: 1.017287164107631
Energy: 1.0596940652975597
Energy: 1.0255670063246825
Energy: 1.0172871641089236
Energy: 1.0596940653001445
Energy: 1.0255670063253286
Energy: 1.0172871641082775
Energy: 1.059694065298206
Energy: 1.0199022573594547
Energy: 1.0313778389715613
Energy: 0.9952232719676445
Energy: 1.0199022573594547
Energy: 1.0313778389722077
Energy: 0.9954168889914655
Energy: 1.0199022573588086
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Energy: 1.0199022573581622
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Energy: 1.0278905644005607
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Energy: 1.0466588544431767
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Energy: 1.0351061234729853
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Energy: 1.080287315328202
Energy: 1.0557809449793005
Energy: 1.0351061234729853
Energy: 1.079979656318358
Energy: 1.0557809449786542
Energy: 1.0661009311713516
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Energy: 1.102075548403219
Energy: 1.0286198961425776
Energy: 1.0432432393934716
Energy: 1.1020755484019265
Energy: 1.0661009311707057
Energy: 1.0432432393954105
Energy: 1.102075548403219
Energy: 1.0286198961425776
Energy: 1.0780863936439826
Energy: 1.019264515404059
Energy: 1.1211596792946916
Energy: 1.0185993838480139
Energy: 1.01926452928792
Energy: 1.0805892932084311
Energy: 1.0780863936433365
Energy: 1.0192645129817168
Energy: 1.1211596792959844
Energy: 1.0185993838480139
Energy: 1.0435301204804461
Energy: 1.0283751600189972
Energy: 1.0040753508811664
Energy: 1.0435301185612431
Energy: 1.0283751600189972
Energy: 1.0040753508818125
Energy: 1.0435301192007425
Energy: 1.0283751600202895
Energy: 1.00407535088052
Energy: 1.0435301182634957
Energy: 1.0541324380406585
Energy: 0.9953281561930032
Energy: 1.0335492704560736
Energy: 1.0541324353463606
Energy: 0.9953281561930032
Energy: 1.0335492744506967
Energy: 1.0541325378376776
Energy: 0.995328156192357
Energy: 1.0335492678883236
Energy: 1.0541324851001084
Energy: 1.0627307671667756
Energy: 1.082213205750317
Energy: 1.022853519163182
Energy: 1.0627307671687143
Energy: 1.0822132057509632
Energy: 1.0228535191638284
Energy: 1.0627307671680681
Energy: 1.0822132057483782
Energy: 1.022853519163182
Energy: 1.0627307671687143
Energy: 1.0432098906427658
Energy: 1.0203660107883705
Energy: 1.0440293709443271
Energy: 1.0432098906421194
Energy: 1.0203660107896633
Energy: 1.0440293709430346
Energy: 1.043209890643412
Energy: 1.0203660107877244
Energy: 1.0440293709430346
Energy: 1.0432098906440583

minimum gb energy = 0.9952232719676445 eV
minimum distance =  2.3476856288212 Angstroms
sigma value = 41


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

Energy: 0.8921033520241716
Energy: 0.9003809838031314
Energy: 0.9008900838763053
Energy: 0.8436634303042139
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Energy: 0.866490350741946
Energy: 1.0506731058515066
Energy: 0.7504726425593976
Energy: 0.8664903507469609
Energy: 0.8988481696480066
Energy: 0.8630175764098825
Energy: 0.8708959427505826
Energy: 0.7832260080758845
Energy: 0.8630175764098825
Energy: 0.87089594275309
Energy: 0.8988481696429919
Energy: 0.8630175764098825
Energy: 0.8708959427430604
Energy: 0.7832260080783918
Energy: 0.940047224956005
Energy: 0.7462180027728611
Energy: 0.9030164547276934
Energy: 0.9400472249585126
Energy: 0.7462180027753683
Energy: 0.9030164547276934
Energy: 0.940047224956005
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Energy: 0.9030164547302009
Energy: 0.9400472249534977
Energy: 0.8517798714120989
Energy: 0.8202932945100904
Energy: 0.8177964821541156
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Energy: 0.8202932945125978
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Energy: 0.8177964821541156
Energy: 0.8517798714095914
Energy: 0.9123822301247688
Energy: 0.8650349111262189
Energy: 0.8087782095697205
Energy: 0.9123822301297835
Energy: 0.8650349111136818
Energy: 0.808491013049383
Energy: 0.9123822301297835
Energy: 0.8650349111237116
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Energy: 0.9123822301297835
Energy: 0.8197580818249705
Energy: 1.1689613241383452
Energy: 0.8247734888027055
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Energy: 0.8247734887976906
Energy: 0.8197580818274778
Energy: 1.1689613241358379
Energy: 0.8247734887976906
Energy: 0.8197580818274778
Energy: 0.8175370161310603
Energy: 0.7655061647517976
Energy: 0.7886186897301775
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Energy: 0.7655061647492901
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Energy: 0.8175370161335677
Energy: 0.7655061647517976
Energy: 0.7886186897226551
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Energy: 0.8209850200924733
Energy: 0.824804811609951
Energy: 0.8651070576308545
Energy: 0.8209850200924733
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Energy: 0.8651070576308545
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Energy: 0.8248048116049362
Energy: 0.8651070576308545
Energy: 0.8209850200924733
Energy: 0.8847350881630727
Energy: 0.7521316459771263
Energy: 0.8585883866296579
Energy: 0.8847350881605653
Energy: 0.7521316459771263
Energy: 0.8585883866321654
Energy: 0.8847350881630727
Energy: 0.7521316459796338
Energy: 0.8585883866346726
Energy: 0.8847350881630727
Energy: 0.8992850797808056
Energy: 0.9014219854237672
Energy: 0.8733844703070612
Energy: 0.8992850797808056
Energy: 0.90142198542126
Energy: 0.8947753527529065
Energy: 0.8992850797833131
Energy: 0.9014219854262748
Energy: 0.8733844703095687
Energy: 0.8992850797808056
Energy: 0.7509884494331515
Energy: 0.8881667520613876
Energy: 0.836270511497834
Energy: 0.750988449430644
Energy: 0.8240742426439112
Energy: 0.8636940027531685
Energy: 0.7509884494331515
Energy: 0.8881667520664024
Energy: 0.8362705114953267
Energy: 0.7509884494281366
Energy: 0.746102812666095
Energy: 0.8340856440975841
Energy: 0.8509284791997773
Energy: 0.746102812666095
Energy: 0.8340686057147056
Energy: 0.8505415810062167
Energy: 0.7461028126686025
Energy: 0.8340856440975841
Energy: 0.8509284791997773
Energy: 0.7461028126686025
Energy: 0.7682536510426586
Energy: 0.8192803475723496
Energy: 0.8430882299861617
Energy: 0.7682536510401512
Energy: 0.8189913734624367
Energy: 0.8430882299886692
Energy: 0.7682536510401512
Energy: 0.8192803475723496
Energy: 0.8430882299886692
Energy: 0.7682536510351363
Energy: 0.936387323822207
Energy: 0.8170901930501089
Energy: 0.9105208645866916
Energy: 0.936387323822207
Energy: 0.8172355838311891
Energy: 0.910520864589199
Energy: 0.9363873238196996
Energy: 0.8170901930501089
Energy: 0.9105208645917063
Energy: 0.9363873238196996
Energy: 0.846408988793116
Energy: 0.8719813600352379
Energy: 0.8077504465549458
Energy: 0.8464089887981308
Energy: 0.8719813600352379
Energy: 0.8077504465574531
Energy: 0.8464089887956233
Energy: 0.8719813600327305
Energy: 0.8077504465549458
Energy: 0.846408988793116

minimum gb energy = 0.744868393493008 eV
minimum distance =  2.34970831047195 Angstroms
sigma value = 185


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

Energy: 1.1188591269602821
Energy: 0.42624259494609473
Energy: 0.4264249932522779
Energy: 0.7351020567658424
Energy: 0.4262425949488006
Energy: 0.4264249932520073
Energy: 1.1188591269614723
Energy: 0.4262425949478806
Energy: 0.4264249932522779
Energy: 0.7351020567661671
Energy: 0.8065057727482873
Energy: 0.42601794523355013
Energy: 0.53170152246478
Energy: 0.7745084941717735
Energy: 0.42601794523295483
Energy: 0.5181515740595567
Energy: 0.8065057727521295
Energy: 0.42601794523566067
Energy: 0.5317015230330627
Energy: 0.7745084941777263
Energy: 0.7536685891206188
Energy: 0.42756007280311237
Energy: 0.7177314093956043
Energy: 0.7845726763645298
Energy: 0.4275600728060888
Energy: 0.6867648534521492
Energy: 0.7536685891229999
Energy: 0.4275600728060888
Energy: 0.7177314093905713
Energy: 0.7845726763663157
Energy: 0.8910915711092156
Energy: 0.4278980831520903
Energy: 0.8760361521235372
Energy: 0.8910915711133826
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Energy: 0.6855089079902624
Energy: 0.8910915711145732
Energy: 0.427898083153281
Energy: 0.8760361521255938
Energy: 0.8910915711115968
Energy: 0.4670141441357293
Energy: 0.42404624488706594
Energy: 0.7525087695708658
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Energy: 0.4240462448858754
Energy: 0.5453081721071983
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Energy: 0.42404624488647064
Energy: 0.7525087695705952
Energy: 0.4670141441363245
Energy: 0.7877084195987608
Energy: 0.6915290571731392
Energy: 0.7987223037897443
Energy: 0.7877084195978951
Energy: 0.5555301002342135
Energy: 0.8032550231844368
Energy: 0.7877084195984901
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Energy: 0.798722303789149
Energy: 0.7877084195987608
Energy: 0.5663619212706984
Energy: 0.7257038401399342
Energy: 0.7494434662344126
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Energy: 0.8379155376816105
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Energy: 0.7494434663263574
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Energy: 0.7799485375198032
Energy: 0.6272766038532435
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Energy: 0.7799485374945307
Energy: 0.6747840184459787
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Energy: 0.7799485374448514
Energy: 0.6272766038508624
Energy: 0.4267329267963695
Energy: 0.7799485373832661
Energy: 0.5555159677336893
Energy: 0.8389821016710061
Energy: 0.4278298820708349
Energy: 0.5895135914699564
Energy: 0.7635217296568134
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Energy: 0.5555159677345551
Energy: 0.8389821016677049
Energy: 0.4278298820696443
Energy: 0.5895135914717424
Energy: 0.719370926133862
Energy: 0.705434123137932
Energy: 0.4271597416811205
Energy: 0.6255801508562369
Energy: 0.6279428516943864
Energy: 0.427159741679064
Energy: 0.7193709261160034
Energy: 0.7054341231387978
Energy: 0.427159741679064
Energy: 0.6255801508625143
Energy: 0.856653091391817
Energy: 0.6873145797113825
Energy: 0.42611478113596724
Energy: 0.87743296962293
Energy: 0.687314579554281
Energy: 0.4261147811347767
Energy: 0.856653091391817
Energy: 0.6873145798553879
Energy: 0.426114781134452
Energy: 0.8774329696247158
Energy: 0.8441887352234604
Energy: 0.42624259494669003
Energy: 0.4264249932520073
Energy: 0.825928023119971
Energy: 0.42624259494820527
Energy: 0.4264249932522779
Energy: 0.8441887352237851
Energy: 0.4262425949478806
Energy: 0.4264249932526026
Energy: 0.825928023119971
Energy: 0.769783754149974
Energy: 0.4260179452338748
Energy: 0.6192093489254371
Energy: 0.8626408450054381
Energy: 0.42601794523355013
Energy: 0.6336354703692908
Energy: 0.769783754149974
Energy: 0.426017945235336
Energy: 0.6192093489266277
Energy: 0.8626408450063581
Energy: 0.7179912997310554
Energy: 0.42756007280370767
Energy: 0.6289499765720756
Energy: 0.6371488502507985
Energy: 0.4275600728058182
Energy: 0.7062168260818831
Energy: 0.7179912997254272
Energy: 0.4275600728066841
Energy: 0.6289499765738615
Energy: 0.637148850255236
Energy: 0.891091571109811
Energy: 0.42789808315241507
Energy: 0.7613133068823199
Energy: 0.8910915711139777
Energy: 0.4278980831506292
Energy: 0.8395512753685952
Energy: 0.8910915711145732
Energy: 0.4278980831520903
Energy: 0.7613133068805341
Energy: 0.891091571111272
Energy: 0.46701414413486336
Energy: 0.42404624488766124
Energy: 0.6750858468682548
Energy: 0.4670141441345386
Energy: 0.4240462448850095
Energy: 0.6271538786523143
Energy: 0.467014144133348
Energy: 0.42404624488647064
Energy: 0.6750858468697701
Energy: 0.4670141441351339
Energy: 0.7877084195967043
Energy: 0.5437089679646154
Energy: 0.8400900079132244
Energy: 0.7877084195969749
Energy: 0.6706202201038679
Energy: 0.7260982148080436
Energy: 0.7877084195987608
Energy: 0.5437089679640204
Energy: 0.8400900079164715
Energy: 0.7877084195981655
Energy: 0.5663619212710231
Energy: 0.80309212100069
Energy: 0.749443466297513
Energy: 0.5663619212695079
Energy: 0.802393191780209
Energy: 0.7494434664644098
Energy: 0.5663619212698325
Energy: 0.803092120998309
Energy: 0.7494434663474631
Energy: 0.5663619212698325
Energy: 0.7799485380142702
Energy: 0.5451581153927363
Energy: 0.4267329267960448
Energy: 0.7799485380472817
Energy: 0.7525290341611646
Energy: 0.4267329267942589
Energy: 0.7799485379862918
Energy: 0.5451581153912212
Energy: 0.42673292679664004
Energy: 0.7799485379791483
Energy: 0.5412711010924636
Energy: 0.6857883352571799
Energy: 0.4278298820696443
Energy: 0.5031160876985764
Energy: 0.8798179238913316
Energy: 0.4278298820708349
Energy: 0.5412711010912731
Energy: 0.6857883352574504
Energy: 0.4278298820699149
Energy: 0.5031160877000377
Energy: 0.6853713850281153
Energy: 0.6854967325099274
Energy: 0.4271597416796593
Energy: 0.7846197697108266
Energy: 0.7162592756334881
Energy: 0.427159741679064
Energy: 0.6853713850266542
Energy: 0.6854967325075463
Energy: 0.42715974168025456
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Energy: 0.9794750320896468
Energy: 0.6873145799330458
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Energy: 0.8251592059492677
Energy: 0.6873145799148624
Energy: 0.42611478113564255
Energy: 0.9794750320887267
Energy: 0.6873145796736089
Energy: 0.4261147811341814
Energy: 0.8251592059474817
Energy: 1.1188591269602821
Energy: 0.4262425949464195
Energy: 0.4264249932520073
Energy: 0.7351020567676283
Energy: 0.42624259494939587
Energy: 0.4264249932516826
Energy: 1.118859126960877
Energy: 0.42624259494820527
Energy: 0.4264249932522779
Energy: 0.7351020567676283
Energy: 0.8065057727066172
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Energy: 0.5317015220117125
Energy: 0.7745084941836792
Energy: 0.42601794523295483
Energy: 0.518151574774821
Energy: 0.8065057727111089
Energy: 0.426017945235336
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Energy: 0.7745084941840039
Energy: 0.7536685891209436
Energy: 0.42756007280462766
Energy: 0.717731409395009
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Energy: 0.4275600728060888
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Energy: 0.7536685891227295
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Energy: 0.717731409390842
Energy: 0.7845726763648545
Energy: 0.8910915711088908
Energy: 0.4278980831514951
Energy: 0.8760361521232126
Energy: 0.8910915711124627
Energy: 0.42789808315030453
Energy: 0.6855089079899377
Energy: 0.8910915711133826
Energy: 0.4278980831520903
Energy: 0.8760361521232126
Energy: 0.8910915711106768
Energy: 0.4670141441357293
Energy: 0.42404624488620013
Energy: 0.7525087695708658
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Energy: 0.4240462448850095
Energy: 0.5453081721054125
Energy: 0.467014144133348
Energy: 0.42404624488706594
Energy: 0.7525087695688093
Energy: 0.4670141441366492
Energy: 0.7877084195972996
Energy: 0.6915290571972212
Energy: 0.7987223037894197
Energy: 0.7877084195951891
Energy: 0.5555301002252842
Energy: 0.803255023185032
Energy: 0.7877084195969749
Energy: 0.6915290571528994
Energy: 0.798722303789149
Energy: 0.7877084195990854
Energy: 0.5663619212698325
Energy: 0.7257038401411248
Energy: 0.7494434662805203
Energy: 0.5663619212695079
Energy: 0.8379155376822058
Energy: 0.7494434665750791
Energy: 0.5663619212701031
Energy: 0.7257038401390683
Energy: 0.7494434663623453
Energy: 0.5663619212689126
Energy: 0.7799485383722001
Energy: 0.6272766038535682
Energy: 0.42673292679544944
Energy: 0.7799485384733448
Energy: 0.6747840184459787
Energy: 0.4267329267933931
Energy: 0.7799485383751765
Energy: 0.6272766038502672
Energy: 0.4267329267960448
Energy: 0.779948538287994
Energy: 0.5555159677333645
Energy: 0.8389821016716014
Energy: 0.4278298820699149
Energy: 0.5895135914714176
Energy: 0.7635217296585993
Energy: 0.4278298820696443
Energy: 0.5555159677333645
Energy: 0.8389821016671096
Energy: 0.42782988206812905
Energy: 0.5895135914711471
Energy: 0.7193709261026364
Energy: 0.7054341231387978
Energy: 0.42715974168263576
Energy: 0.6255801508887069
Energy: 0.627942851692871
Energy: 0.42715974168084986
Energy: 0.7193709261005259
Energy: 0.7054341231397178
Energy: 0.42715974168025456
Energy: 0.6255801508881117
Energy: 0.8566530913924124
Energy: 0.6873145801156907
Energy: 0.4261147811362378
Energy: 0.8774329696223346
Energy: 0.6873145802344233
Energy: 0.42611478113537193
Energy: 0.856653091393603
Energy: 0.6873145801002132
Energy: 0.4261147811335861
Energy: 0.8774329696217393

minimum gb energy = 0.4240462448850095 eV
minimum distance =  2.40933064028499 Angstroms
sigma value = 33


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

Energy: 0.7757231288221281
Energy: 0.7611191277060353
Energy: 0.7612812287859042
Energy: 0.814524437259693
Energy: 0.7611191277076693
Energy: 0.7612812287859042
Energy: 0.7757231288204942
Energy: 0.7611191277076693
Energy: 0.7612812287859042
Energy: 0.814524437259693
Energy: 0.779777882487382
Energy: 0.7670392749458053
Energy: 0.7622742790244669
Energy: 0.779777882489016
Energy: 0.7670392749474393
Energy: 0.7622742790244669
Energy: 0.779777882489016
Energy: 0.7670392749425373
Energy: 0.7622742790211988
Energy: 0.77977788249065
Energy: 0.7870172150613243
Energy: 0.7752171660559528
Energy: 0.7751917692810065
Energy: 0.7870172150613243
Energy: 0.7752171660543188
Energy: 0.7751917692826406
Energy: 0.7870172150613243
Energy: 0.7752171660510508
Energy: 0.7751917692826406
Energy: 0.7995701747089097
Energy: 0.8404462682681928
Energy: 0.7617788363419482
Energy: 0.8893270389893468
Energy: 0.8404462682698268
Energy: 0.7617788363419482
Energy: 0.8893270389909809
Energy: 0.8404462682714607
Energy: 0.7617788363403142
Energy: 0.8893270389942487
Energy: 0.8404462682681928
Energy: 0.7791258264589553
Energy: 0.7587976023209279
Energy: 0.7725961945926749
Energy: 0.7791258264605893
Energy: 0.7587976023209279
Energy: 0.772596194594309
Energy: 0.7791258264605893
Energy: 0.7587976023241958
Energy: 0.7725961945926749
Energy: 0.7791258264605893
Energy: 0.8214640682672238
Energy: 0.7813187647336348
Energy: 0.7603974951042626
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Energy: 0.7624465353934115
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Energy: 0.8275360310668705
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Energy: 0.8275360310668705
Energy: 0.7624465353934115
Energy: 0.7795122191189917
Energy: 0.8275360310652364
Energy: 0.7620587866214062
Energy: 0.8785401476104466
Energy: 0.7628374731861904
Energy: 0.7406538539622802
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Energy: 0.7628374731878245
Energy: 0.7406538539639143
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Energy: 0.7406538539606463
Energy: 0.8785401476104466
Energy: 0.7812322600067236
Energy: 0.7546973357934003
Energy: 0.855047099511152
Energy: 0.7812322600083577
Energy: 0.7546973357966681
Energy: 0.8550470995144198
Energy: 0.7812322600083577
Energy: 0.7546973357950342
Energy: 0.8550470995127858
Energy: 0.7812322600067236
Energy: 0.7682833446973646
Energy: 0.7615989439765697
Energy: 0.7496352096697912
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Energy: 0.7615989439782036
Energy: 0.7496352096681574
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Energy: 0.7682833446957306
Energy: 0.7642681763599736
Energy: 0.799177430753826
Energy: 0.773150161516886
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Energy: 0.7991774307521919
Energy: 0.7731209884373956
Energy: 0.7642681763567056
Energy: 0.7991774307521919
Energy: 0.773150161516886
Energy: 0.7642681763583397
Energy: 0.7611626327425806
Energy: 0.8090095828396578
Energy: 0.8629812000856331
Energy: 0.7611626327458189
Energy: 0.7997581974895384
Energy: 0.8693282799820142
Energy: 0.7611626327474528
Energy: 0.80900958283639
Energy: 0.8629811999941897
Energy: 0.7611626327409465
Energy: 0.7750699221163784
Energy: 0.8106640943045904
Energy: 0.7831547602228774
Energy: 0.7750699221180123
Energy: 0.8108300347077112
Energy: 0.7831708298198451
Energy: 0.7750699221196463
Energy: 0.8106640943029566
Energy: 0.7831547602212434
Energy: 0.7750699221212802
Energy: 0.7610096005812815
Energy: 0.7576747874584231
Energy: 0.7913001015905338
Energy: 0.7610096005812815
Energy: 0.7543986931609207
Energy: 0.7913001015905338
Energy: 0.7610096005796475
Energy: 0.757674787460057
Energy: 0.7913001015921678
Energy: 0.7610096005812815
Energy: 0.7605362103258362
Energy: 0.791814825062898
Energy: 0.7981407598851864
Energy: 0.7605362103258362
Energy: 0.7855192095767101
Energy: 0.7981407598835524
Energy: 0.7605362103274702
Energy: 0.791814825064532
Energy: 0.7981407598851864
Energy: 0.7605362103258362
Energy: 0.7623132661435137
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Energy: 0.7851710382697755
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Energy: 0.7705635782176797
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Energy: 0.8875196006740813
Energy: 0.7709867599546679

minimum gb energy = 0.7349957540859186 eV
minimum distance =  2.36320380258916 Angstroms
sigma value = 219


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

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Energy: 1.1058909883648413
Energy: 1.1053449963237496
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Energy: 1.0812205240802029
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Energy: 1.110561714797314
Energy: 1.0812205240802029
Energy: 1.097268151095427
Energy: 1.1105617147962328
Energy: 1.0812205240802029

minimum gb energy = 1.0603257721993027 eV
minimum distance =  2.32253843695917 Angstroms
sigma value = 15


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

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minimum gb energy = 1.2136135596464883 eV
minimum distance =  2.31355872471523 Angstroms
sigma value = 293


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

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Energy: 1.306133607811902
Energy: 1.264846526180553
Energy: 1.3995619622822033
Energy: 1.306133607811902
Energy: 1.363600276651331
Energy: 1.291840270491192
Energy: 1.2670557120943242
Energy: 1.3636002766520416
Energy: 1.2918402704916807
Energy: 1.2669626330893526
Energy: 1.3636002766515534
Energy: 1.2918402704919472
Energy: 1.2670557120906827
Energy: 1.3636002766508424
Energy: 1.2455238861247122
Energy: 1.3379902096999021
Energy: 1.2568250217496764
Energy: 1.245523886122758
Energy: 1.3379902097018561
Energy: 1.2568250217482106
Energy: 1.2455238861242237
Energy: 1.3379902097028333
Energy: 1.2568250217516306
Energy: 1.2455238861261777
Energy: 1.29781767804791
Energy: 1.2511023363659406
Energy: 1.2661420914801715
Energy: 1.2978176780513297
Energy: 1.2511023363698488
Energy: 1.2661420914767518
Energy: 1.2978176780506192
Energy: 1.251102336368383
Energy: 1.2661420914779955
Energy: 1.2978176780454675
Energy: 1.251717695048092
Energy: 1.347242760520541
Energy: 1.2583830405102217
Energy: 1.2500290476919516
Energy: 1.3472427605217845
Energy: 1.2583830405121759
Energy: 1.2517176950493354
Energy: 1.3472427605217845
Energy: 1.2583830405119094
Energy: 1.250029047689509
Energy: 1.2837500430191084
Energy: 1.2640132618356728
Energy: 1.2578087836317806
Energy: 1.2732651889074116
Energy: 1.264013261835451
Energy: 1.2578087836327578
Energy: 1.2837500430171542
Energy: 1.264013261835451
Energy: 1.2578087836312923
Energy: 1.2732651889066566
Energy: 1.3420988734779296
Energy: 1.2562693301328423
Energy: 1.3404759147587126
Energy: 1.3420988734769526
Energy: 1.2562693301333308
Energy: 1.3404759147587126
Energy: 1.3420988734735328
Energy: 1.256269330135285
Energy: 1.3404759147599563
Energy: 1.3420988734757533
Energy: 1.2993486716564275
Energy: 1.2613180327865565
Energy: 1.24993111947416
Energy: 1.2993486716569163
Energy: 1.2571427605979721
Energy: 1.249931119473183
Energy: 1.2993486716556726
Energy: 1.2613180327878002
Energy: 1.2499311194743823
Energy: 1.299348671655939
Energy: 1.242081456299095
Energy: 1.2571302574165009
Energy: 1.2154877866096643
Energy: 1.2420814562998497
Energy: 1.2571464886261972
Energy: 1.215487786608421
Energy: 1.2420814562976292
Energy: 1.2571302574123262
Energy: 1.215487786608421
Energy: 1.242081456299095
Energy: 1.3699506246017468
Energy: 1.2553045054299279
Energy: 1.2782125618903133
Energy: 1.3699506246027238
Energy: 1.2553045054296614
Energy: 1.2782125618971525
Energy: 1.3699506246044113
Energy: 1.2553045054304166
Energy: 1.2782125618966638
Energy: 1.36995062460148
Energy: 1.3154249456184353
Energy: 1.439774180874911
Energy: 1.260609326188409
Energy: 1.3154249456223435
Energy: 1.4397741808763767
Energy: 1.2606024941926697
Energy: 1.315424945621855
Energy: 1.439774180872957
Energy: 1.2606093261896525
Energy: 1.3154249456201228
Energy: 1.2563856342905884
Energy: 1.2549006979251052
Energy: 1.4033483452448292
Energy: 1.256385634290855
Energy: 1.2549006979236397
Energy: 1.4033483452450515
Energy: 1.2563856342923205
Energy: 1.2549006979236397
Energy: 1.4033483452450515
Energy: 1.256385634292809
Energy: 1.320716420096209
Energy: 1.2539777685415765
Energy: 1.3087564660517002
Energy: 1.3207164200991401
Energy: 1.253977768539667
Energy: 1.3087564660502347
Energy: 1.3207164200998507
Energy: 1.2539777685401556
Energy: 1.308756466051434
Energy: 1.320716420096209
Energy: 1.2576637748949564
Energy: 1.3765699512178409
Energy: 1.2943289475187882
Energy: 1.2576637748949564
Energy: 1.3765699512156202
Energy: 1.2943289475231847
Energy: 1.2576637748944677
Energy: 1.3765699512185514
Energy: 1.2943289475226964
Energy: 1.2576637748962
Energy: 1.306133607810925
Energy: 1.2648465261790875
Energy: 1.3995619622812263
Energy: 1.3061336078131454
Energy: 1.2648465261790875
Energy: 1.399561962281493
Energy: 1.3061336078123906
Energy: 1.264846526179354
Energy: 1.3995619622819813
Energy: 1.306133607810925
Energy: 1.3636002766515534
Energy: 1.2918402704897265
Energy: 1.2665844042342624
Energy: 1.3636002766525304
Energy: 1.2918402704904817
Energy: 1.266639835184076
Energy: 1.3636002766505764
Energy: 1.2918402704924357
Energy: 1.2665844042396364
Energy: 1.3636002766510646
Energy: 1.245523886123735
Energy: 1.3379902097001244
Energy: 1.2568250217486994
Energy: 1.2455238861230244
Energy: 1.3379902097011014
Energy: 1.256825021747456
Energy: 1.245523886126444
Energy: 1.337990209702567
Energy: 1.2568250217516306
Energy: 1.245523886126444

minimum gb energy = 1.215487786608421 eV
minimum distance =  2.2991875698892 Angstroms
sigma value = 293


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

Energy: 1.3833134694442117
Energy: 1.319433262942095
Energy: 1.3190297968446396
Energy: 1.3833134694446532
Energy: 1.3194332629407706
Energy: 1.3190297968455222
Energy: 1.3833134694437703
Energy: 1.319433262942978
Energy: 1.3190297968446396
Energy: 1.3833134694446532
Energy: 1.316787618784308
Energy: 1.3835853817834576
Energy: 1.3840345447231344
Energy: 1.3167876187838665
Energy: 1.3835853817843404
Energy: 1.3840345447231344
Energy: 1.316787618783425
Energy: 1.3835853817834576
Energy: 1.3840345447235762
Energy: 1.3167876187838665
Energy: 1.3172409126606772
Energy: 1.3167405407907538
Energy: 1.2968294250290435
Energy: 1.3172409126615605
Energy: 1.3167405407903123
Energy: 1.2968212611150634
Energy: 1.317240912660236
Energy: 1.316740540789871
Energy: 1.296844436250394
Energy: 1.317240912661119
Energy: 1.296376910066746
Energy: 1.316933803179689
Energy: 1.3171049208892172
Energy: 1.2963772437640222
Energy: 1.3169338031788063
Energy: 1.317104920888334
Energy: 1.2963781124288833
Energy: 1.3169338031801308
Energy: 1.3171049208892172
Energy: 1.2963774240818908
Energy: 1.3191743156338724
Energy: 1.3835931662075995
Energy: 1.3166290350112828
Energy: 1.3191743156329894
Energy: 1.3835931662080412
Energy: 1.3166290350117242
Energy: 1.3191743156338724
Energy: 1.3835931662075995
Energy: 1.3166290350121659
Energy: 1.3191743156356381
Energy: 1.319433262942978
Energy: 1.3190297968455222
Energy: 1.3833134694437703
Energy: 1.319433262942095
Energy: 1.3190297968446396
Energy: 1.3833134694446532
Energy: 1.319433262942095
Energy: 1.3190297968459637
Energy: 1.3833134694442117
Energy: 1.3194332629416536
Energy: 1.3835853817843404
Energy: 1.3840345447231344
Energy: 1.3167876187975522
Energy: 1.3835853817834576
Energy: 1.3840345447231344
Energy: 1.3167876187847496
Energy: 1.3835853817843404
Energy: 1.3840345447231344
Energy: 1.316787618783425
Energy: 1.3835853817834576
Energy: 1.316740540789871
Energy: 1.2968190151582977
Energy: 1.317240912661119
Energy: 1.3167405407903123
Energy: 1.2968344589388276
Energy: 1.3172409126615605
Energy: 1.3167405407903123
Energy: 1.2968466792642361
Energy: 1.3172409126597946
Energy: 1.316740540789871
Energy: 1.316933803179248
Energy: 1.3171049208892172
Energy: 1.29637790962336
Energy: 1.3169338031801308
Energy: 1.3171049208901
Energy: 1.2963772797155895
Energy: 1.316933803179248
Energy: 1.3171049208892172
Energy: 1.2963769660749564
Energy: 1.3169338031801308
Energy: 1.3835931662080412
Energy: 1.3166290350117242
Energy: 1.3191743156347553
Energy: 1.3835931662075995
Energy: 1.3166290350117242
Energy: 1.3191743156343139
Energy: 1.3835931662080412
Energy: 1.3166290350103997
Energy: 1.3191743156347553
Energy: 1.3835931662075995
Energy: 1.3190297968446396
Energy: 1.3833134694446532
Energy: 1.3194332629425365
Energy: 1.3190297968455222
Energy: 1.3833134694442117
Energy: 1.319433262941212
Energy: 1.3190297968446396
Energy: 1.3833134694442117
Energy: 1.319433262941212
Energy: 1.3190297968455222
Energy: 1.3840345447231344
Energy: 1.3167876187984353
Energy: 1.3835853817838992
Energy: 1.3840345447231344
Energy: 1.3167876187993182
Energy: 1.3835853817834576
Energy: 1.3840345447235762
Energy: 1.3167876187984353
Energy: 1.3835853817843404
Energy: 1.384034544722693
Energy: 1.2968585224823348
Energy: 1.3172409126615605
Energy: 1.3167405407907538
Energy: 1.2968390947380122
Energy: 1.3172409126606772
Energy: 1.3167405407894293
Energy: 1.2968521717303123
Energy: 1.317240912661119
Energy: 1.3167405407903123
Energy: 1.2968630974501367
Energy: 1.317104920888334
Energy: 1.2963774212793173
Energy: 1.316933803179248
Energy: 1.3171049208896586
Energy: 1.2963781868102262
Energy: 1.3169338031801308
Energy: 1.3171049208892172
Energy: 1.296378316336693
Energy: 1.316933803179248
Energy: 1.3171049208901
Energy: 1.3166290350121659
Energy: 1.3191743156334308
Energy: 1.3835931662080412
Energy: 1.3166290350121659
Energy: 1.3191743156347553
Energy: 1.3835931662075995
Energy: 1.3166290350117242
Energy: 1.3191743156351967
Energy: 1.3835931662080412
Energy: 1.3166290350121659
Energy: 1.3833134694442117
Energy: 1.3194332629416536
Energy: 1.3190297968446396
Energy: 1.3833134694446532
Energy: 1.319433262941212
Energy: 1.3190297968455222
Energy: 1.3833134694442117
Energy: 1.319433262942095
Energy: 1.3190297968446396
Energy: 1.3833134694442117
Energy: 1.3167876187993182
Energy: 1.3835853817838992
Energy: 1.3840345447235762
Energy: 1.3167876188002012
Energy: 1.3835853817838992
Energy: 1.384034544722693
Energy: 1.3167876187984353
Energy: 1.3835853817834576
Energy: 1.3840345447231344
Energy: 1.3167876187975522
Energy: 1.3172409126606772
Energy: 1.3167405407889878
Energy: 1.2968546824563305
Energy: 1.3172409126615605
Energy: 1.316740540789871
Energy: 1.2968636931325943
Energy: 1.317240912660236
Energy: 1.3167405407903123
Energy: 1.296863308899852
Energy: 1.317240912661119
Energy: 1.2963774394887422
Energy: 1.3169338031801308
Energy: 1.3171049208901
Energy: 1.2963779768101193
Energy: 1.316933803179248
Energy: 1.3171049208905417
Energy: 1.2963775905192536
Energy: 1.3169338031801308
Energy: 1.3171049208892172
Energy: 1.2963786835981916
Energy: 1.3191743156329894
Energy: 1.3835931662075995
Energy: 1.3166290350117242
Energy: 1.3191743156351967
Energy: 1.3835931662080412
Energy: 1.3166290350121659
Energy: 1.3191743156351967
Energy: 1.3835931662075995
Energy: 1.3166290350108416
Energy: 1.3191743156329894
Energy: 1.319433262942095
Energy: 1.3190297968455222
Energy: 1.3833134694437703
Energy: 1.3194332629425365
Energy: 1.3190297968446396
Energy: 1.3833134694446532
Energy: 1.3194332629425365
Energy: 1.3190297968455222
Energy: 1.3833134694442117
Energy: 1.3194332629416536
Energy: 1.3835853817843404
Energy: 1.3840345447231344
Energy: 1.3167876187979939
Energy: 1.3835853817834576
Energy: 1.3840345447235762
Energy: 1.3167876187997598
Energy: 1.3835853817843404
Energy: 1.3840345447231344
Energy: 1.3167876187993182
Energy: 1.3835853817834576

minimum gb energy = 1.296376910066746 eV
minimum distance =  2.37128986192927 Angstroms
sigma value = 15


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

Energy: 1.2768083667511947
Energy: 1.2857849070365521
Energy: 1.2746858765313045
Energy: 1.253200493041534
Energy: 1.2857849070365521
Energy: 1.2746858765373081
Energy: 1.2768083667511947
Energy: 1.2857849070385172
Energy: 1.2746858765353068
Energy: 1.253200493041534
Energy: 1.2761316505312181
Energy: 1.193726160897688
Energy: 1.1848471725650376
Energy: 1.2761316505292168
Energy: 1.1937261608996892
Energy: 1.1848471725650376
Energy: 1.2761316505252145
Energy: 1.193726160897688
Energy: 1.184847172561035
Energy: 1.2761316505292168
Energy: 1.3195486922098432
Energy: 1.2612442246877118
Energy: 1.3487972226018663
Energy: 1.3195486922078419
Energy: 1.2612442246877118
Energy: 1.3487972226038674
Energy: 1.3195486922078419
Energy: 1.261244224691678
Energy: 1.3487972226018663
Energy: 1.3195486922118442
Energy: 1.18790165730305
Energy: 1.2442037371887291
Energy: 1.1901701896235222
Energy: 1.1879016573050512
Energy: 1.2442037371887291
Energy: 1.1901701896195194
Energy: 1.1879016573010488
Energy: 1.2442037371947328
Energy: 1.1901701896215209
Energy: 1.18790165730305
Energy: 1.2500116420585576
Energy: 1.1921139910890475
Energy: 1.324264850913096
Energy: 1.2500116420545553
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Energy: 1.324264850913096
Energy: 1.2500116420525542
Energy: 1.1921139910890475
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Energy: 1.2609423688442902
Energy: 1.355116004401139
Energy: 1.1831945207723016
Energy: 1.2609423688442902
Energy: 1.355116004401139
Energy: 1.1831945207743029
Energy: 1.2609423688462913
Energy: 1.35511600440314
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Energy: 1.2609423688462913
Energy: 1.2076419456962055
Energy: 1.3232470129895935
Energy: 1.2752886221874742
Energy: 1.2079449472406174
Energy: 1.3232470129915948
Energy: 1.2752886221894753
Energy: 1.2076419456962055
Energy: 1.3232470129895935
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Energy: 1.3000996104764508
Energy: 1.249535066450105
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Energy: 1.2495350664461022
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Energy: 1.4913753302273778
Energy: 1.249088852106971
Energy: 1.2239459758677633
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Energy: 1.223945975863761
Energy: 1.4913753302273778
Energy: 1.2490888521089722
Energy: 1.2239459758657623
Energy: 1.491375330229379
Energy: 1.1876187181860904
Energy: 1.3299726575827462
Energy: 1.2651617035915903
Energy: 1.1876172711520563
Energy: 1.3299726575867488
Energy: 1.2651617035935916
Energy: 1.1876187181840894
Energy: 1.3299726575867488
Energy: 1.2651617035935916
Energy: 1.1876172711440514
Energy: 1.2552507844873615
Energy: 1.1748052575503452
Energy: 1.291276124716871
Energy: 1.2552507844853602
Energy: 1.1748052575523467
Energy: 1.291276124716871
Energy: 1.2552507844873615
Energy: 1.1748052575563488
Energy: 1.291276124718872
Energy: 1.2552507844893626
Energy: 1.2613320818416862
Energy: 1.1801702063205466
Energy: 1.3225120633305387
Energy: 1.2613320818436873
Energy: 1.1801622241517113
Energy: 1.3225120633265364
Energy: 1.2613320818416862
Energy: 1.1801702063185455
Energy: 1.3225120633285377
Energy: 1.2613320818436873
Energy: 1.297834717240462
Energy: 1.2121823459509722
Energy: 1.3217053799625187
Energy: 1.297834717240462
Energy: 1.2121823459509722
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Energy: 1.2978347172384608
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Energy: 1.3217053799605174
Energy: 1.2978347172364597
Energy: 1.184664303165376
Energy: 1.1856345617253539
Energy: 1.3754553819869217
Energy: 1.184664303163375
Energy: 1.1856345617233526
Energy: 1.3754553819929254
Energy: 1.184664303163375
Energy: 1.1856345617233526
Energy: 1.3754553819889233
Energy: 1.184664303165376
Energy: 1.3032874547742441
Energy: 1.3511513871074725
Energy: 1.2047979041491117
Energy: 1.303287454770242
Energy: 1.3511513871034702
Energy: 1.2047909780081516
Energy: 1.3032874547762456
Energy: 1.3511513871034702
Energy: 1.2047979041471104
Energy: 1.303287454770242
Energy: 1.1919962417523644
Energy: 1.2919201541217982
Energy: 1.344481674518824
Energy: 1.1919962417523644
Energy: 1.291920154119797
Energy: 1.344481674518824
Energy: 1.1919962417503633
Energy: 1.2919201541237995
Energy: 1.3444816745207886
Energy: 1.1919962417523644
Energy: 1.2488611844754407
Energy: 1.2342617359626409
Energy: 1.3480451404972242
Energy: 1.2488611844754407
Energy: 1.2342617359586383
Energy: 1.3480451404952227
Energy: 1.2488611844754407
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Energy: 1.3480451404972242
Energy: 1.248861184473476
Energy: 1.2586483241425062
Energy: 1.190862555561861
Energy: 1.1875053236183313
Energy: 1.2586483241445074
Energy: 1.1908625555638623
Energy: 1.1875053236183313
Energy: 1.2586483241405049
Energy: 1.1908625555638623
Energy: 1.1875053236183313
Energy: 1.2586483241465085
Energy: 1.2163970915228342
Energy: 1.328215365737432
Energy: 1.247608703407647
Energy: 1.2163970915248352
Energy: 1.3282153657334295
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Energy: 1.3282153657314284
Energy: 1.247608703407647
Energy: 1.2163970915248352
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Energy: 1.2052037697605194
Energy: 1.2625099252524896
Energy: 1.3210711799368393
Energy: 1.2052037697585178
Energy: 1.2625099252504883
Energy: 1.3210711799408414
Energy: 1.2052037697585178
Energy: 1.2625099252504883
Energy: 1.3210711799388404
Energy: 1.2396361464991612
Energy: 1.1891492186099264
Energy: 1.3798415411846696
Energy: 1.2396361464991612
Energy: 1.1891492186079615
Energy: 1.3798415411846696
Energy: 1.2396361465011623
Energy: 1.1891492186099264
Energy: 1.3798415411826686
Energy: 1.2396361464991612
Energy: 1.1965585916737826
Energy: 1.2630571008426452
Energy: 1.1830922015258667
Energy: 1.1965585916777852
Energy: 1.2630571008426452
Energy: 1.1830922015238652
Energy: 1.1965585916797863
Energy: 1.2630571008566536
Energy: 1.1830922015238652
Energy: 1.1965585916777852
Energy: 1.2115164620760206
Energy: 1.2035576081017099
Energy: 1.2715051401122521
Energy: 1.211514585575732
Energy: 1.2035428713952219
Energy: 1.2715051401122521
Energy: 1.211516462074019
Energy: 1.2035576081037112
Energy: 1.2715051401162547
Energy: 1.2115145855737308
Energy: 1.2052375249508513
Energy: 1.209966664182223
Energy: 1.1782845810032698
Energy: 1.2052375249508513
Energy: 1.2099666641842244
Energy: 1.1782845809972662
Energy: 1.2052375249528524
Energy: 1.209966664182223
Energy: 1.1782845809972662
Energy: 1.2052375249528524
Energy: 1.3016017882802435
Energy: 1.2231714939207854
Energy: 1.2421070790938942
Energy: 1.3016017882782425
Energy: 1.2231714939207854
Energy: 1.2421070790978963
Energy: 1.3016017882782425
Energy: 1.223171493918784
Energy: 1.2421070790938942
Energy: 1.3016017882762412
Energy: 1.198530515421157
Energy: 1.260018787773259
Energy: 1.2558634955627561
Energy: 1.1985342475683987
Energy: 1.260018787803277
Energy: 1.2558634955587535
Energy: 1.198530515423158
Energy: 1.260018787805278
Energy: 1.2558634955587535
Energy: 1.1985342475683987
Energy: 1.2688668021032308
Energy: 1.1765920859563046
Energy: 1.3080894004447807
Energy: 1.2688668021032308
Energy: 1.1765920859583057
Energy: 1.3080894004427794
Energy: 1.2688668021032308
Energy: 1.1765920859563046
Energy: 1.3080894004427794
Energy: 1.2688668021032308
Energy: 1.331771549074133
Energy: 1.3329922249715147
Energy: 1.365809320006419
Energy: 1.3317715490781357
Energy: 1.3329922249735158
Energy: 1.3658093200084203
Energy: 1.3317715490721318
Energy: 1.3329922249735158
Energy: 1.3658093200104213
Energy: 1.3317715490781357
Energy: 1.264010685565586
Energy: 1.180076190868079
Energy: 1.2202078895124313
Energy: 1.2671472303892146
Energy: 1.1801309696735813
Energy: 1.2202078895144324
Energy: 1.2640106855675872
Energy: 1.180076190868079
Energy: 1.2202078895144324
Energy: 1.2671472303872133
Energy: 1.2270754616612998
Energy: 1.1858758720614397
Energy: 1.3056323281447988
Energy: 1.2270754616673034
Energy: 1.1858758720654423
Energy: 1.3056323281447988
Energy: 1.2270754616673034
Energy: 1.1858758720654423
Energy: 1.3056323281468
Energy: 1.2270754616673034
Energy: 1.2864355836516648
Energy: 1.2398929264286922
Energy: 1.2064986927863652
Energy: 1.2864355836496635
Energy: 1.2398929264286922
Energy: 1.2068197054057659
Energy: 1.2864355836496635
Energy: 1.2398929264246896
Energy: 1.2064986927883665
Energy: 1.2864355836496635
Energy: 1.1777531561172299
Energy: 1.312706865499515
Energy: 1.3648671223409548
Energy: 1.1777531561132273
Energy: 1.312706865499515
Energy: 1.3648671223409548
Energy: 1.1777531561152284
Energy: 1.3127068655015162
Energy: 1.3648671223409548
Energy: 1.1777531561172299
Energy: 1.2734187400963135
Energy: 1.332771201192036
Energy: 1.1874666882717577
Energy: 1.2498095523117199
Energy: 1.3327712011940371
Energy: 1.187466688273759
Energy: 1.273418740098315
Energy: 1.3327712011940371
Energy: 1.187466688273759
Energy: 1.2498095523097188
Energy: 1.271210760435162
Energy: 1.2806640586834883
Energy: 1.3211056629665034
Energy: 1.2482171922079934
Energy: 1.2806640586794857
Energy: 1.3383826546303699
Energy: 1.271210760437163
Energy: 1.280664058681487
Energy: 1.3211056629665034
Energy: 1.2482171922099947
Energy: 1.1818803329633634
Energy: 1.4171143149592327
Energy: 1.2943506711289727
Energy: 1.1818803329673293
Energy: 1.417114314961234
Energy: 1.2943506711309738
Energy: 1.1818803329633634
Energy: 1.417114314961234
Energy: 1.2943506711309738
Energy: 1.1818803329653647
Energy: 1.4116674168789975
Energy: 1.2072987446086982
Energy: 1.2402440718399284
Energy: 1.4116674168789975
Energy: 1.2072987446086982
Energy: 1.2402440718439307
Energy: 1.4116674168789975
Energy: 1.2072987446086982
Energy: 1.2402440718419296
Energy: 1.4116674168769963
Energy: 1.2058406655631249
Energy: 1.3662937634736303
Energy: 1.1854714945925948
Energy: 1.2058406655651261
Energy: 1.3662937634756316
Energy: 1.185250522843429
Energy: 1.2058406655651261
Energy: 1.3662937634756316
Energy: 1.1854714945925948
Energy: 1.2058406655631249
Energy: 1.304259787278924
Energy: 1.2288371574745798
Energy: 1.180264255124321
Energy: 1.3042597872849275
Energy: 1.2288371574725787
Energy: 1.180264255126322
Energy: 1.3042597872849275
Energy: 1.2288371574725787
Energy: 1.1802642551203184
Energy: 1.3042597872829265
Energy: 1.3387780512241159
Energy: 1.347171423016354
Energy: 1.2523834397187006
Energy: 1.3387780512261174
Energy: 1.3471714230223215
Energy: 1.2523834397187006
Energy: 1.3387780512241159
Energy: 1.3471714230223215
Energy: 1.2523834397227034
Energy: 1.3387780512241159
Energy: 1.2259810073834896
Energy: 1.2398608787952718
Energy: 1.177414952943283
Energy: 1.2259810073794872
Energy: 1.2398608787952718
Energy: 1.177414952945284
Energy: 1.2259810073794872
Energy: 1.2398608787932708
Energy: 1.177414952945284
Energy: 1.2259810073854909
Energy: 1.187860156744568
Energy: 1.286141601105735
Energy: 1.234063670186574
Energy: 1.1878601567405658
Energy: 1.2861416011097373
Energy: 1.2340636701845729
Energy: 1.1878601567425668
Energy: 1.2861416011097373
Energy: 1.234063670186574
Energy: 1.1878601567425668
Energy: 1.3492817052661623
Energy: 1.2173338254562052
Energy: 1.2054466918860374
Energy: 1.3492817052661623
Energy: 1.2173338254562052
Energy: 1.205446691884036
Energy: 1.3492817052641612
Energy: 1.2173338254562052
Energy: 1.205446691884036
Energy: 1.34928170526216
Energy: 1.274797678146188
Energy: 1.1779812550873068
Energy: 1.2542034328259906
Energy: 1.2747976781501904
Energy: 1.1779812550873068
Energy: 1.2542034328299931
Energy: 1.2747976780781467
Energy: 1.1779812550853055
Energy: 1.2542034328259906
Energy: 1.2747976782322035
Energy: 1.2045745388225857
Energy: 1.5012358235725718
Energy: 1.2135762879110032
Energy: 1.204574538824587
Energy: 1.5012358235705703
Energy: 1.2135762879070007
Energy: 1.204574538824587
Energy: 1.5012358235705703
Energy: 1.2135762879070007
Energy: 1.2045745388265883
Energy: 1.2334158086108318
Energy: 1.1801379568682209
Energy: 1.3692864639481632
Energy: 1.233415808614798
Energy: 1.1801377800721466
Energy: 1.3692864643362155
Energy: 1.233415808614798
Energy: 1.1801379568682209
Energy: 1.369286463350057
Energy: 1.2334158086108318
Energy: 1.2063140375952093
Energy: 1.2210225967527917
Energy: 1.3494043371534394
Energy: 1.2063140375992119
Energy: 1.2210225967487895
Energy: 1.349404337155441
Energy: 1.2063140375972103
Energy: 1.221022596746788
Energy: 1.349404337155441
Energy: 1.2063140375972103
Energy: 1.2578545103192604
Energy: 1.2387211665549112
Energy: 1.2007007050141578
Energy: 1.2578545103252643
Energy: 1.2387211665549112
Energy: 1.2007040950970365
Energy: 1.2578545103212622
Energy: 1.2387211665549112
Energy: 1.2007007050141578
Energy: 1.2578545103232632
Energy: 1.179832241351623
Energy: 1.2110910944837958
Energy: 1.218808388833261
Energy: 1.1798322413576265
Energy: 1.2110910944817947
Energy: 1.218808388853273
Energy: 1.1798322413576265
Energy: 1.21109109447983
Energy: 1.2188083889132728
Energy: 1.1798322413576265
Energy: 1.2473434903824523
Energy: 1.3349580150867202
Energy: 1.3380329747165534
Energy: 1.2473434903864549
Energy: 1.3349580150827176
Energy: 1.3380329747185544
Energy: 1.2473434903864549
Energy: 1.3349580150867202
Energy: 1.3380329747185544
Energy: 1.2473434903884562

minimum gb energy = 1.1748052575503452 eV
minimum distance =  2.33493592854362 Angstroms
sigma value = 437


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

Energy: 1.109686201488864
Energy: 1.2031919628697783
Energy: 1.204924016211199
Energy: 1.109686201489593
Energy: 1.2031919628705074
Energy: 1.2049240162126569
Energy: 1.109686201488864
Energy: 1.2031919628712366
Energy: 1.204924016211199
Energy: 1.1096862014903222
Energy: 1.287364098850472
Energy: 1.0843538180906092
Energy: 1.0823886154211275
Energy: 1.2873640988490138
Energy: 1.0843538180906092
Energy: 1.0823886154203985
Energy: 1.287364098850472
Energy: 1.0843538180906092
Energy: 1.0823886154211275
Energy: 1.287364098850472
Energy: 1.1725334734382356
Energy: 1.0709686823750282
Energy: 1.1954564329586392
Energy: 1.1725334734396937
Energy: 1.0709686823764863
Energy: 1.1954564329586392
Energy: 1.1725334734382356
Energy: 1.0709686823750282
Energy: 1.1954564329586392
Energy: 1.1725334734389645
Energy: 1.1835800178193208
Energy: 1.3562570607706395
Energy: 1.113831284391137
Energy: 1.1835800178178624
Energy: 1.3562570607699105
Energy: 1.113831284390408
Energy: 1.1835800178193208
Energy: 1.3562570607706395
Energy: 1.113831284391137
Energy: 1.1835800178185918
Energy: 1.2079294735614963
Energy: 1.0969787828663864
Energy: 1.3360188547645946
Energy: 1.2079294735585797
Energy: 1.0969787828649282
Energy: 1.3360188547660528
Energy: 1.2079294735607673
Energy: 1.0969787828656574
Energy: 1.3360188547653238
Energy: 1.2079294735578507
Energy: 1.1425905001724472
Energy: 1.3041380019619992
Energy: 1.082120444677134
Energy: 1.1425905001739056
Energy: 1.3041380019641868
Energy: 1.082120444678592
Energy: 1.1425905001724472
Energy: 1.3041380019641868
Energy: 1.0821204446764048
Energy: 1.1425905001739056
Energy: 1.1667395067724036
Energy: 1.116553385334647
Energy: 1.0711415780838192
Energy: 1.1667395067789652
Energy: 1.1165533853339178
Energy: 1.0711415780838192
Energy: 1.1667395067731325
Energy: 1.116553385334647
Energy: 1.0711415780838192
Energy: 1.1667395067789652
Energy: 1.1050584883566401
Energy: 1.3197956077328672
Energy: 1.209328346343101
Energy: 1.1050584883559111
Energy: 1.3197956077350546
Energy: 1.2093283463466802
Energy: 1.1050584883566401
Energy: 1.3197956077328672
Energy: 1.2093283463474092
Energy: 1.1050584883559111
Energy: 1.4755605104157838
Energy: 1.0758038384641802
Energy: 1.0971266068839807
Energy: 1.4755605104157838
Energy: 1.0758038384627218
Energy: 1.0971266068854388
Energy: 1.4755605104157838
Energy: 1.0758038384641802
Energy: 1.0971266068847099
Energy: 1.4755605104150549
Energy: 1.2033015390391366
Energy: 1.2216587930030702
Energy: 1.276243628853075
Energy: 1.2033015390369493
Energy: 1.2216587930045284
Energy: 1.276243628853075
Energy: 1.2033015390398656
Energy: 1.2216587930030702
Energy: 1.276243628853075
Energy: 1.2033015390391366
Energy: 1.1410254509018742
Energy: 1.082460468138979
Energy: 1.1248693748627068
Energy: 1.1410254509018742
Energy: 1.082460468140437
Energy: 1.1248693748627068
Energy: 1.141025450901145
Energy: 1.0824604681397079
Energy: 1.1735322796478203
Energy: 1.1410254509018742
Energy: 1.1895882155908715
Energy: 1.0781397889525448
Energy: 1.142693046287117
Energy: 1.1895882155908715
Energy: 1.0781397889547322
Energy: 1.142693046287117
Energy: 1.1895882155894133
Energy: 1.0781397889525448
Energy: 1.142693046286388
Energy: 1.1895882155923296
Energy: 1.0969863365176777
Energy: 1.2847418347459492
Energy: 1.0969131903601441
Energy: 1.0969863365162196
Energy: 1.2847418347481363
Energy: 1.0969131903601441
Energy: 1.0969863365176777
Energy: 1.28474183474522
Energy: 1.0969131903601441
Energy: 1.0969863365162196
Energy: 1.145393043047444
Energy: 1.0562399160746683
Energy: 1.2333755535757753
Energy: 1.1453930430452568
Energy: 1.056239916075397
Energy: 1.2333755540727391
Energy: 1.145393043047444
Energy: 1.056239916075397
Energy: 1.2333755532354298
Energy: 1.1453930430452568

minimum gb energy = 1.0562399160746683 eV
minimum distance =  2.2659867124941 Angstroms
sigma value = 33