Model name: model_name=EAM_Dynamo_MishinMehlPapaconstantopoulos_2002_NiAl__MO_109933561507_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.051526293158533
cohesive_energy=3.3624417440272794
mass=26.981538
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: -9.23201098901316e-12 eV

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

Energy: 0.011720913507653346
Energy: 0.3410726480441695
Energy: 0.3410726480441695
Energy: 0.011720913508804148
Energy: 0.3410726480441695
Energy: 0.3410726480441695
Energy: 0.011720913507653346
Energy: 0.3410726480441695
Energy: 0.3410726480441695
Energy: 0.011720913507653346
Energy: 0.33869998146280816
Energy: 0.01435641737210053
Energy: 0.3387399371117169
Energy: 0.33869998146280816
Energy: 0.01435641737210053
Energy: 0.3387399371117169
Energy: 0.33869998146280816
Energy: 0.01435641737210053
Energy: 0.3387399371117169
Energy: 0.33869998146280816
Energy: 0.6345371774942442
Energy: 0.2148113879538193
Energy: 0.2148113879538193
Energy: 0.6345356300502889
Energy: 0.2148113879538193
Energy: 0.2148113879538193
Energy: 0.6345388519130848
Energy: 0.21481138795266846
Energy: 0.5002578487533903
Energy: 0.6345413659730685
Energy: 0.33869998146280816
Energy: 0.33873993711286765
Energy: 0.01435641737210053
Energy: 0.33869998146280816
Energy: 0.3387399371117169
Energy: 0.01435641737210053
Energy: 0.33869998146280816
Energy: 0.33873993711059225
Energy: 0.01435641737325133
Energy: 0.33869998146280816
Energy: 0.011720913507653346
Energy: 0.3410726480441695
Energy: 0.3410726480441695
Energy: 0.011720913508804148
Energy: 0.3410726480441695
Energy: 0.3410726480441695
Energy: 0.011720913507653346
Energy: 0.3410726480441695
Energy: 0.3410726480441695
Energy: 0.011720913507653346
Energy: 0.33869998146280816
Energy: 0.01435641737210053
Energy: 0.3387399371117169
Energy: 0.33869998146280816
Energy: 0.01435641737210053
Energy: 0.33873993711286765
Energy: 0.33869998146280816
Energy: 0.01435641737210053
Energy: 0.3387399371117169
Energy: 0.33869998146280816
Energy: 0.6345421068559707
Energy: 0.3018140139222921
Energy: 0.2148113879538193
Energy: 0.6345362226020108
Energy: 0.3018140139222921
Energy: 0.21481138795266846
Energy: 0.6345348285792588
Energy: 0.42266351966320237
Energy: 0.2148113879538193
Energy: 0.6345379746436466

minimum gb energy = 0.011720913507653346 eV
minimum distance =  2.69070472902987 Angstroms
sigma value = 3


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

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Energy: 0.9329121912507562
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Energy: 0.6951556219049593
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Energy: 0.7404515464164966
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Energy: 0.9330766128561033
Energy: 0.6964707819255787
Energy: 0.9329121912448365
Energy: 0.9330765571251506
Energy: 0.7404515464167786
Energy: 0.7636112079192188
Energy: 0.7360405331058856
Energy: 0.9256026821315043
Energy: 0.7636112079330314
Energy: 0.7360405331056036
Energy: 0.9256026821286854
Energy: 0.7636112079242928
Energy: 0.7360405331061673
Energy: 0.9256026821312223
Energy: 0.7636112079273936
Energy: 0.8032505276497757
Energy: 0.8914800441813517
Energy: 0.8895159664048741
Energy: 0.8040098105519345
Energy: 0.8914800441796604
Energy: 0.8895159719998336
Energy: 0.8032505276523126
Energy: 0.8914800441849908
Energy: 0.889515952543274
Energy: 0.8040098105516527
Energy: 0.9078858244074763
Energy: 0.936078434564105
Energy: 0.6522264749148086
Energy: 0.9078858244074763
Energy: 0.9360784345607223
Energy: 0.6522264749193188
Energy: 0.9078858244086039
Energy: 0.9360784345570577
Energy: 0.6522264749170636
Energy: 0.907885824405785

minimum gb energy = 0.628518783499 eV
minimum distance =  2.6797035953831 Angstroms
sigma value = 75


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

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Energy: 0.669257235382566
Energy: 0.6691254877574775
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minimum gb energy = 0.6639897677933715 eV
minimum distance =  2.59819607003451 Angstroms
sigma value = 105


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

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Energy: 0.8044465721491447
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Energy: 0.8274820998243664
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Energy: 0.8486717443882577
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Energy: 0.7367818156942689
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Energy: 0.8155866001660528
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Energy: 0.8319058663840152
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Energy: 0.8319058663835638
Energy: 0.815586600165573
Energy: 0.77529638485848
Energy: 0.8319058663858772
Energy: 0.8155866001638803
Energy: 0.7908487598055566
Energy: 0.7887984373428514
Energy: 0.8054128442158935
Energy: 0.7908487598052464
Energy: 0.78879843734082
Energy: 0.8054128442193074
Energy: 0.7908487598071083
Energy: 0.7887984373411303
Energy: 0.8054128442178966
Energy: 0.7908487598084908
Energy: 0.8183063406626407
Energy: 0.7845843377022536
Energy: 0.8181471746640693
Energy: 0.8183063406627819
Energy: 0.7845263304964767
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Energy: 0.818306340660299
Energy: 0.7845843377031846
Energy: 0.8181471746628278
Energy: 0.8183063406643335
Energy: 0.8533962102426836
Energy: 0.7838030389434042
Energy: 0.7816430043961727
Energy: 0.8533962102436148
Energy: 0.7838843975669604
Energy: 0.7816430043936898
Energy: 0.8533962102417526
Energy: 0.7838030389454074
Energy: 0.7816430043940003
Energy: 0.8533962102440661
Energy: 0.7771325709356
Energy: 0.8445385272206888
Energy: 0.7744555593776155
Energy: 0.7771325709324965
Energy: 0.844538527222551
Energy: 0.7744555593780951
Energy: 0.7771325709334275
Energy: 0.8445385272228614
Energy: 0.7744555593784054
Energy: 0.7771325709303241
Energy: 0.7836864959248584
Energy: 0.8713153674755586
Energy: 0.7840944157902815
Energy: 0.7836864959260998
Energy: 0.8664240461565184
Energy: 0.7840944157893506
Energy: 0.7836864959233067
Energy: 0.871315367474007
Energy: 0.7840944157884194
Energy: 0.7836864959220652
Energy: 0.7618911846078713
Energy: 0.7645397846491184
Energy: 0.8161800153684525
Energy: 0.7618911846094231
Energy: 0.7645814257628804
Energy: 0.8161800153685936
Energy: 0.7618911846112851
Energy: 0.7645397846601216
Energy: 0.8161800153685936
Energy: 0.7618911846078713
Energy: 0.787850098217141
Energy: 0.764389357179363
Energy: 0.861872657435786
Energy: 0.7878500983297411
Energy: 0.7643905092799425
Energy: 0.8618726574345447
Energy: 0.7878500983227723
Energy: 0.7643893571750181
Energy: 0.8618726574354756
Energy: 0.7878500982919068

minimum gb energy = 0.7362953274677482 eV
minimum distance =  2.59128118094998 Angstroms
sigma value = 165


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

Energy: 0.711339982389741
Energy: 0.8447183168032457
Energy: 0.8386501174174487
Energy: 0.7113399823908064
Energy: 0.8447183168016474
Energy: 0.8386501174174487
Energy: 0.7113399823902737
Energy: 0.8447183168032457
Energy: 0.8386501174174487
Energy: 0.7113399823902737
Energy: 0.7105703873371947
Energy: 0.7215086663272825
Energy: 0.7487951341110956
Energy: 0.7105703873324002
Energy: 0.7215086663267499
Energy: 0.7487950580413435
Energy: 0.7105703873366619
Energy: 0.7215086663267499
Energy: 0.7487956624896117
Energy: 0.7105703873361292
Energy: 0.7924581301988906
Energy: 0.8542224554427601
Energy: 0.7040315212869647
Energy: 0.7924581301967596
Energy: 0.8542224554422272
Energy: 0.7040315132188083
Energy: 0.7924581301988906
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Energy: 0.7924581301967596
Energy: 0.7937259604934749
Energy: 0.7198179120345312
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Energy: 0.7944720017998892
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Energy: 0.794495361818595
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Energy: 0.7944953618164642
Energy: 0.7944720017998892
Energy: 0.8354038788244912
Energy: 0.7944953618180624
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Energy: 0.7243330821954495
Energy: 0.8338982036695568
Energy: 0.7927946632085356
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Energy: 0.7927946632085356
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Energy: 0.8473818929323726
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Energy: 0.863331469101676
Energy: 0.7252514990207521
Energy: 0.7253274228459421
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Energy: 0.863331469101676
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Energy: 0.7917944673688815
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Energy: 0.8472595996607941
Energy: 0.7917944673678161
Energy: 0.8367887264059352
Energy: 0.8472595996602612
Energy: 0.7917944673688815
Energy: 0.8367887264080659
Energy: 0.8472595996613268
Energy: 0.7917944673678161
Energy: 0.7243804517588612
Energy: 0.7926491991945782
Energy: 0.8183982199411725
Energy: 0.7243804517567304
Energy: 0.79264919919298
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Energy: 0.7243804517593941
Energy: 0.7926491991945782
Energy: 0.8183982199422378
Energy: 0.7243804517572633
Energy: 0.7943790406349958
Energy: 0.7945318967111743
Energy: 0.8355310425037243
Energy: 0.7943790406371266
Energy: 0.7945318967127724
Energy: 0.8355310425042572
Energy: 0.794379040634463
Energy: 0.794531896711707
Energy: 0.8355310425037243
Energy: 0.7943790406365939
Energy: 0.7935073138562554
Energy: 0.7208914867162495
Energy: 0.7200150931373068
Energy: 0.7935073138594517
Energy: 0.7208914867189131
Energy: 0.7200150931373068
Energy: 0.793507313856788
Energy: 0.7208914867173148
Energy: 0.7200150931362415
Energy: 0.7935073138594517
Energy: 0.7922945309646358
Energy: 0.7041835891571898
Energy: 0.8548564068946245
Energy: 0.7922945309619721
Energy: 0.7041835898728477
Energy: 0.8548564068972639
Energy: 0.7922945309641031
Energy: 0.7041835911742288
Energy: 0.8548564068962228
Energy: 0.7922945309619721
Energy: 0.7105830784369158
Energy: 0.7485981017441932
Energy: 0.7216923252676488
Energy: 0.7105830784251961
Energy: 0.7485981017787957
Energy: 0.721692325267116
Energy: 0.7105830784305233
Energy: 0.7485981017926463
Energy: 0.7216923252655177
Energy: 0.7105830784289251
Energy: 0.7113399823886756
Energy: 0.844718316802713
Energy: 0.8386501174169159
Energy: 0.7113399823886756
Energy: 0.8447183168021802
Energy: 0.8386501174158504
Energy: 0.7113399823886756
Energy: 0.844718316802713
Energy: 0.8386501174163831
Energy: 0.7113399823886756

minimum gb energy = 0.7040315132188083 eV
minimum distance =  2.68141411765287 Angstroms
sigma value = 41


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

Energy: 0.829890782849526
Energy: 0.7658706291171357
Energy: 0.765721967597235
Energy: 0.7836215379041027
Energy: 0.7658706291157076
Energy: 0.7657219675982873
Energy: 0.8298907828486992
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Energy: 0.7836215379041027
Energy: 0.7646557958717096
Energy: 0.6488114115344531
Energy: 0.7732521630693191
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Energy: 0.6488114115340397
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Energy: 0.7646557958723109
Energy: 0.7831182581021269
Energy: 0.6515814624230385
Energy: 0.6958282574300009
Energy: 0.7623619291208642
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Energy: 0.695872835746915
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Energy: 0.7516189434237178
Energy: 0.6700016383547013
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Energy: 0.6700016383563548
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Energy: 0.6860760523452928
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Energy: 0.7724852006266314
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Energy: 0.6857333465899609
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Energy: 0.6725191362309477
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Energy: 0.6632091597081039
Energy: 0.681673766630922
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Energy: 0.7540115436965258
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Energy: 0.7729236381577701
Energy: 0.6554341407423826
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Energy: 0.7729236381592357
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Energy: 0.7729236381643841
Energy: 0.6554341407423826
Energy: 0.7283741818212022
Energy: 0.7729236381590103
Energy: 0.7718666589458026
Energy: 0.7659753541586396
Energy: 0.8067692939871165
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Energy: 0.7838652402708828
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Energy: 0.7718666589441491
Energy: 0.6490722291864756
Energy: 0.7768449045430003
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Energy: 0.7144491502024157
Energy: 0.6490722291809137
Energy: 0.7768449045440149
Energy: 0.7300440594870996
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Energy: 0.6516079205143526
Energy: 0.6822906396283439
Energy: 0.6825002026415047
Energy: 0.6516079205164194
Energy: 0.6819582258296779
Energy: 0.6826772373485335
Energy: 0.6516079205238602
Energy: 0.6822906396308241
Energy: 0.6825002026409034
Energy: 0.65160792052138
Energy: 0.6573060371087862
Energy: 0.6861510100905754
Energy: 0.6700943226046674
Energy: 0.6573060371093875
Energy: 0.6863173904193343
Energy: 0.6700943226213906
Energy: 0.6573060371060804
Energy: 0.686151010083548
Energy: 0.6700943226027883
Energy: 0.6573060371054791
Energy: 0.8018476416584212
Energy: 0.6846859663052716
Energy: 0.7317555316986943
Energy: 0.8018476416631939
Energy: 0.684722106212432
Energy: 0.7317555316999345
Energy: 0.8018476416650352
Energy: 0.6846859663054969
Energy: 0.7317555317009867
Energy: 0.8018476416598868
Energy: 0.7625211004904703
Energy: 0.7192123990530821
Energy: 0.674049104350851
Energy: 0.7625211004933263
Energy: 0.7192123990555623
Energy: 0.6740491043562249
Energy: 0.7625211004931385
Energy: 0.7192123990547357
Energy: 0.6740491043543458
Energy: 0.7625211004935518

minimum gb energy = 0.6488114115326117 eV
minimum distance =  2.59931875955083 Angstroms
sigma value = 185


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

Energy: 0.4356038394432597
Energy: 0.38728528017553426
Energy: 0.3871598584213341
Energy: 0.34564627347084786
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Energy: 0.38728528017651564
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Energy: 0.39538171402659317
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Energy: 0.49446788065009634
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Energy: 0.4011438811148558
Energy: 0.4944678806525499
Energy: 0.3148095343699494
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Energy: 0.49446788065058705
Energy: 0.3467588645398292
Energy: 0.401143881112157
Energy: 0.4944678806510777
Energy: 0.32947170995881936
Energy: 0.44022525269075075
Energy: 0.38654663409274925
Energy: 0.39046295599574804
Energy: 0.4186238191443785
Energy: 0.38654663409225853
Energy: 0.32947170996127295
Energy: 0.4402252526939403
Energy: 0.38654663409127715
Energy: 0.3904629559974655
Energy: 0.3139278413316387
Energy: 0.3150678985843163
Energy: 0.4086961496688317
Energy: 0.3139332068206892
Energy: 0.31495411310045013
Energy: 0.4086961496683411
Energy: 0.3139278413294305
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Energy: 0.4086961496680957
Energy: 0.3139332068211799
Energy: 0.3952150864784088
Energy: 0.4276362077151854
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Energy: 0.4276362077171483
Energy: 0.37739440955631676
Energy: 0.3952150864784088
Energy: 0.4276362077151854
Energy: 0.3773944095560714
Energy: 0.3952150864808623

minimum gb energy = 0.2832303818044777 eV
minimum distance =  2.71552230814804 Angstroms
sigma value = 33


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

Energy: 0.642249177866415
Energy: 0.6880794642361647
Energy: 0.6878463803882394
Energy: 0.6116516920793679
Energy: 0.6880794642321238
Energy: 0.6878463803855456
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Energy: 0.6454704244228091
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Energy: 0.6273888234776926
Energy: 0.7057204082777476
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minimum gb energy = 0.5913247892687317 eV
minimum distance =  2.59509589722046 Angstroms
sigma value = 219


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

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Energy: 0.7309977373856855
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Energy: 0.8334428850155542
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Energy: 0.7312366044434315
Energy: 0.8098802522104795
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Energy: 0.8531202120428377
Energy: 0.8098802522104795
Energy: 0.7538884110751368
Energy: 0.853120212043729
Energy: 0.8098802522104795

minimum gb energy = 0.7309977373856855 eV
minimum distance =  2.65757953425342 Angstroms
sigma value = 15


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

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minimum gb energy = 0.8348498615326777 eV
minimum distance =  2.59856999442069 Angstroms
sigma value = 293


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

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Energy: 0.8990282094298616
Energy: 0.8553104897507019
Energy: 0.8553163768561969
Energy: 0.8990282094296603
Energy: 0.8277583616645189
Energy: 0.8393123617159832
Energy: 0.8295111772062945
Energy: 0.8277583616655256
Energy: 0.8393123617155805
Energy: 0.829511177206496
Energy: 0.8277583616649217
Energy: 0.8393123617155805
Energy: 0.8295111772062945
Energy: 0.8277583616655256
Energy: 0.827881204637604
Energy: 0.896486935314798
Energy: 0.9131215384267178
Energy: 0.8278812046365972
Energy: 0.8964869353156035
Energy: 0.9131215384271204
Energy: 0.827881204638208
Energy: 0.8964869353149995
Energy: 0.9131215384265163
Energy: 0.8278812046361946
Energy: 0.8649490797077106
Energy: 0.8677899156936046
Energy: 0.827296266811336
Energy: 0.8649490797073078
Energy: 0.8677899156938061
Energy: 0.8272962668105304
Energy: 0.8649490797079119
Energy: 0.8677899156934034
Energy: 0.8272962668109332
Energy: 0.8649490797071067
Energy: 0.8972856309325763
Energy: 0.9304325491784126
Energy: 0.8288151850296629
Energy: 0.8972856309323749
Energy: 0.9304325491872535
Energy: 0.8288151850284546
Energy: 0.8972856309327776
Energy: 0.9304325492100061
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Energy: 0.8972856309321735
Energy: 0.8475392906701521
Energy: 0.846630527701305
Energy: 0.828127432188254
Energy: 0.847539290669548
Energy: 0.8466305277015063
Energy: 0.8281274321884555
Energy: 0.8475392906701521
Energy: 0.8466305277015063
Energy: 0.828127432188254
Energy: 0.8475392906699507
Energy: 0.8888599840969272
Energy: 0.8697465718800154
Energy: 0.8275354977697525
Energy: 0.8888599840951151
Energy: 0.8697465718804182
Energy: 0.8275354977701553
Energy: 0.8888599840963232
Energy: 0.8697465718796128
Energy: 0.8275354977697525
Energy: 0.8888599840949138
Energy: 0.8478456831759342
Energy: 0.8740843725505835
Energy: 0.8744593449095656
Energy: 0.84784568317652
Energy: 0.8740843725489726
Energy: 0.8744593449109752
Energy: 0.8478456831763185
Energy: 0.8740843725499793
Energy: 0.874459344910371
Energy: 0.84784568317652
Energy: 0.888783578551225
Energy: 0.827386958019568
Energy: 0.8695959020131602
Energy: 0.888783578551225
Energy: 0.8273869580197692
Energy: 0.8695959020123549
Energy: 0.888783578551225
Energy: 0.8273869580203732
Energy: 0.869595902014167
Energy: 0.8887835785514264
Energy: 0.8475630793953337
Energy: 0.8280843206343815
Energy: 0.8466102884195935
Energy: 0.8475630793949311
Energy: 0.8280843206343815
Energy: 0.8466102884175799
Energy: 0.8475630793955351
Energy: 0.82808432063418
Energy: 0.8466102884173786
Energy: 0.8475630793947296
Energy: 0.8972972581071399
Energy: 0.8287968344780009
Energy: 0.9301640969847124
Energy: 0.8972972581073414
Energy: 0.8287968344777995
Energy: 0.9301640969909541
Energy: 0.8972972581071399
Energy: 0.8287968344780009
Energy: 0.9301640969867259
Energy: 0.8972972581073414
Energy: 0.8650478329886655
Energy: 0.8272699929928772
Energy: 0.8675689847976219
Energy: 0.8650478329878601
Energy: 0.8272699929928772
Energy: 0.8675689847974206
Energy: 0.8650478329884642
Energy: 0.8272699929928772
Energy: 0.8675689847974206
Energy: 0.8650478329870548
Energy: 0.8278264758879942
Energy: 0.9132008298852891
Energy: 0.8964518273509989
Energy: 0.8278264758875916
Energy: 0.9132008298816648
Energy: 0.8964518273516029
Energy: 0.8278264758875916
Energy: 0.9132008298814633
Energy: 0.8964518273505961
Energy: 0.8278264758865849
Energy: 0.8277543450399163
Energy: 0.8296556003632931
Energy: 0.8397795101983048
Energy: 0.8277543450397149
Energy: 0.8296556003638973
Energy: 0.8397795101979022
Energy: 0.8277543450401177
Energy: 0.8296556003640985
Energy: 0.8397795101997142
Energy: 0.8277543450383056
Energy: 0.8990282094298616
Energy: 0.8553104897505003
Energy: 0.855316376856398
Energy: 0.8990282094296603
Energy: 0.8553104897511046
Energy: 0.8553163768561969
Energy: 0.8990282094296603
Energy: 0.8553104897505003
Energy: 0.8553163768561969
Energy: 0.8990282094296603
Energy: 0.8277583616641162
Energy: 0.8393123617149765
Energy: 0.829511177206496
Energy: 0.8277583616645189
Energy: 0.8393123617147752
Energy: 0.8295111772062945
Energy: 0.8277583616643177
Energy: 0.8393123617147752
Energy: 0.8295111772062945
Energy: 0.8277583616635122
Energy: 0.827881204637
Energy: 0.8964869353156035
Energy: 0.913121538426919
Energy: 0.8278812046386108
Energy: 0.896486935314798
Energy: 0.9131215384267178
Energy: 0.8278812046359931
Energy: 0.8964869353160062
Energy: 0.9131215384267178
Energy: 0.8278812046384094
Energy: 0.8649490797075092
Energy: 0.8677899156938061
Energy: 0.8272962668109332
Energy: 0.8649490797071067
Energy: 0.8677899156936046
Energy: 0.8272962668109332
Energy: 0.8649490797075092
Energy: 0.8677899156936046
Energy: 0.8272962668107318
Energy: 0.8649490797073078
Energy: 0.8972856309325763
Energy: 0.9304325491800233
Energy: 0.8288151850276493
Energy: 0.8972856309327776
Energy: 0.9304325491721707
Energy: 0.8288151850304682
Energy: 0.8972856309327776
Energy: 0.9304325491665331
Energy: 0.8288151850288574
Energy: 0.8972856309329789

minimum gb energy = 0.827269992992273 eV
minimum distance =  2.58350960976689 Angstroms
sigma value = 293


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

Energy: 0.8345774365715721
Energy: 0.8354272093619106
Energy: 0.835430844084635
Energy: 0.8345774365719361
Energy: 0.8354272093626384
Energy: 0.8354308440824516
Energy: 0.8345774365722999
Energy: 0.8354272093626384
Energy: 0.8354308440824516
Energy: 0.8345774365730277
Energy: 0.8345171403489461
Energy: 0.8346760025597457
Energy: 0.8353436857579692
Energy: 0.8345171404064283
Energy: 0.834676002559018
Energy: 0.8353436857561497
Energy: 0.8345171404209684
Energy: 0.8346760025597457
Energy: 0.8353436857561497
Energy: 0.8345171403474904
Energy: 0.8338036702538184
Energy: 0.8339450533726085
Energy: 0.8059951077014539
Energy: 0.8338036702541824
Energy: 0.8339450533718806
Energy: 0.805995112689611
Energy: 0.8338036702534546
Energy: 0.8339450533718806
Energy: 0.8059952401009881
Energy: 0.8338036702534546
Energy: 0.8074217917376196
Energy: 0.8339685702657021
Energy: 0.833774674849547
Energy: 0.8074218909908008
Energy: 0.8339685702653381
Energy: 0.8337746748491832
Energy: 0.807421772438302
Energy: 0.8339685702657021
Energy: 0.8337746748491832
Energy: 0.8074218040412399
Energy: 0.8352953775986718
Energy: 0.8346737365748025
Energy: 0.8349441309544032
Energy: 0.8352953776015831
Energy: 0.8346737365740746
Energy: 0.8349441310751736
Energy: 0.8352953775990356
Energy: 0.8346737365748025
Energy: 0.8349441309260344
Energy: 0.8352953776015831
Energy: 0.8354272093619106
Energy: 0.8354308440839073
Energy: 0.8345774365715721
Energy: 0.835427209364094
Energy: 0.8354308440839073
Energy: 0.8345774365719361
Energy: 0.8354272093622744
Energy: 0.8354308440842712
Energy: 0.8345774365715721
Energy: 0.8354272093626384
Energy: 0.834676002559018
Energy: 0.8353436857568776
Energy: 0.8345171403373175
Energy: 0.8346760025601097
Energy: 0.8353436857568776
Energy: 0.8345171403344062
Energy: 0.834676002559018
Energy: 0.8353436857597889
Energy: 0.8345171403402286
Energy: 0.8346760025597457
Energy: 0.8339450533718806
Energy: 0.8059951337058654
Energy: 0.8338036702538184
Energy: 0.8339450533726085
Energy: 0.8059951568657147
Energy: 0.8338036702538184
Energy: 0.833945053370789
Energy: 0.8059952464935947
Energy: 0.8338036702538184
Energy: 0.8339450533726085
Energy: 0.8339685702657021
Energy: 0.8337746748491832
Energy: 0.8074218556728479
Energy: 0.8339685702657021
Energy: 0.833774674849547
Energy: 0.8074217806875065
Energy: 0.8339685702657021
Energy: 0.8337746748491832
Energy: 0.8074218198110727
Energy: 0.8339685702657021
Energy: 0.8346737365740746
Energy: 0.8349441309285817
Energy: 0.8352953776001273
Energy: 0.8346737365748025
Energy: 0.8349441309485806
Energy: 0.8352953776015831
Energy: 0.8346737365740746
Energy: 0.8349441309442137
Energy: 0.8352953775993995
Energy: 0.8346737365748025
Energy: 0.8354308440842712
Energy: 0.8345774365719361
Energy: 0.8354272093622744
Energy: 0.8354308440835433
Energy: 0.8345774365719361
Energy: 0.8354272093622744
Energy: 0.8354308440835433
Energy: 0.8345774365719361
Energy: 0.8354272093626384
Energy: 0.8354308440839073
Energy: 0.8353436857586971
Energy: 0.8345171403329503
Energy: 0.834676002559018
Energy: 0.8353436857583332
Energy: 0.8345171403562244
Energy: 0.8346760025601097
Energy: 0.8353436857565136
Energy: 0.8345171403773315
Energy: 0.8346760025593818
Energy: 0.8353436857579692
Energy: 0.8059950853640538
Energy: 0.8338036702530907
Energy: 0.8339450533715168
Energy: 0.8059952172547018
Energy: 0.8338036702538184
Energy: 0.8339450533715168
Energy: 0.8059950875123796
Energy: 0.8338036702534546
Energy: 0.8339450533715168
Energy: 0.805995250589464
Energy: 0.833774674849547
Energy: 0.8074217530029134
Energy: 0.8339685702653381
Energy: 0.8337746748491832
Energy: 0.807421919025315
Energy: 0.8339685702657021
Energy: 0.833774674849547
Energy: 0.8074217455099588
Energy: 0.8339685702657021
Energy: 0.8337746748491832
Energy: 0.8349441309405744
Energy: 0.8352953776015831
Energy: 0.8346737365740746
Energy: 0.8349441309500362
Energy: 0.8352953776008551
Energy: 0.8346737365748025
Energy: 0.8349441309227592
Energy: 0.8352953776004912
Energy: 0.8346737365740746
Energy: 0.834944130968232
Energy: 0.8345774365722999
Energy: 0.8354272093619106
Energy: 0.8354308440824516
Energy: 0.8345774365722999
Energy: 0.8354272093626384
Energy: 0.8354308440824516
Energy: 0.8345774365719361
Energy: 0.8354272093630023
Energy: 0.8354308440835433
Energy: 0.8345774365726639
Energy: 0.8345171403587719
Energy: 0.8346760025597457
Energy: 0.8353436857579692
Energy: 0.8345171403311308
Energy: 0.8346760025593818
Energy: 0.8353436857572414
Energy: 0.8345171403551327
Energy: 0.8346760025597457
Energy: 0.8353436857576054
Energy: 0.8345171403391369
Energy: 0.8338036702538184
Energy: 0.8339450533722446
Energy: 0.8059952911800566
Energy: 0.8338036702538184
Energy: 0.8339450533715168
Energy: 0.8059950830742312
Energy: 0.8338036702538184
Energy: 0.8339450533733365
Energy: 0.8059951688252196
Energy: 0.8338036702534546
Energy: 0.8074218071338767
Energy: 0.8339685702657021
Energy: 0.8337746748491832
Energy: 0.8074217448468218
Energy: 0.8339685702657021
Energy: 0.8337746748491832
Energy: 0.8074218030136416
Energy: 0.8339685702657021
Energy: 0.8337746748491832
Energy: 0.8074217180501663
Energy: 0.8352953775983077
Energy: 0.8346737365748025
Energy: 0.8349441309202117
Energy: 0.8352953776015831
Energy: 0.8346737365740746
Energy: 0.8349441310402542
Energy: 0.8352953776001273
Energy: 0.8346737365748025
Energy: 0.8349441310795405
Energy: 0.8352953775993995
Energy: 0.8354272093626384
Energy: 0.8354308440839073
Energy: 0.8345774365719361
Energy: 0.8354272093615466
Energy: 0.8354308440828153
Energy: 0.8345774365722999
Energy: 0.8354272093615466
Energy: 0.8354308440842712
Energy: 0.8345774365719361
Energy: 0.8354272093630023
Energy: 0.8346760025593818
Energy: 0.8353436857579692
Energy: 0.8345171403395009
Energy: 0.8346760025597457
Energy: 0.8353436857583332
Energy: 0.8345171403380451
Energy: 0.8346760025593818
Energy: 0.8353436857565136
Energy: 0.8345171403620472
Energy: 0.8346760025601097

minimum gb energy = 0.8059950830742312 eV
minimum distance =  2.6665986014062 Angstroms
sigma value = 15


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

Energy: 0.8556144450392839
Energy: 0.8846541195566676
Energy: 0.8845421189143436
Energy: 0.8309459518526277
Energy: 0.8846541195616165
Energy: 0.8845421189192926
Energy: 0.8556144450425831
Energy: 0.8846541195599669
Energy: 0.8845421189159931
Energy: 0.8309459518526277
Energy: 0.8837895955937555
Energy: 0.868796764925503
Energy: 0.8295113112417675
Energy: 0.8837895955888067
Energy: 0.8687967649222038
Energy: 0.8295113112450667
Energy: 0.883789595592106
Energy: 0.8687967649222038
Energy: 0.8295113112417675
Energy: 0.8837895955970548
Energy: 0.8670438569209662
Energy: 0.8518838573178649
Energy: 0.9026474295018185
Energy: 0.8670438569209662
Energy: 0.8518838573195144
Energy: 0.9026477024971452
Energy: 0.8670438569226158
Energy: 0.8518838573145655
Energy: 0.902648064222592
Energy: 0.8670438569209662
Energy: 0.825476679757105
Energy: 0.8516026121935437
Energy: 0.8249125520838779
Energy: 0.8254766797554554
Energy: 0.8516026121918943
Energy: 0.824912552078929
Energy: 0.8254766797554554
Energy: 0.8516026121902446
Energy: 0.8249125520822284
Energy: 0.8254766797554554
Energy: 0.8847074189420522
Energy: 0.8505544046697451
Energy: 0.8934577210846767
Energy: 0.8847074189404025
Energy: 0.8505544046730443
Energy: 0.8934577210846767
Energy: 0.8847074189420522
Energy: 0.8505544046779931
Energy: 0.8934577210846767
Energy: 0.8847074189420522
Energy: 0.8699198883331882
Energy: 0.8962845839934855
Energy: 0.8231865121884471
Energy: 0.8699198883348379
Energy: 0.8962845839918361
Energy: 0.8231865121884471
Energy: 0.8699198883315387
Energy: 0.8962845839934855
Energy: 0.8231865121917462
Energy: 0.8699198883331882
Energy: 0.8549996519851574
Energy: 0.872701373956421
Energy: 0.8462071495849023
Energy: 0.8550655821625895
Energy: 0.8727013739580707
Energy: 0.8462071495882015
Energy: 0.8549996519802084
Energy: 0.8727013739597204
Energy: 0.846207149586552
Energy: 0.8550655821642392
Energy: 0.847780451154308
Energy: 0.9200962143315093
Energy: 0.8863171200954219
Energy: 0.8477804511526583
Energy: 0.9200962143381081
Energy: 0.8863171200937724
Energy: 0.8477804511526583
Energy: 0.9200962143414073
Energy: 0.8863171200921227
Energy: 0.847780451154308
Energy: 1.0163497743055026
Energy: 0.8441000844556491
Energy: 0.8444723118341151
Energy: 1.0163497743071523
Energy: 0.8321633541699689
Energy: 0.8322523020422365
Energy: 1.016349774303853
Energy: 0.8441000844539996
Energy: 0.8444723118357648
Energy: 1.0163497743055026
Energy: 0.8483343041691987
Energy: 0.9546910243155408
Energy: 0.917619387626261
Energy: 0.8481597423684107
Energy: 0.9546910243171906
Energy: 0.9149328019462332
Energy: 0.8483343041691987
Energy: 0.95469102431884
Energy: 0.9176193876279107
Energy: 0.8481597423651116
Energy: 0.8662113519410857
Energy: 0.8183143002923227
Energy: 0.8841773586212802
Energy: 0.8662113519377862
Energy: 0.8183143002989212
Energy: 0.8841773586278786
Energy: 0.8662113519377862
Energy: 0.8183143002972716
Energy: 0.8841773586212802
Energy: 0.8662113519394359
Energy: 0.8999266655863335
Energy: 0.8220582848616251
Energy: 0.9499974320951254
Energy: 0.8999266655879831
Energy: 0.8220590809972628
Energy: 0.9499974320918261
Energy: 0.8999266655846838
Energy: 0.8220582848566763
Energy: 0.9499974320951254
Energy: 0.8999266655863335
Energy: 0.9319512091052964
Energy: 0.8222540421948547
Energy: 0.8768695540959669
Energy: 0.9319512091069461
Energy: 0.8222540421948547
Energy: 0.8768695541009158
Energy: 0.9319512091069461
Energy: 0.8222540421965042
Energy: 0.8768695540992661
Energy: 0.9319512091052964
Energy: 0.8223887651771226
Energy: 0.8206632383874936
Energy: 0.9391373173971104
Energy: 0.8223887651804217
Energy: 0.8206632383907928
Energy: 0.9391373173971104
Energy: 0.822388765178772
Energy: 0.8206632383858441
Energy: 0.9391373174004096
Energy: 0.8223887651754729
Energy: 0.8864818230096599
Energy: 0.9211761682120188
Energy: 0.8280023351819596
Energy: 0.8864818230096599
Energy: 0.9211761681922233
Energy: 0.8279906334414907
Energy: 0.8864818230096599
Energy: 0.9211761682334639
Energy: 0.8280023351737116
Energy: 0.8864818230096599
Energy: 0.8331240158878449
Energy: 0.8349400715555586
Energy: 0.9326457704847462
Energy: 0.8331240158911442
Energy: 0.8349400715572081
Energy: 0.9326457704830967
Energy: 0.8331240158927938
Energy: 0.8349400715605073
Energy: 0.9326457704797972
Energy: 0.8331240158878449
Energy: 0.8311608677679276
Energy: 0.9283605307773963
Energy: 0.9392628928405256
Energy: 0.8311608677662778
Energy: 0.9283605307790459
Energy: 0.9392628928438247
Energy: 0.8311608677662778
Energy: 0.9283605307823453
Energy: 0.9392628928372264
Energy: 0.8311608677662778
Energy: 0.9185896371981722
Energy: 0.8729065730878947
Energy: 0.8280679787737184
Energy: 0.9185896371998219
Energy: 0.8729065730895442
Energy: 0.828067978772069
Energy: 0.9185896372047706
Energy: 0.8729065730878947
Energy: 0.8280679787753681
Energy: 0.9185896372047706
Energy: 0.8358652790412171
Energy: 0.9627914946514446
Energy: 0.8503692328226403
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Energy: 0.9627914946547438
Energy: 0.850369232819341
Energy: 0.8358652790428667
Energy: 0.9627914946530941
Energy: 0.8503692328209905
Energy: 0.835865279046166
Energy: 0.9250463490588908
Energy: 0.8286171998414066
Energy: 0.8635318968782462
Energy: 0.9250463490588908
Energy: 0.8286171998381073
Energy: 0.8635318968831951
Energy: 0.9250463490555915
Energy: 0.8286171998414066
Energy: 0.8635318968831951
Energy: 0.9250463490572411
Energy: 0.8737627252195559
Energy: 0.851688615251324
Energy: 0.937611512376557
Energy: 0.8737627252212053
Energy: 0.851688615251324
Energy: 0.9376115123782065
Energy: 0.8737627252162565
Energy: 0.8516886152562728
Energy: 0.937611512376557
Energy: 0.873762725214607
Energy: 0.868813380509539
Energy: 0.9536101095664475
Energy: 0.8232085352096271
Energy: 0.8688133805128382
Energy: 0.9536101095664475
Energy: 0.8232085352079777
Energy: 0.8688133805078895
Energy: 0.9536101095664475
Energy: 0.823208535206328
Energy: 0.868813380509539
Energy: 0.8523830634188335
Energy: 0.8527100478580082
Energy: 0.882042167853664
Energy: 0.8523681611365077
Energy: 0.8527987794370021
Energy: 0.8820421678520145
Energy: 0.8523830634122352
Energy: 0.8527100478580082
Energy: 0.8820421678503647
Energy: 0.8523681611381574
Energy: 0.8290265293776674
Energy: 0.8749467428599159
Energy: 0.8320237489271327
Energy: 0.8290265293809665
Energy: 0.8749467428632153
Energy: 0.8320237489287824
Energy: 0.8290265293793169
Energy: 0.874946742864865
Energy: 0.8320237489287824
Energy: 0.8290265293793169
Energy: 0.8981385647203401
Energy: 0.8578467640039051
Energy: 0.8582697430156866
Energy: 0.8981385647269385
Energy: 0.8578467640039051
Energy: 0.8582697430222851
Energy: 0.8981385647219898
Energy: 0.8578467640022556
Energy: 0.8582697430222851
Energy: 0.8981385647186904
Energy: 0.8480004557779278
Energy: 0.8999418230845856
Energy: 0.8806855957727532
Energy: 0.8481285618999304
Energy: 0.8999418230862354
Energy: 0.8913591377692222
Energy: 0.8480004557746285
Energy: 0.8999418230845856
Energy: 0.880685595774403
Energy: 0.8481285618949815
Energy: 0.8837446309685363
Energy: 0.8179282339947218
Energy: 0.8847165520805027
Energy: 0.8837446309751349
Energy: 0.8179282339914227
Energy: 0.8847165520805027
Energy: 0.883744630965237
Energy: 0.8179282339947218
Energy: 0.8847165520755541
Energy: 0.8837446309668867
Energy: 0.8971409310526188
Energy: 0.9221706654925147
Energy: 0.9514111260204247
Energy: 0.8971409310542685
Energy: 0.922170665495814
Energy: 0.9514111260204247
Energy: 0.8971409310542685
Energy: 0.9221706654925147
Energy: 0.9514111260187749
Energy: 0.8971409310575678
Energy: 0.9186880635308727
Energy: 0.8220908967735426
Energy: 0.8509935952289864
Energy: 0.9022967300964676
Energy: 0.8219132227438432
Energy: 0.8509935952405339
Energy: 0.9186880635094277
Energy: 0.8220908967685938
Energy: 0.8509935952405339
Energy: 0.9022967300997667
Energy: 0.8324718182577648
Energy: 0.822133547727165
Energy: 0.880455032193991
Energy: 0.8324718182577648
Energy: 0.8221335477255152
Energy: 0.8804550321956405
Energy: 0.8324718182544656
Energy: 0.8221335477304641
Energy: 0.8804550322005894
Energy: 0.8324718182561154
Energy: 0.9471020207017351
Energy: 0.8837447160634265
Energy: 0.8291533367646815
Energy: 0.9471020207000855
Energy: 0.8837447160667258
Energy: 0.8291576455113208
Energy: 0.9471020207033847
Energy: 0.8837447160683755
Energy: 0.8291533367663312
Energy: 0.947102020706684
Energy: 0.8195694771876143
Energy: 0.8888584942686482
Energy: 0.929203664087269
Energy: 0.8195694771925632
Energy: 0.8888584942719474
Energy: 0.92920366408232
Energy: 0.8195694771958624
Energy: 0.8888584942719474
Energy: 0.9292036640856193
Energy: 0.8195694771892638
Energy: 0.855786269804792
Energy: 0.9321717634984067
Energy: 0.8645672024690871
Energy: 0.8308800071435435
Energy: 0.932171763496757
Energy: 0.8645672024723864
Energy: 0.8557862698014927
Energy: 0.9321717634951073
Energy: 0.8645672024756855
Energy: 0.8308800071369448
Energy: 0.8556639335034301
Energy: 0.8744659081981068
Energy: 0.9266790311010299
Energy: 0.8307873439522486
Energy: 0.8744659081997564
Energy: 0.9272801877128897
Energy: 0.8556639335067293
Energy: 0.8744659081997564
Energy: 0.9266790311026794
Energy: 0.8307873439522486
Energy: 0.8195213230868413
Energy: 0.9085045295060213
Energy: 0.8867888235775131
Energy: 0.819521323088491
Energy: 0.9085045295093206
Energy: 0.8867888235775131
Energy: 0.8195213230901406
Energy: 0.9085045295142395
Energy: 0.8867888235775131
Energy: 0.819521323088491
Energy: 0.8623417967273922
Energy: 0.8301916945634286
Energy: 0.8630718545590692
Energy: 0.8623417967257425
Energy: 0.8301916945617789
Energy: 0.8630718545623385
Energy: 0.8623417967257425
Energy: 0.8301916945617789
Energy: 0.8630718545574197
Energy: 0.8623417967273922
Energy: 0.8332694391074862
Energy: 0.9315463965303831
Energy: 0.8207227563973629
Energy: 0.8332694391008875
Energy: 0.9315463965287334
Energy: 0.8208191417192198
Energy: 0.8332694391041869
Energy: 0.9315463965303831
Energy: 0.8207227563973629
Energy: 0.8332694391041869
Energy: 0.9693597325858359
Energy: 0.8862296421862261
Energy: 0.8219899904383837
Energy: 0.9693597325841863
Energy: 0.8862296421845766
Energy: 0.8219899904400332
Energy: 0.9693597325841863
Energy: 0.8862296421845766
Energy: 0.8219899904334348
Energy: 0.9693597325808868
Energy: 0.8720727575184123
Energy: 0.9277485777549421
Energy: 0.8318038690596674
Energy: 0.872072757520062
Energy: 0.9277485777549421
Energy: 0.8318038690547184
Energy: 0.8720727575167628
Energy: 0.927748577751643
Energy: 0.8318038690580176
Energy: 0.8720727575167628
Energy: 0.9408093726121408
Energy: 0.8859457732654994
Energy: 0.8325847691664235
Energy: 0.9408093726154402
Energy: 0.8859457732654994
Energy: 0.832584769164774
Energy: 0.9408093726121408
Energy: 0.8859457732638499
Energy: 0.832584769164774
Energy: 0.9408093726088416
Energy: 0.8491429178830376
Energy: 0.8896530338382512
Energy: 0.8638047120868787
Energy: 0.849142917881388
Energy: 0.8896530338432
Energy: 0.8638047120835795
Energy: 0.849142917881388
Energy: 0.8896530338399009
Energy: 0.8638047120835795
Energy: 0.8491429178797382
Energy: 0.9372042850686023
Energy: 0.8479743238423605
Energy: 0.8444209775239329
Energy: 0.9372042850669526
Energy: 0.8352055897410382
Energy: 0.8321350939170625
Energy: 0.9372042850636535
Energy: 0.8479743238473094
Energy: 0.8444209775239329
Energy: 0.9372042850686023
Energy: 0.9388329590230424
Energy: 0.8244032580403399
Energy: 0.8902912999665458
Energy: 0.9388329590180935
Energy: 0.8244032580386901
Energy: 0.8902912999698451
Energy: 0.9388329590164438
Energy: 0.8244032580403399
Energy: 0.8902912999681954
Energy: 0.9388329590213926
Energy: 0.8517924951790393
Energy: 0.9568115693567611
Energy: 0.8520157194238195
Energy: 0.8517924951773898
Energy: 0.9568115693567611
Energy: 0.8520157194254692
Energy: 0.85179249517574
Energy: 0.9568115693518123
Energy: 0.8520157194238195
Energy: 0.8517924951740905
Energy: 0.8785714595743249
Energy: 0.8213581499882171
Energy: 0.9550277160833206
Energy: 0.8785714595710258
Energy: 0.8213462440540718
Energy: 0.9550277160816709
Energy: 0.878571459569376
Energy: 0.8213581499931659
Energy: 0.9550277160800212
Energy: 0.8785714595726752
Energy: 0.8321989312314004
Energy: 0.8319374183019965
Energy: 0.9313128419900902
Energy: 0.8321989312396186
Energy: 0.8319374183052957
Energy: 0.9313128419900902
Energy: 0.8321989312396186
Energy: 0.8319374183003468
Energy: 0.9313128419900902
Energy: 0.8321989312314004
Energy: 0.8310875886511165
Energy: 0.8697830193602367
Energy: 0.8283346299337948
Energy: 0.8310875886527661
Energy: 0.869783019363536
Energy: 0.828334122507376
Energy: 0.8310875886511165
Energy: 0.8697830193651857
Energy: 0.8283346299354445
Energy: 0.8310875886494669
Energy: 0.8279241179801867
Energy: 0.8567540590050022
Energy: 0.8871670056535965
Energy: 0.827924117978537
Energy: 0.8567540590083016
Energy: 0.887167005651947
Energy: 0.827924117978537
Energy: 0.856754059006652
Energy: 0.887167005651947
Energy: 0.827924117978537
Energy: 0.8307898560293534
Energy: 0.9323688106660969
Energy: 0.8700479590827374
Energy: 0.8307898560194855
Energy: 0.9323688106677464
Energy: 0.8700479590777886
Energy: 0.8307898560211352
Energy: 0.9323688106693961
Energy: 0.8700479590794382
Energy: 0.8307898560244344

minimum gb energy = 0.8179282339914227 eV
minimum distance =  2.6009072397959 Angstroms
sigma value = 437


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

Energy: 0.7889366395423582
Energy: 0.8023824939313113
Energy: 0.8023228151628822
Energy: 0.7889366395435601
Energy: 0.8023824939313113
Energy: 0.8023228151622812
Energy: 0.7889366395429592
Energy: 0.8023824939313113
Energy: 0.8023228151628822
Energy: 0.7889366395435601
Energy: 0.8900154586352633
Energy: 0.7782552758162098
Energy: 0.789017054413772
Energy: 0.8900154586370664
Energy: 0.7782552758144068
Energy: 0.7890170544143731
Energy: 0.8900154586358644
Energy: 0.7782552758156087
Energy: 0.789017054413171
Energy: 0.8900154586382683
Energy: 0.8862320613937242
Energy: 0.7712793747478827
Energy: 0.8949388153020477
Energy: 0.8862320613937242
Energy: 0.7712793747466807
Energy: 0.8949388766733911
Energy: 0.8862320613937242
Energy: 0.7712793747478827
Energy: 0.8949389760222606
Energy: 0.8862320613931233
Energy: 0.804316110005443
Energy: 0.8859313743347405
Energy: 0.8053263022813875
Energy: 0.8043161099970292
Energy: 0.8859313743311344
Energy: 0.8053263022837913
Energy: 0.804316110004842
Energy: 0.8859313743377454
Energy: 0.8053263022813875
Energy: 0.8043161100102509
Energy: 0.8084464959798889
Energy: 0.7882138465777847
Energy: 0.9153984471298422
Energy: 0.8084464959828939
Energy: 0.7882138465777847
Energy: 0.9153984471286403
Energy: 0.8084464959804899
Energy: 0.7882138465777847
Energy: 0.9153984471256353
Energy: 0.8084464959828939
Energy: 0.8046335445141404
Energy: 0.899993227642573
Energy: 0.7785333300044581
Energy: 0.8046335445129382
Energy: 0.8999932276449769
Energy: 0.7785333300062612
Energy: 0.8046335445141404
Energy: 0.8999932276437749
Energy: 0.7785333300044581
Energy: 0.8046335445135392
Energy: 0.821602447749716
Energy: 0.7991984597044779
Energy: 0.7711766402474712
Energy: 0.8216024477449082
Energy: 0.7991984597044779
Energy: 0.7711766402462693
Energy: 0.821602447749716
Energy: 0.7991984597044779
Energy: 0.7711766402474712
Energy: 0.8216024477479131
Energy: 0.7925238914609963
Energy: 0.9220835932448385
Energy: 0.8549589241970996
Energy: 0.7925238914585924
Energy: 0.9220835932454398
Energy: 0.8549589242001046
Energy: 0.7925238914603953
Energy: 0.9220835932448385
Energy: 0.8549589241977006
Energy: 0.7925238914585924
Energy: 0.9477161638675772
Energy: 0.7879709054024174
Energy: 0.7882649954383889
Energy: 0.9477161638663752
Energy: 0.7879709054048214
Energy: 0.7882649954407929
Energy: 0.9477161638669762
Energy: 0.7879709054030184
Energy: 0.78826499543899
Energy: 0.9477161638669762
Energy: 0.8546662081887143
Energy: 0.8135937784494086
Energy: 0.8740902648754909
Energy: 0.8546662081893153
Energy: 0.8135937784524134
Energy: 0.8740902653969014
Energy: 0.8546662081887143
Energy: 0.8135937784500096
Energy: 0.874090264496432
Energy: 0.8546662081893153
Energy: 0.858591470471361
Energy: 0.778585612455945
Energy: 0.8032617340061635
Energy: 0.858591470471361
Energy: 0.7785856124571471
Energy: 0.8032617340037597
Energy: 0.85859147047076
Energy: 0.8243803319678072
Energy: 0.8383715795557809
Energy: 0.85859147047076
Energy: 0.8152423291269814
Energy: 0.7788333925881087
Energy: 0.8075421676345579
Energy: 0.8152423291275823
Energy: 0.7788333925869066
Energy: 0.8075421676333558
Energy: 0.8152423291257792
Energy: 0.7788333925881087
Energy: 0.8075421676345579
Energy: 0.8152423291281834
Energy: 0.7881533513745738
Energy: 0.8949474368564412
Energy: 0.788398410476244
Energy: 0.7881533513763769
Energy: 0.8949474368552393
Energy: 0.7883984104768449
Energy: 0.7881533513745738
Energy: 0.8949474368564412
Energy: 0.788398410476244
Energy: 0.7881533513769778
Energy: 0.7942136445959095
Energy: 0.8014996889029798
Energy: 0.8054623623186598
Energy: 0.7942136445929046
Energy: 0.8014996889029798
Energy: 0.8054623623162558
Energy: 0.7942136445977125
Energy: 0.8014996889029798
Energy: 0.8054623623156548
Energy: 0.7942136445959095

minimum gb energy = 0.7711766402462693 eV
minimum distance =  2.60974097366649 Angstroms
sigma value = 33