Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Pt__MO_601539325066_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.9200811892747867
cohesive_energy=5.770450689405303
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.64410559651178e-19, 2.75447809093914e-19, 3.64926169749546e-19, 4.42594886435964e-19, 5.132572847019e-19, 5.76338183135748e-19, 6.30349159644522e-19, 6.75786888984762e-19, 7.14102943186872e-19, 7.46684807215896e-19, 7.74617154653052e-19, 7.98734719524654e-19, 8.19686383367472e-19, 8.380056710006279e-19, 8.5412837446857e-19, 8.68386144334536e-19, 8.81008091857188e-19, 8.92112778107442e-19, 9.01719429204906e-19, 9.097623559075859e-19, 9.161438254408078e-19, 9.20756491970094e-19, 9.23531461900182e-19, 9.24455917818e-19, 9.23456159598384e-19, 9.202373867406779e-19, 9.14477561741448e-19, 9.05867464510332e-19, 8.933400454090859e-19, 8.758042221499558e-19, 8.524605085925759e-19, 8.223347813434739e-19, 7.842013752776399e-19, 7.364789420573159e-19, 6.770926629414719e-19, 6.03285191942994e-19, 5.113955554531919e-19, 3.9663004098313793e-19, 2.52752977073304e-19, 7.1582848742169e-20, -1.580398247014038e-19, -4.5201408286725e-19, -8.33550017781474e-19, -1.3356641639939039e-18, -2.0023522918741798e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018925060482314706
Energy: 0.021486827256023702
Energy: 0.5627459223054667
Energy: 0.11160090311154858
Energy: 0.02148682725652746
Energy: 0.5741867416947033
Energy: 0.11160090310894089
Energy: 0.5741867416941698
Energy: 0.562745922304963
Energy: 0.11160090310997804
Energy: 0.018925060482314706
Energy: 0.02148682725652746
Energy: 0.11160090310529606
Energy: 0.5741867416931327
Energy: 0.02148682725652746
Energy: 0.5741867416941698

minimum gb energy = 0.018925060482314706 eV
minimum distance =  2.67544129848851 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.1843068734929163
Energy: 0.8582291243445167
Energy: 0.9228240277996537
Energy: 0.9207965702807394
Energy: 0.8410662511700266
Energy: 0.9346492618624055
Energy: 0.8482016900270936
Energy: 0.9346492618611116
Energy: 0.9222778241150752
Energy: 0.9195261422193632
Energy: 1.2993776284359275
Energy: 0.919526142215482
Energy: 0.8523051283033639
Energy: 0.8493253857303189
Energy: 0.8485426170162864
Energy: 0.8493253857335534
Energy: 1.100190906353865
Energy: 0.8496009367907148
Energy: 0.8520051944041224
Energy: 0.8496009367913617
Energy: 0.8679705699802817
Energy: 0.8646112680311903
Energy: 0.8491079760368799
Energy: 0.8646112680279558
Energy: 0.8726480711190286
Energy: 0.8613492448937642
Energy: 1.097638128875094
Energy: 0.8613492448931174
Energy: 0.8690737513086049
Energy: 0.8729536089641957
Energy: 0.9054008847280163
Energy: 0.8729536089596676
Energy: 0.9540135273911808
Energy: 0.8653838412555278
Energy: 0.9022661962528666
Energy: 0.8653838412561747
Energy: 0.9198274373708399
Energy: 0.8679500699281874
Energy: 0.8844257282657952
Energy: 0.8679500699294811
Energy: 0.8799288563167084
Energy: 0.8650286076282185
Energy: 0.9551086039916761
Energy: 0.8650286076275715
Energy: 0.8685176670560932
Energy: 0.8636300456554512
Energy: 0.9024822792088777
Energy: 0.8636300456554512
Energy: 0.8703690429184433
Energy: 0.8608243725195207
Energy: 0.8415801577588757
Energy: 0.8608243725188738
Energy: 0.8677002227922859
Energy: 0.8639751402430518
Energy: 0.8433244709648773
Energy: 0.8639751402443456
Energy: 0.8410013949172837
Energy: 0.8492464733446059
Energy: 0.8505517010864837
Energy: 0.8492464733446059
Energy: 0.8693908333024893
Energy: 0.8491368894000868
Energy: 0.8482475572268375
Energy: 0.84913688939944
Energy: 0.9202922314497893
Energy: 0.919099029149813
Energy: 0.8541448278062591
Energy: 0.919099029149813
Energy: 0.8490412617971692
Energy: 0.8496767396021233
Energy: 0.8415105920099804
Energy: 0.8496767396014764
Energy: 0.8482077117639127
Energy: 0.9185707649592726
Energy: 0.9213607587580962
Energy: 0.9185707649586257
Energy: 0.8672539226975088
Energy: 0.8489058653353225
Energy: 0.8522624543943079
Energy: 0.8489058653359696
Energy: 0.8533193324680067
Energy: 0.8517654320757606
Energy: 0.8677041468752033
Energy: 0.8517654320783481
Energy: 0.8490523625683806
Energy: 0.8494267726495738
Energy: 0.8681200149938952
Energy: 0.8494267726508676
Energy: 0.8668826494621334
Energy: 0.8639556122925629
Energy: 0.8750138996069222
Energy: 0.863955612291269
Energy: 0.9069229808933612
Energy: 0.8694418197270877
Energy: 0.872822872109639
Energy: 0.8694418197270877
Energy: 0.9010142685817105
Energy: 0.8658317430981342
Energy: 0.9540731539670874
Energy: 0.8658317431000748
Energy: 0.8870623257746713
Energy: 0.8622190570645119
Energy: 0.9206268437936768
Energy: 0.8622190570645119
Energy: 0.9552477503967062
Energy: 0.8626404200698332
Energy: 0.880456000820968
Energy: 0.8626404200704801
Energy: 0.9004143721524899
Energy: 0.8631660009431052
Energy: 0.8682716630304019
Energy: 0.8631660009424584
Energy: 0.8411738305430461
Energy: 0.8612006362136191
Energy: 0.8698387272980226
Energy: 0.8612006362123255
Energy: 0.8436085339664774
Energy: 0.8658568419908658
Energy: 0.868933753195992
Energy: 0.8658568419941002
Energy: 0.8497083025114742
Energy: 0.8489883232654198
Energy: 0.840942041172892
Energy: 0.848988323264126
Energy: 0.848128887645481
Energy: 0.8493793242883061
Energy: 0.8692540503594643
Energy: 0.8493793242870123
Energy: 0.8534575006248437
Energy: 0.8516457086654117
Energy: 0.919394516068476
Energy: 0.851645708663471

minimum gb energy = 0.840942041172892 eV
minimum distance =  2.39563957325964 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.3651695617074235
Energy: 0.8788321250705848
Energy: 0.953365698886366
Energy: 0.9533295067727489
Energy: 0.8693388893829551
Energy: 0.9612283915608373
Energy: 0.8733853018610437
Energy: 0.9612283915637875
Energy: 0.9539359422739292
Energy: 0.9521107803481743
Energy: 1.240361101076443
Energy: 0.9521107803511246
Energy: 0.8767767561871634
Energy: 0.8729909153370553
Energy: 0.8727569657204874
Energy: 0.8729909153466437
Energy: 0.8713220967239884
Energy: 0.8723576849913561
Energy: 0.8738144908460603
Energy: 0.872357684989948
Energy: 0.8991818556314437
Energy: 0.901284740990438
Energy: 0.872107354397084
Energy: 0.9012847409933882
Energy: 0.9089793554753799
Energy: 0.8951867406571906
Energy: 1.0347404819780754
Energy: 0.8951867406601409
Energy: 0.9013940722116621
Energy: 0.902363343350462
Energy: 0.9362628057889907
Energy: 0.9023633433541499
Energy: 0.8997451032676083
Energy: 0.9005410903956494
Energy: 0.9489706347847382
Energy: 0.9005410903941743
Energy: 0.9346596942658427
Energy: 0.9033652658867461
Energy: 0.9008020871120203
Energy: 0.903365265880108
Energy: 0.8688418430238779
Energy: 0.8951979241504054
Energy: 0.9113323338863335
Energy: 0.8951979241555683
Energy: 0.8710981390772125
Energy: 0.9017623309558612
Energy: 0.8990863278839694
Energy: 0.9017623309639745
Energy: 0.8733238129004641
Energy: 0.87241657343079
Energy: 0.8700628684823283
Energy: 0.8724165734336732
Energy: 0.8724018507615403
Energy: 0.8727271710275588
Energy: 0.8937281986300565
Energy: 0.8727271710216583
Energy: 0.8739116313054507
Energy: 0.9506237139091006
Energy: 0.9503014229942076
Energy: 0.9506237139054129
Energy: 0.8710197057022506
Energy: 0.8724050045572899
Energy: 0.8729450702536988
Energy: 0.8724050045528644
Energy: 0.9553519526684598
Energy: 0.9510051012749972
Energy: 0.8728762012089759
Energy: 0.9510051012801599
Energy: 0.8767687717729068
Energy: 0.8729861414752846
Energy: 0.898496255551837
Energy: 0.8729861414819227
Energy: 0.8713525681518337
Energy: 0.8764097384578613
Energy: 0.878341407115958
Energy: 0.8764097384615491
Energy: 0.8994974666140604
Energy: 0.8721877027808074
Energy: 0.8722914493597974
Energy: 0.8721877027852327
Energy: 0.9059881137336213
Energy: 0.9000973551647445
Energy: 0.8997522060912762
Energy: 0.9000973551589111
Energy: 0.9032207294565473
Energy: 0.9058261167888121
Energy: 0.9381678910845055
Energy: 0.9058261167910246
Energy: 0.8999915982657667
Energy: 0.9014677744654142
Energy: 0.9437456613930228
Energy: 0.9014677744646766
Energy: 0.9347818987378806
Energy: 0.9010240852933656
Energy: 0.8998537345096892
Energy: 0.9010240852941033
Energy: 0.868838372642276
Energy: 0.8951921160455312
Energy: 0.9113082060315225
Energy: 0.8951921160381555
Energy: 0.8684431378471015
Energy: 0.8978805291823105
Energy: 0.9007914018417839
Energy: 0.8978805291859984
Energy: 0.8723722175371483
Energy: 0.8721954111188465
Energy: 0.8683955253479507
Energy: 0.8721954111225343
Energy: 0.8725514598166919
Energy: 0.8721327637078333
Energy: 0.8741890054455453
Energy: 0.8721327637100461
Energy: 0.8734737127285109
Energy: 0.8764366670707376
Energy: 0.9505022014400673
Energy: 0.8764366670677874

minimum gb energy = 0.8683955253479507 eV
minimum distance =  2.38948972420536 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.296886606274971
Energy: 0.8959487690836225
Energy: 0.9872197764367323
Energy: 0.9867221607355688
Energy: 0.9006027826807411
Energy: 0.9849406272296154
Energy: 0.8952817533984438
Energy: 0.9849406272304728
Energy: 0.9881173260937735
Energy: 0.9856742944219034
Energy: 1.164453230108595
Energy: 0.9856742944219034
Energy: 0.9019060184449881
Energy: 0.8960474152338369
Energy: 0.8951182860906972
Energy: 0.8960474151884337
Energy: 0.8939908366976402
Energy: 0.895359100233855
Energy: 0.8988333414274793
Energy: 0.8953591002347124
Energy: 0.9372788437494121
Energy: 0.9793376791896453
Energy: 0.8961244706768731
Energy: 0.9793376791887879
Energy: 0.9394890171683297
Energy: 0.9418033393651766
Energy: 0.9665914134781048
Energy: 0.9418033393643191
Energy: 0.941946023765891
Energy: 0.9460736244434391
Energy: 0.9129152569583783
Energy: 0.9460736244425816
Energy: 0.9677029713026951
Energy: 0.9409379150389434
Energy: 0.9024750046195466
Energy: 0.9409379150398007
Energy: 0.9377468728209793
Energy: 0.942223775321278
Energy: 0.8966369473068848
Energy: 0.9422237753221353
Energy: 0.890302702224208
Energy: 0.8957465413707904
Energy: 0.895742276278122
Energy: 0.8957465413716478
Energy: 0.8892097380283205
Energy: 0.8962955093373448
Energy: 0.8947604189825483
Energy: 0.8962955093364873
Energy: 0.9832773662649232
Energy: 0.9826577619309383
Energy: 0.8883101180503764
Energy: 0.9826577619300809
Energy: 0.8946445615844226
Energy: 0.895683057576449
Energy: 0.900981976141784
Energy: 0.8956830575773064
Energy: 0.893454889664575
Energy: 0.9837652896196469
Energy: 0.9892089328062675
Energy: 0.9837652896196469
Energy: 0.9335807140101314
Energy: 0.8976843950594734
Energy: 0.901027516903035
Energy: 0.897684395058616
Energy: 0.8952132213179889
Energy: 0.9019934627345004
Energy: 0.8939081023064015
Energy: 0.9019934627336431
Energy: 0.8964247299691908
Energy: 0.8955797505460701
Energy: 0.9371053844822997
Energy: 0.8955797505452127
Energy: 0.9666273872241717
Energy: 0.9440762273826595
Energy: 0.9371514270417421
Energy: 0.9440762273835169
Energy: 0.9132080941820829
Energy: 0.9443246804724824
Energy: 0.9353502748836289
Energy: 0.9443246804724824
Energy: 0.9040976534521538
Energy: 0.9402932858602252
Energy: 0.9685508432455628
Energy: 0.9402932858593678
Energy: 0.8998270322999776
Energy: 0.9408959193503386
Energy: 0.9377896838815413
Energy: 0.9408959193494811
Energy: 0.8945799720799218
Energy: 0.8963987092387063
Energy: 0.8897288124317598
Energy: 0.896398709237849
Energy: 0.8958463873360893
Energy: 0.8959639564543596
Energy: 0.8889105861696127
Energy: 0.8959639564535021
Energy: 0.888164925753954
Energy: 0.9022252408249902
Energy: 0.9823833699747764
Energy: 0.9022252408249902

minimum gb energy = 0.888164925753954 eV
minimum distance =  2.39234443354433 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.1954000116261254
Energy: 0.9015440884907905
Energy: 1.0177256812100701
Energy: 1.0166020827337918
Energy: 0.9620505605065263
Energy: 0.9983264207690851
Energy: 0.921685401966843
Energy: 0.9983264207660165
Energy: 1.0179664680597051
Energy: 1.0149522766182388
Energy: 1.0153415744767513
Energy: 1.0149522766182388
Energy: 0.9302001939851274
Energy: 0.922483506121697
Energy: 0.9219845972812712
Energy: 0.9224835061237426
Energy: 0.9193730301138014
Energy: 0.9231952225045421
Energy: 0.9271453446525528
Energy: 0.9231952225004507
Energy: 0.9313898377451998
Energy: 1.0126519546693502
Energy: 0.9237717464542976
Energy: 1.0126519546703732
Energy: 0.9523097750902093
Energy: 0.9921058767494422
Energy: 0.9236797168597124
Energy: 0.9921058767494422
Energy: 0.9233279463525413
Energy: 0.992708137299981
Energy: 0.9221291866493742
Energy: 0.992708137299981
Energy: 0.9224661168250091
Energy: 0.9234479141973589
Energy: 0.8938139832564588
Energy: 0.9234479141942905
Energy: 0.9234777618949234
Energy: 0.9238723928362208
Energy: 0.891207470028223
Energy: 0.9238723928372438
Energy: 0.8913057937231554
Energy: 1.0115461560855337
Energy: 1.01264339583154
Energy: 1.011546156084511
Energy: 0.9599927481591314
Energy: 0.9246044334029716
Energy: 0.9224454988318174
Energy: 0.9246044334070165
Energy: 1.0204229673154144
Energy: 1.011875087748048
Energy: 1.0145734526930892
Energy: 1.0118750877429339
Energy: 0.9315635613681147
Energy: 0.9222288126265472
Energy: 0.9260167099229181
Energy: 0.9222288126245016
Energy: 0.9189422958694223
Energy: 0.9311564563653777
Energy: 0.9227081923317716
Energy: 0.9311564563643548
Energy: 0.930479853539438
Energy: 0.9239305108480975
Energy: 0.9233133925439385
Energy: 0.9239305108460518
Energy: 0.9592685185625787
Energy: 0.9923922265887262
Energy: 0.9226236740930149
Energy: 0.992392226589749
Energy: 0.961489921123314
Energy: 0.9933382596843805
Energy: 0.9224732166332875
Energy: 0.9933382596854033
Energy: 0.9213306590159648
Energy: 0.9236334675403415
Energy: 0.8916192429232056
Energy: 0.923633467537273
Energy: 0.9237026162364136
Energy: 0.9246916195187318
Energy: 0.8915792901835335
Energy: 0.9246916195187318
Energy: 0.8900682406812522
Energy: 0.9324224848983227
Energy: 1.0109530847435848
Energy: 0.9324224848973

minimum gb energy = 0.8900682406812522 eV
minimum distance =  2.39279909065702 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.0590380064579727
Energy: 0.898495024107001
Energy: 1.044294002113832
Energy: 1.0417146993641344
Energy: 0.8880317099153449
Energy: 0.9691404434814861
Energy: 0.9186592752037096
Energy: 0.9691404434802212
Energy: 1.0421810909330593
Energy: 1.040271159486344
Energy: 1.0380005682008544
Energy: 1.0402711594876093
Energy: 0.8928829551797023
Energy: 0.9695446554305486
Energy: 0.919782982777551
Energy: 0.9695446554318133
Energy: 0.9715622105769328
Energy: 0.979921771322036
Energy: 0.9182325169710106
Energy: 0.979921771322036
Energy: 0.8917927219374235
Energy: 0.9798559612121125
Energy: 0.9185809423674776
Energy: 0.9798559612108476
Energy: 0.8864601893264037
Energy: 0.9825304561061379
Energy: 0.9733473476814296
Energy: 0.9825304561061379
Energy: 0.8855372977175782
Energy: 0.9808486261203361
Energy: 0.9230622537604387
Energy: 0.9808486261203361
Energy: 1.0393919742498332
Energy: 1.0374735639646595
Energy: 1.1812409546031837
Energy: 1.0374735639646595
Energy: 0.9218232391320091
Energy: 0.9810488210931405
Energy: 0.8862877416350337
Energy: 0.9810488210918756
Energy: 1.0338400562042673
Energy: 1.0384896776950745
Energy: 1.0468303967968842
Energy: 1.0384896776950745
Energy: 0.8893910733957527
Energy: 0.9721911664937227
Energy: 0.892338608009366
Energy: 0.9721911664937227
Energy: 0.9199223040910679
Energy: 0.9921740579136605
Energy: 0.9715025112809637
Energy: 0.9921740579136605
Energy: 0.9205518353974808
Energy: 0.9796485510119544
Energy: 0.8941831424048937
Energy: 0.9796485510119544
Energy: 0.9750503601829913
Energy: 0.9828106386258922
Energy: 0.8858105568406144
Energy: 0.9828106386258922
Energy: 0.9197704860715886
Energy: 0.982928651302417
Energy: 0.8860730028840157
Energy: 0.982928651301152
Energy: 0.8848795259719565
Energy: 0.8922102727483454
Energy: 1.0356663656565286
Energy: 0.8922102727483454

minimum gb energy = 0.8848795259719565 eV
minimum distance =  2.48394566605499 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.4991538634485957
Energy: 1.0471163060392525
Energy: 1.1436105829158132
Energy: 1.1409476211094747
Energy: 0.9138713959800046
Energy: 0.9720091901986002
Energy: 0.9749852110127449
Energy: 0.9720091901993165
Energy: 0.9850979368422133
Energy: 0.9758445819582332
Energy: 1.146814245351398
Energy: 0.9758445819575168
Energy: 0.9782160933836686
Energy: 1.0189459845265763
Energy: 0.973261164435032
Energy: 1.0189459845251436
Energy: 0.9760243677622473
Energy: 1.0574340028575993
Energy: 1.0104479244103455
Energy: 1.057434002856883
Energy: 0.9759725014784394
Energy: 1.0600012047609293
Energy: 0.9767769299936487
Energy: 1.060001204760213
Energy: 1.0321393086193404
Energy: 0.9755555765149149
Energy: 0.9760031463267763
Energy: 0.9755555765149149
Energy: 1.0308526308428214
Energy: 0.976932662829728
Energy: 0.9661241446963528
Energy: 0.9769326628282952
Energy: 1.1481950824875393
Energy: 1.137065104341004
Energy: 1.1455113570139186
Energy: 1.1370651043417204
Energy: 1.1358566426218684
Energy: 1.041513473420857
Energy: 0.9751516166110481
Energy: 1.0415134734237224
Energy: 1.0457401483371114
Energy: 0.9655629863663573
Energy: 0.9373400501530774
Energy: 0.9655629863634918
Energy: 1.0341600775160928
Energy: 0.9647765216345257
Energy: 0.9647522893198252
Energy: 0.9647765216366748
Energy: 1.033905430980263
Energy: 0.9647744555712153
Energy: 0.9650773660694951
Energy: 0.9647744555697827
Energy: 1.0338849323242096
Energy: 0.9651466465679361
Energy: 0.9376740697956426
Energy: 0.9651466465672198
Energy: 1.1362327487814257
Energy: 1.0750556749828484
Energy: 1.029177644058645
Energy: 1.075055674982132
Energy: 1.151003969014769
Energy: 1.0352410848917326
Energy: 1.0288937280703667
Energy: 1.035241084892449
Energy: 1.0332715011966545
Energy: 0.9737099358419381
Energy: 0.9745065000720539
Energy: 0.9737099358426544
Energy: 1.0368242963373624
Energy: 0.973771564722717
Energy: 0.9732217384352886
Energy: 0.9737715647241497
Energy: 0.9738520160406379
Energy: 1.0580911062030907
Energy: 0.9766327082761088
Energy: 1.0580911062009415
Energy: 1.0110404601173053
Energy: 1.0599409599582916
Energy: 0.9759334201693871
Energy: 1.0599409599590077
Energy: 0.9795716565799351
Energy: 0.9677940125391729
Energy: 1.0327060715318341
Energy: 0.9677940125406057
Energy: 0.9744854491577534
Energy: 0.9769041848961876
Energy: 1.0330133341593555
Energy: 0.9769041848976204
Energy: 0.9735511059516446
Energy: 1.0201606271104724
Energy: 1.0765851466975833
Energy: 1.020160627109756
Energy: 1.1432492660298745
Energy: 1.1352807203862068
Energy: 1.1402209127994243
Energy: 1.1352807203840574
Energy: 0.9658134526930838
Energy: 0.9647646482630671
Energy: 1.0380151962062454
Energy: 0.9647646482637834
Energy: 0.9644486065461539
Energy: 0.964280757018595
Energy: 0.9764683818878764
Energy: 0.9642807570178785
Energy: 0.9364831864235945
Energy: 0.9670717462799743
Energy: 1.0324469225951087
Energy: 0.9670717462806907
Energy: 0.9657141032970777
Energy: 0.9643341350652495
Energy: 1.0336654395703873
Energy: 0.9643341350652495
Energy: 0.9651245329969136
Energy: 0.9660441330839653
Energy: 1.0367529975530443
Energy: 0.9660441330803835
Energy: 1.2347583174406225
Energy: 1.1366754260757665
Energy: 1.1409350374309806
Energy: 1.1366754260793486

minimum gb energy = 0.9138713959800046 eV
minimum distance =  2.48910486768491 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.3601911010016845
Energy: 0.8640296731610114
Energy: 1.0408200683507405
Energy: 1.0366692460644948
Energy: 1.1982883228933345
Energy: 0.9163154002247137
Energy: 1.0287104730836816
Energy: 0.9163154002230643
Energy: 1.0383538242628658
Energy: 1.0287875118646985
Energy: 1.0356794291342075
Energy: 1.0287875118613998
Energy: 1.0275888493478023
Energy: 0.9166913975607937
Energy: 1.0364265521738814
Energy: 0.9166913975624431
Energy: 1.0343349262683474
Energy: 0.9162931127411479
Energy: 0.8420467904450484
Energy: 0.9162931127378494
Energy: 1.0336018732092456
Energy: 0.9178873413212532
Energy: 0.842438801855759
Energy: 0.9178873413229023
Energy: 1.1993942766972185
Energy: 1.024755066241135
Energy: 1.0285925376046947
Energy: 1.024755066241135
Energy: 1.197798548426106
Energy: 0.9181066385309767
Energy: 1.0240759854998438
Energy: 0.9181066385326261
Energy: 1.0252434255479521
Energy: 1.0264794549319542
Energy: 1.044503938249601
Energy: 1.0264794549352525
Energy: 1.0247548378897409
Energy: 0.9161546315712039
Energy: 1.0259426781314416
Energy: 0.9161546315745024
Energy: 1.031914600113291
Energy: 0.9163452884698774
Energy: 0.8619082055690912
Energy: 0.9163452884698774
Energy: 1.027704222294528
Energy: 0.9167484013076896
Energy: 0.8469817318371871
Energy: 0.9167484013109881
Energy: 1.1977654135522575
Energy: 0.9187174410527764
Energy: 1.0226668105364571
Energy: 0.9187174410511271

minimum gb energy = 0.8420467904450484 eV
minimum distance =  2.47026422258125 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.4505782565816245
Energy: 1.1319483413002742
Energy: 1.1975305237892881
Energy: 1.1932919902387822
Energy: 1.0534369899190794
Energy: 0.9615151947189753
Energy: 1.1824839380871892
Energy: 0.9615151947165337
Energy: 0.9594406177268238
Energy: 0.9616001869000647
Energy: 1.2006906460964084
Energy: 0.961600186897623
Energy: 0.9675042208380504
Energy: 0.9617564165245391
Energy: 1.2614195453650678
Energy: 0.9617564165227077
Energy: 0.963543074594532
Energy: 0.9602330301435209
Energy: 1.2636049628318888
Energy: 0.9602330301374723
Energy: 0.960692081600438
Energy: 0.9609307148373857
Energy: 1.2584937458708914
Energy: 0.9609307148373857
Energy: 1.2692972282430686
Energy: 1.1632535923108007
Energy: 1.1846230166854077
Energy: 1.163253592316905
Energy: 1.2446944914701357
Energy: 1.0619397915680069
Energy: 1.1648950977594008
Energy: 1.0619397915612925
Energy: 1.0255896602427448
Energy: 1.0557450486433966
Energy: 1.0829712847564854
Energy: 1.0557450486409548
Energy: 0.9987116144789445
Energy: 1.0578893371380158
Energy: 1.169464150413536
Energy: 1.0578893371422888
Energy: 1.0203851724819502
Energy: 1.0494945232784099
Energy: 1.1623807010276581
Energy: 1.0494945232820725
Energy: 1.0384565725971882
Energy: 1.021717366470105
Energy: 1.2546020818268118
Energy: 1.0217173664737673
Energy: 1.1686141923126867
Energy: 1.0521242643067368
Energy: 1.05841921506055
Energy: 1.0521242643171138
Energy: 1.2688679512716963
Energy: 1.036633923443551
Energy: 1.043244256766134
Energy: 1.0366339234527073
Energy: 1.1098301214993862
Energy: 1.1236028890966794
Energy: 1.0639714328772314
Energy: 1.1236028890905752
Energy: 1.1721914063032934
Energy: 1.1032193967156072
Energy: 1.081646097642004
Energy: 1.1032193967217114
Energy: 1.1150660847585063
Energy: 0.9518617295041755
Energy: 1.0830304076845774
Energy: 0.9518617295017339
Energy: 1.1076197949048248
Energy: 1.105292594362238
Energy: 1.335055915943196
Energy: 1.1052925943634588
Energy: 1.1189521809720553
Energy: 0.9514353191546753
Energy: 0.9573846984145411
Energy: 0.9514353191570614
Energy: 1.2859392057587475
Energy: 0.9963023081111849
Energy: 1.006415921341149
Energy: 0.9963023081087433
Energy: 1.2098662826165318
Energy: 0.953169823504428
Energy: 1.0003728040126914
Energy: 0.9531698234964927
Energy: 1.2601879853430062
Energy: 0.9840235636665906
Energy: 0.9828254209288484
Energy: 0.9840235636659801
Energy: 1.2630959336971879
Energy: 0.9836928843853017
Energy: 1.0022181732394733
Energy: 0.9836928843798081
Energy: 1.2188301219336664
Energy: 1.16698905600851
Energy: 1.2754726104426288
Energy: 1.1669890560079
Energy: 1.169938645975177
Energy: 1.0532785104312727
Energy: 1.2416476787695494
Energy: 1.0532785104312727
Energy: 1.0836423696117423
Energy: 1.050000063698814
Energy: 1.0199412549795728
Energy: 1.0500000636982034
Energy: 1.175627442311435
Energy: 0.9842549242798941
Energy: 0.9979496827900861
Energy: 0.9842549242756212
Energy: 1.1978455906210557
Energy: 1.0589938080470656
Energy: 1.0179829914141623
Energy: 1.0589938080397407
Energy: 1.2545406941654895
Energy: 1.0623349331848801
Energy: 1.0176969684384902
Energy: 1.0623349331793863
Energy: 1.0345473616515193
Energy: 1.0110376763768492
Energy: 1.2423552884709093
Energy: 1.011037676375018
Energy: 1.0245685083793803
Energy: 1.0149855513627075
Energy: 1.199532033728024
Energy: 1.014985551359045
Energy: 1.0143228831075959
Energy: 1.0706774700130466
Energy: 1.1674742764319619
Energy: 1.0706774700088295
Energy: 1.0499938666514141
Energy: 1.068430153228825
Energy: 1.1669487800588423
Energy: 1.068430153231877
Energy: 1.0159724749911565
Energy: 0.9612995869456463
Energy: 1.1184240008355564
Energy: 0.9612995869444254
Energy: 1.2585544185726354
Energy: 1.1621453492058653
Energy: 1.171220703596626
Energy: 1.162145349205255

minimum gb energy = 0.9514353191546753 eV
minimum distance =  2.47250553594571 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.44075551271053
Energy: 1.0461073624978001
Energy: 1.1063354199927053
Energy: 1.1541438754753752
Energy: 1.0227241953103903
Energy: 0.9853504158793273
Energy: 1.1076915482034104
Energy: 0.9853504158802957
Energy: 0.981164108441859
Energy: 0.9836167693804564
Energy: 1.1444195906732981
Energy: 0.9836167693804564
Energy: 0.9808642019747295
Energy: 0.983474135838638
Energy: 1.2322383897477247
Energy: 0.9834741358376696
Energy: 0.9884385877405192
Energy: 0.9850476772849039
Energy: 1.2188233791453484
Energy: 0.9850476772839355
Energy: 1.0466631883160868
Energy: 0.9847080172730432
Energy: 1.2368197057066028
Energy: 0.9847080172749801
Energy: 1.0969533150612194
Energy: 1.137690291029053
Energy: 1.1659991201988091
Energy: 1.1376902910300215
Energy: 1.0913966814749076
Energy: 1.087016629573328
Energy: 1.135685002066369
Energy: 1.0870166295723593
Energy: 1.050424799361425
Energy: 1.0307105008498898
Energy: 1.1379003730222417
Energy: 1.030710500847953
Energy: 1.0358232224765742
Energy: 0.9913564257167171
Energy: 1.1381829828496093
Energy: 0.991356425718654
Energy: 1.0323917486901115
Energy: 0.9525502329081348
Energy: 1.0858068299432675
Energy: 0.9525502329061979
Energy: 1.0192377122800735
Energy: 0.9537142734368025
Energy: 1.2029106097383793
Energy: 0.9537142734368025
Energy: 1.1443741875348166
Energy: 1.0310395387748612
Energy: 1.0130142534130044
Energy: 1.0310395387758298
Energy: 1.165527626511571
Energy: 0.9519454103265821
Energy: 1.0303978324005687
Energy: 0.9519454103246451
Energy: 1.1588241785298958
Energy: 1.0681921555273035
Energy: 1.0122121202113752
Energy: 1.0681921555253666
Energy: 1.2192081426018855
Energy: 1.0161740048237036
Energy: 1.0115578761124309
Energy: 1.0161740048256407
Energy: 1.2275170419969483
Energy: 1.0755307917183963
Energy: 1.024905782325731
Energy: 1.0755307917203332
Energy: 1.1396911840772588
Energy: 1.1400742915062456
Energy: 1.0974925882661248
Energy: 1.140074291507214
Energy: 1.110334318002407
Energy: 1.0592674070147827
Energy: 1.0977435459124307
Energy: 1.0592674070147827
Energy: 1.1360563062661766
Energy: 1.0655668436062846
Energy: 1.102965719053159
Energy: 1.0655668436053163
Energy: 1.1112710507111014
Energy: 1.0639673615164607
Energy: 1.0393948354901597
Energy: 1.0639673615174292
Energy: 1.2226307835352408
Energy: 1.1018990380272298
Energy: 1.105394439318525
Energy: 1.1018990380252929

minimum gb energy = 0.9519454103246451 eV
minimum distance =  2.46523789187671 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.7112455151386965
Energy: 1.0305176236528233
Energy: 1.1670177756967726
Energy: 1.1648765407614554
Energy: 1.0850573657536404
Energy: 0.9887189090819517
Energy: 1.2205282458766384
Energy: 0.9887189090737339
Energy: 0.9990025321450159
Energy: 1.0099032086816349
Energy: 1.1113927709700426
Energy: 1.0099032086761566
Energy: 0.993246255211807
Energy: 0.9903555565262635
Energy: 1.2086504965624194
Energy: 0.9903555565283179
Energy: 0.9907691846703386
Energy: 0.987673473827568
Energy: 1.2015271401281673
Energy: 0.9876734738234592
Energy: 1.0974468647850155
Energy: 0.9883811380517842
Energy: 1.1990091343649651
Energy: 0.9883811380538386
Energy: 1.1855803461153431
Energy: 0.9895873062065148
Energy: 0.9902409615195108
Energy: 0.9895873062119933
Energy: 1.2100527944841883
Energy: 0.9877315615341489
Energy: 0.987769787736143
Energy: 0.987731561533464
Energy: 1.2184581450167096
Energy: 0.9877266484499795
Energy: 0.988559461808218
Energy: 0.9877266484568276
Energy: 1.2198800821373885
Energy: 0.9916308852108028
Energy: 0.9901392393415162
Energy: 0.9916308852162814
Energy: 1.213759156619067
Energy: 1.0620366394740774
Energy: 1.078483796959138
Energy: 1.0620366394713383
Energy: 1.1009892035941862
Energy: 1.102291588471321
Energy: 1.1836778432164874
Energy: 1.1022915884754299
Energy: 1.1048454785967963
Energy: 1.0653055173344865
Energy: 1.1050851839288325
Energy: 1.065305517336541
Energy: 1.1087861985373058
Energy: 1.0650049798345398
Energy: 1.009980276641347
Energy: 1.0650049798468666
Energy: 1.1042623895744983
Energy: 1.0658955220087785
Energy: 1.0137313751049484
Energy: 1.0658955220060393
Energy: 1.1850942786238752
Energy: 1.101020920812587
Energy: 1.09889995400979
Energy: 1.1010209208214892
Energy: 1.2149383535117653
Energy: 1.0623112824145506
Energy: 1.2135948027701577
Energy: 1.0623112824063952
Energy: 0.990494241210553
Energy: 1.024098244481287
Energy: 1.1111544762204555
Energy: 1.02409824448882
Energy: 0.9854761588038431
Energy: 0.9883729672404957
Energy: 1.2131747982134113
Energy: 0.9883729672391262
Energy: 0.9892676818217446
Energy: 0.9878131514766674
Energy: 1.1783337531641123
Energy: 0.9878131514725587
Energy: 0.9899018349903902
Energy: 0.989340680160557
Energy: 1.2100396784695884
Energy: 0.9893406801626115
Energy: 1.184272474611342
Energy: 0.9878423873817275
Energy: 1.0967814576907495
Energy: 0.987842387379673
Energy: 1.187871988948315
Energy: 0.988114538376501
Energy: 0.9907769545980032
Energy: 0.9881145383812947
Energy: 1.2088186505737781
Energy: 0.9902848410159799
Energy: 0.9926037495455733
Energy: 0.9902848410200887
Energy: 1.2178645695625951
Energy: 0.9994719689360254
Energy: 1.021210921932787
Energy: 0.9994719689449278
Energy: 1.1910382772550174
Energy: 0.9885145931945746
Energy: 0.9937084296253303
Energy: 0.9885145931966292
Energy: 1.1675752767217968
Energy: 1.1647017226512646
Energy: 1.4655586021017541
Energy: 1.1647017226485255
Energy: 1.0981466577226624
Energy: 1.065507807063209
Energy: 1.0995457466473282
Energy: 1.0655078070830062
Energy: 1.1140296974461927
Energy: 1.0749649266548453
Energy: 1.1039567927347782
Energy: 1.074964926650114
Energy: 1.1000508460932719
Energy: 1.0655103601647387
Energy: 1.009865793306923
Energy: 1.0655103601544667
Energy: 1.178690876914349
Energy: 1.1001386288810515
Energy: 1.1040992645881826
Energy: 1.1001386288789972

minimum gb energy = 0.9854761588038431 eV
minimum distance =  2.45696784596799 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.9314733508636132
Energy: 0.9347303122907058
Energy: 1.0748899386182176
Energy: 1.1344928756065633
Energy: 0.9580633229250152
Energy: 1.0428422346617259
Energy: 0.9566356670843087
Energy: 1.0428422346640582
Energy: 0.9746704589079848
Energy: 1.0148768286644223
Energy: 0.9450701479595859
Energy: 1.0148768286667547
Energy: 0.9623458043392059
Energy: 0.9581717192521083
Energy: 0.9752480335233508
Energy: 0.9581717192544407
Energy: 0.9647514266904652
Energy: 0.9609178681101779
Energy: 0.9591663824892805
Energy: 0.9609178681101779
Energy: 0.973983064923154
Energy: 1.0351096718150852
Energy: 0.9626791162089415
Energy: 1.0351096718150852
Energy: 0.9464115635786807
Energy: 1.0155651760053908
Energy: 0.9747471765888148
Energy: 1.0155651760123876
Energy: 0.9565191307215362
Energy: 0.9580129569697504
Energy: 0.959062579404686
Energy: 0.9580129569697504
Energy: 0.9575233668612151
Energy: 0.9604665345929664
Energy: 0.9534293126245273
Energy: 0.9604665345929664

minimum gb energy = 0.9314733508636132 eV
minimum distance =  2.44612867671119 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.3728818273237615
Energy: 0.9202288896569204
Energy: 1.1157610911292635
Energy: 0.9548768398292355
Energy: 1.0826163085224425
Energy: 0.9593674315520853
Energy: 1.1122289149578577
Energy: 0.9593674315553197
Energy: 1.1120134901825982
Energy: 1.0419434533020862
Energy: 1.1063098016171948
Energy: 1.0419434533046739
Energy: 0.986452343575938
Energy: 0.953620765673659
Energy: 1.0938794058028234
Energy: 0.9536207656717183
Energy: 1.0826298311919367
Energy: 0.9526051355924086
Energy: 1.0985278037964696
Energy: 0.9526051355917617
Energy: 0.9555859738972731
Energy: 0.9561500542880141
Energy: 1.095643229258588
Energy: 0.956150054288661
Energy: 0.9540068243706262
Energy: 0.951868716237995
Energy: 1.0984669712121855
Energy: 0.9518687162386419
Energy: 0.9767301946536451
Energy: 0.9588204031929131
Energy: 1.1756804760049946
Energy: 0.9588204031922661
Energy: 1.0588215562459014
Energy: 0.9761986888553682
Energy: 1.2011918991470456
Energy: 0.9761986888579557
Energy: 1.1767955801402419
Energy: 0.9264695657025928
Energy: 0.9254991713319446
Energy: 0.9264695657038865
Energy: 1.0574188116646321
Energy: 0.9231141306501003
Energy: 0.9249330473739801
Energy: 0.9231141306513941
Energy: 1.200116266790418
Energy: 0.9225917538152236
Energy: 0.9215271461375569
Energy: 0.9225917538158703
Energy: 1.1728578874106512
Energy: 0.9232461189644983
Energy: 1.1601069028714308
Energy: 0.9232461189683796
Energy: 1.0748017175003592
Energy: 0.9743161994519789
Energy: 1.1009901896385912
Energy: 0.9743161994539196
Energy: 0.9549863596545302
Energy: 0.9528178855285391
Energy: 1.1009368155531212
Energy: 0.9528178855278921
Energy: 0.9716651413098527
Energy: 0.9569470110883528
Energy: 1.1286644737946354
Energy: 0.9569470110870589
Energy: 0.9515989550670942
Energy: 0.9509199277277948
Energy: 0.9813608924450524
Energy: 0.950919927726501
Energy: 1.1116541467142813
Energy: 0.9612847111769234
Energy: 1.0873946366929927
Energy: 0.9612847111782172
Energy: 1.108287777091498
Energy: 1.0441168038042035
Energy: 1.1116712250416254
Energy: 1.0441168038042035
Energy: 1.1126782523907726
Energy: 0.9527237673600775
Energy: 0.9815715493240487
Energy: 0.9527237673600775
Energy: 1.0949223616033767
Energy: 0.9735614602498335
Energy: 1.0925813239399103
Energy: 0.9735614602511272
Energy: 1.0984083303293004
Energy: 0.9526544503549771
Energy: 0.9532008107135593
Energy: 0.9526544503569176
Energy: 1.1283065941173036
Energy: 0.9531367091444654
Energy: 0.9527076090592388
Energy: 0.9531367091438184
Energy: 1.1753467923100656
Energy: 0.9575374283151721
Energy: 0.9721111613919223
Energy: 0.9575374283151721
Energy: 1.1762361871722762
Energy: 0.9747882850872557
Energy: 1.057568640163335
Energy: 0.9747882850866088
Energy: 0.9272943827567764
Energy: 0.924429000294003
Energy: 1.1770801582297143
Energy: 0.9244290002978843
Energy: 0.926746642061016
Energy: 0.9233835566490203
Energy: 1.0590102209484131
Energy: 0.9233835566471383
Energy: 0.9275567384149546
Energy: 0.9234538724984399
Energy: 1.02242236302677
Energy: 0.923453872497793
Energy: 0.9228907338126873
Energy: 0.9231315285204968
Energy: 1.1733383591365725
Energy: 0.9231315285211438
Energy: 1.0986872067822684
Energy: 0.9739486177008687
Energy: 1.0755444927976554
Energy: 0.9739486176976343
Energy: 1.0990775168580684
Energy: 0.9550502372400157
Energy: 0.9669572501883527
Energy: 0.9550502372393689
Energy: 1.127480946730102
Energy: 0.9557528924623497
Energy: 0.9602273749863754
Energy: 0.9557528924623497
Energy: 0.9844904023686618
Energy: 0.9511078580085208
Energy: 0.9525258594001549
Energy: 0.9511078580104615

minimum gb energy = 0.9202288896569204 eV
minimum distance =  2.41188962442929 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.6454223716239165
Energy: 0.8863944521888368
Energy: 1.1020984890786885
Energy: 0.9206424483993295
Energy: 1.0383155073674375
Energy: 0.9252152724244959
Energy: 1.1236295768450397
Energy: 0.9252152724236015
Energy: 1.062321423267439
Energy: 1.0315767898763208
Energy: 1.124327882171674
Energy: 1.0315767898754264
Energy: 1.0513991509905576
Energy: 1.0307164481956734
Energy: 1.1011663993138048
Energy: 1.0307164481974624
Energy: 1.0350158663766897
Energy: 0.9291941646930291
Energy: 1.04262126807351
Energy: 0.9291941646921346
Energy: 0.9298209355673319
Energy: 0.9299074478410312
Energy: 1.0438688585089824
Energy: 0.9299074478437144
Energy: 0.9300880861186082
Energy: 0.9288602432748141
Energy: 1.1020875015664904
Energy: 0.9288602432730253
Energy: 0.9508818666618365
Energy: 0.9334811478900095
Energy: 1.1811480125750204
Energy: 0.9334811478917984
Energy: 0.9567908684353916
Energy: 0.9720118105312722
Energy: 1.1610258838217153
Energy: 0.9720118105312722
Energy: 1.157371203376503
Energy: 0.867812761209578
Energy: 0.9603234022137251
Energy: 0.8678127612122613
Energy: 0.9339784484128082
Energy: 0.8676569107673799
Energy: 1.0194755967823486
Energy: 0.8676569107673799
Energy: 1.2229915202555575
Energy: 0.8645688118465704
Energy: 0.9555948966454426
Energy: 0.8645688118519368
Energy: 1.22257002704509
Energy: 0.8690726020692487
Energy: 0.9587870924753833
Energy: 0.8690726020701431
Energy: 1.0895889963492456
Energy: 0.8635342108916871
Energy: 1.1367845561339902
Energy: 0.8635342108970537
Energy: 1.050962279027718
Energy: 0.9724981713116393
Energy: 1.1371161529518943
Energy: 0.9724981713062727
Energy: 1.031050162553537
Energy: 0.9712642834389951
Energy: 1.102321027511336
Energy: 0.9712642834398896
Energy: 0.9823959129956049
Energy: 0.9290085780914189
Energy: 1.0413493198236605
Energy: 0.9290085780976799
Energy: 0.9397828690843639
Energy: 0.9408766443316331
Energy: 1.0360584252820997
Energy: 0.9408766443307387
Energy: 0.9316686148458425
Energy: 0.9299692894723366
Energy: 1.1614013302630344
Energy: 0.9299692894741254
Energy: 0.9417356163513888
Energy: 0.9398369162012308
Energy: 1.1815596022515584
Energy: 0.9398369162030197
Energy: 1.157379425801991
Energy: 0.9635770391462968
Energy: 1.1017034031418729
Energy: 0.9635770391480856
Energy: 1.1557201115489577
Energy: 0.9221243942760549
Energy: 0.9318510981378486
Energy: 0.9221243942796324
Energy: 1.1109342574715821
Energy: 0.9189037978519795
Energy: 0.9215724498719142
Energy: 0.9189037978564516
Energy: 1.1791586930789832
Energy: 0.9203148610630306
Energy: 0.9202629686692965
Energy: 0.9203148610612417

minimum gb energy = 0.8635342108916871 eV
minimum distance =  2.4033690837045 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.6013790086862314
Energy: 0.8798422272518689
Energy: 1.0969294341291203
Energy: 0.9071971283340535
Energy: 0.9320801039123453
Energy: 0.9057913437749434
Energy: 1.0335706958147437
Energy: 0.9057913437755464
Energy: 1.1160865212128295
Energy: 0.9023478404971949
Energy: 1.03013107225717
Energy: 0.9023478404994062
Energy: 1.1305333216624234
Energy: 0.9555874024005085
Energy: 1.0171530335960335
Energy: 0.9555874024027199
Energy: 0.9957916728057821
Energy: 0.8806482856242316
Energy: 1.1255380589153696
Energy: 0.8806482856248348
Energy: 0.8807149946610389
Energy: 0.8809990040488205
Energy: 1.1492225059100338
Energy: 0.8809990040483178
Energy: 0.8840629524856067
Energy: 0.8803861001536702
Energy: 0.9290725423365122
Energy: 0.8803861001525646
Energy: 0.8909836196570098
Energy: 0.8842576601505548
Energy: 1.1383617997399675
Energy: 0.8842576601516603
Energy: 1.1384217548844928
Energy: 0.8848791223934669
Energy: 1.1146641552638465
Energy: 0.8848791223906525
Energy: 1.060873816868858
Energy: 0.960504598795023
Energy: 1.041528359232433
Energy: 0.9605045987939174
Energy: 1.1330156099121145
Energy: 0.9034454468007879
Energy: 0.9227579062480598
Energy: 0.9034454467985766
Energy: 1.1444955934151546
Energy: 0.911847458413584
Energy: 1.0193987024142839
Energy: 0.9118474584152928
Energy: 1.1453804574335478
Energy: 0.9025867730267821
Energy: 0.9029365949843117
Energy: 0.9025867730283903
Energy: 1.0359877739546144
Energy: 0.903015382200154
Energy: 0.9069983348580367
Energy: 0.9030153821990484
Energy: 1.1248511230389753
Energy: 0.9045175375810601
Energy: 0.9119105390452529
Energy: 0.9045175375826683
Energy: 1.1393794976569431
Energy: 0.9264874145356018
Energy: 1.0401726308870007
Energy: 0.9264874145367075
Energy: 0.9023851295326132
Energy: 0.9110562489710954
Energy: 1.1279404794319143
Energy: 0.9110562489727037
Energy: 0.9042779386306976
Energy: 0.9018311881336802
Energy: 1.1377689648782299
Energy: 0.9018311881336802
Energy: 0.9384198729645965
Energy: 0.9110716719008736
Energy: 1.1110242360795353
Energy: 0.9110716719024818
Energy: 0.9047056436864913
Energy: 0.9023380940870743
Energy: 1.1381428128826667
Energy: 0.9023380940875769
Energy: 1.028689023686142
Energy: 0.9043898156551667
Energy: 0.9035987435667032
Energy: 0.9043898156518497
Energy: 1.029898620756396
Energy: 0.9021204639655007
Energy: 1.1191857768223772
Energy: 0.9021204639677122
Energy: 0.9283883199028252
Energy: 0.9532126182347533
Energy: 1.1240785432782354
Energy: 0.9532126182331451
Energy: 1.1714803164763412
Energy: 0.8821188854576703
Energy: 0.9956983578740126
Energy: 0.8821188854576703
Energy: 1.1255155824472949
Energy: 0.8802264995158893
Energy: 0.8791385521124565
Energy: 0.8802264995131753
Energy: 0.9312648470784595
Energy: 0.881671997954851
Energy: 0.888444710280305
Energy: 0.8816719979575647
Energy: 1.1390204898845562
Energy: 0.8816249055342844
Energy: 0.8814121609597287
Energy: 0.8816249055342844
Energy: 1.1105898238129537
Energy: 0.882619344863261
Energy: 1.1453749154692052
Energy: 0.8826193448627585
Energy: 1.0355035982756704
Energy: 0.9564095784963024
Energy: 1.057014306564752
Energy: 0.9564095784979106
Energy: 0.9246777672084486
Energy: 0.903130876711333
Energy: 1.1294413676792512
Energy: 0.9031308767141475
Energy: 1.017501316226802
Energy: 0.9025705263855621
Energy: 1.1457320885433733
Energy: 0.9025705263877735
Energy: 0.9018546778807026
Energy: 0.9031666685078964
Energy: 1.1464722137765866
Energy: 0.9031666685095046
Energy: 0.9035780283121513
Energy: 0.9023681320312584
Energy: 1.037467381310356
Energy: 0.9023681320329672
Energy: 0.9280309171973449
Energy: 0.9068674050993961
Energy: 1.1275530374520986
Energy: 0.9068674050999991
Energy: 1.0409642879005316
Energy: 0.924564715581746
Energy: 1.1383531484863048
Energy: 0.9245647155800373
Energy: 1.1407135471405596
Energy: 0.9132703629398471
Energy: 0.9284335316809991
Energy: 0.9132703629409528
Energy: 1.1333404212238878
Energy: 0.902119045815346
Energy: 0.9029878793407895
Energy: 0.9021190458159493
Energy: 1.1158770510113083
Energy: 0.911400456225249
Energy: 0.9057807968391357
Energy: 0.911400456225249

minimum gb energy = 0.8791385521124565 eV
minimum distance =  2.41471985327891 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.7091873795824166
Energy: 0.8694789249057189
Energy: 0.8185535855360639
Energy: 0.819616360482002
Energy: 0.8175396007452076
Energy: 0.9025753038134937
Energy: 0.8153904370942475
Energy: 0.9025753038134937
Energy: 0.8082885089894922
Energy: 0.9043237766342135
Energy: 0.8468155609134972
Energy: 0.90432377663566
Energy: 0.8117223102335145
Energy: 0.9094344146746872
Energy: 0.8181664651941919
Energy: 0.9094344146746872
Energy: 0.8176496584677297
Energy: 0.8167263042696358
Energy: 0.8400804307885308
Energy: 0.8167263042696358
Energy: 0.8175792243161852
Energy: 0.8163555834562247
Energy: 0.8396335419107998
Energy: 0.8163555834562247
Energy: 0.8170534342437058
Energy: 0.8168510362444766
Energy: 0.8188658306179769
Energy: 0.8168510362459231
Energy: 0.815623459486387
Energy: 0.820982745960509
Energy: 0.8081465170450921
Energy: 0.820982745960509
Energy: 0.820796503211193
Energy: 0.817745062769346
Energy: 0.8082221107707067
Energy: 0.817745062769346
Energy: 0.8464298931742625
Energy: 0.9131552991194246
Energy: 0.8205130057295918
Energy: 0.9131552991208712
Energy: 0.820401495220894
Energy: 0.8892306068462464
Energy: 0.808194476063408
Energy: 0.8892306068462464
Energy: 0.8390289340568012
Energy: 0.8157604920358109
Energy: 0.8200849061691466
Energy: 0.8157604920358109
Energy: 0.8392532822099339
Energy: 0.8193505319988739
Energy: 0.8395637655331503
Energy: 0.8193505319974274
Energy: 0.8180010007503077
Energy: 0.816440233022169
Energy: 0.8170970889572272
Energy: 0.8164402330236155
Energy: 0.8085370668544385
Energy: 0.8179939563028465
Energy: 0.8194689535851912
Energy: 0.8179939563028465

minimum gb energy = 0.8081465170450921 eV
minimum distance =  2.45255173627251 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.496401465344682
Energy: 0.7918414416818242
Energy: 1.031001789082509
Energy: 0.8030009947175126
Energy: 0.8682110538881865
Energy: 0.7989673035311393
Energy: 0.9427154051766995
Energy: 0.7989673035323519
Energy: 0.806576930156167
Energy: 0.7969418513491187
Energy: 0.9517493806346556
Energy: 0.7969418513466935
Energy: 1.0942027046461154
Energy: 0.8006927246628256
Energy: 0.9315474799462249
Energy: 0.8006927246731322
Energy: 1.073794276772045
Energy: 0.7985164846777245
Energy: 0.9629287546791497
Energy: 0.7985164846710556
Energy: 0.9329793384391265
Energy: 0.7983572872967378
Energy: 0.9255826046239942
Energy: 0.7983572873094695
Energy: 0.9326498282552693
Energy: 0.7975229337365105
Energy: 1.0666146090168367
Energy: 0.7975229337226214
Energy: 0.9327672043100954
Energy: 0.7974799750781926
Energy: 0.9583177200322806
Energy: 0.797479975079405
Energy: 0.7972618881256246
Energy: 0.801536808321407
Energy: 0.9368759035688855
Energy: 0.8015368083311073
Energy: 0.8036726231596348
Energy: 0.7974462039418108
Energy: 0.9365400806384657
Energy: 0.7974462039393858
Energy: 0.800063725557843
Energy: 0.8062658061310393
Energy: 1.497344049078719
Energy: 0.8062658061177014
Energy: 0.9264307834119107
Energy: 0.7964700348061939
Energy: 0.9353535453213262
Energy: 0.7964700348116504
Energy: 0.9285128793845917
Energy: 0.8406864886002903
Energy: 0.9259779597083474
Energy: 0.840686488593015
Energy: 1.0696120420139885
Energy: 0.8376968663918265
Energy: 1.0953092978868224
Energy: 0.8376968663924328
Energy: 0.9601015737401777
Energy: 0.799818589018521
Energy: 1.0676102535641325
Energy: 0.7998185890245838
Energy: 0.9597880410948941
Energy: 0.7979923169925137
Energy: 0.8034133695406563
Energy: 0.7979923169943325
Energy: 1.066413577618688
Energy: 0.7984660464705854
Energy: 0.7994526021490639
Energy: 0.7984660464699792
Energy: 0.8360445623976771
Energy: 0.7973541946812882
Energy: 0.801022087827148
Energy: 0.7973541946679502
Energy: 1.040828943071849
Energy: 0.8011952254467928
Energy: 0.92501035016753
Energy: 0.8011952254534618
Energy: 0.9349594243728412
Energy: 0.7964199058069631
Energy: 0.9516733605963578
Energy: 0.7964199058118133
Energy: 1.1211028567368062
Energy: 0.7972565561159891
Energy: 0.9268121085792556
Energy: 0.7972565561165954
Energy: 0.9358002876800867
Energy: 0.7967133738353122
Energy: 0.9263533456743916
Energy: 0.7967133738207615
Energy: 0.9390017903110949
Energy: 0.7997603751751153
Energy: 0.9650845061500392
Energy: 0.7997603751708715
Energy: 0.8067905025290799
Energy: 0.7967914795409886
Energy: 1.0696675210217206
Energy: 0.7967914795337133
Energy: 0.9292430941121853
Energy: 0.79816366099555
Energy: 0.9587481682519426
Energy: 0.7981636609949436
Energy: 0.7983074205668823
Energy: 0.7969079891782643
Energy: 0.9570532196720625
Energy: 0.7969079891764456
Energy: 0.7984154001798804
Energy: 0.7970715015751839
Energy: 1.073740758158616
Energy: 0.7970715015679086
Energy: 0.8145479975727474
Energy: 0.8029919523249728
Energy: 0.8353455907994277
Energy: 0.8029919523382556
Energy: 0.9254737489901925
Energy: 0.7975357241763861
Energy: 1.0414291408756926
Energy: 0.7975357241800238
Energy: 0.9621433130547657
Energy: 0.8372567585665431
Energy: 0.925273113351257
Energy: 0.8372567585653307
Energy: 1.0668747280055608
Energy: 0.8392068233722291
Energy: 1.121396285622245
Energy: 0.8392068233734417
Energy: 0.9589317386713659
Energy: 0.7980077754372739
Energy: 0.9250863292514294
Energy: 0.7980077754348488
Energy: 0.9607733361279444
Energy: 0.7999841530581754
Energy: 0.8185566395223166
Energy: 0.7999841530624192
Energy: 1.0699008681418927
Energy: 0.7974057320102326
Energy: 0.7984276645211753
Energy: 0.7974057320120514
Energy: 1.040647138200802
Energy: 0.7975228875457326
Energy: 0.8048970163625864
Energy: 0.7975228875439138

minimum gb energy = 0.7918414416818242 eV
minimum distance =  2.44408859199232 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.2819728252960005
Energy: 0.7367138780315067
Energy: 0.7319299303883363
Energy: 0.7337412116593742
Energy: 0.9647359925041485
Energy: 0.7330601215965928
Energy: 0.9533727694637124
Energy: 0.733060121597636
Energy: 1.168417612321436
Energy: 0.7334343762424749
Energy: 0.9605608813462605
Energy: 0.7334343762424749
Energy: 1.1680458158237668
Energy: 0.8186585252844607
Energy: 0.9532093007802166
Energy: 0.8186585252844607
Energy: 1.185323034543696
Energy: 0.8200144550920703
Energy: 0.956539638185083
Energy: 0.8200144550910272
Energy: 0.8802048636826231
Energy: 0.7322753410657665
Energy: 0.7385481949261528
Energy: 0.7322753410668097
Energy: 0.7271436798777609
Energy: 0.7327301498317528
Energy: 1.1886720258420185
Energy: 0.7327301498317528
Energy: 0.7479572058132338
Energy: 0.7326094330778811
Energy: 0.9467293549549628
Energy: 0.7326094330789241
Energy: 0.7323446974641634
Energy: 0.7348726512064838
Energy: 0.9472235697672798
Energy: 0.7348726512064838
Energy: 0.7318287714702448
Energy: 0.7348663491157291
Energy: 0.8595135536008316
Energy: 0.7348663491146861
Energy: 0.7319299303664317
Energy: 0.7337412117344277
Energy: 1.2819728252960005
Energy: 0.7367138780294205
Energy: 0.9533727694637124
Energy: 0.733060121597636
Energy: 0.8599172083508282
Energy: 0.7330601215986791
Energy: 0.9605608813462605
Energy: 0.7334343762424749
Energy: 1.168417612321436
Energy: 0.733434376243518
Energy: 0.9532093007802166
Energy: 0.8186585252844607
Energy: 1.1680458158227236
Energy: 0.8186585252855039
Energy: 0.9565396381829968
Energy: 0.8200144550920703
Energy: 1.185323034544739
Energy: 0.8200144550931134
Energy: 0.8567180311119826
Energy: 0.7322753410542927
Energy: 0.7275695470391652
Energy: 0.7322753410532497
Energy: 1.1886720258409755
Energy: 0.7327301498327958
Energy: 0.7271436798767178
Energy: 0.7327301498307097
Energy: 0.9467293549549628
Energy: 0.7326094330778811
Energy: 0.7479572058132338
Energy: 0.7326094330903979
Energy: 0.9472235664955442
Energy: 0.7348726512064838
Energy: 0.7323446974652065
Energy: 0.7348726512075269
Energy: 0.9647360512217674
Energy: 0.7348663491146861
Energy: 0.7318287714723309
Energy: 0.7348663491136429

minimum gb energy = 0.7271436798767178 eV
minimum distance =  2.46380453512646 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.5770938865207451
Energy: 0.6845063420535787
Energy: 0.9412302075047096
Energy: 0.673000582643738
Energy: 1.0477411936136134
Energy: 0.671920641236485
Energy: 0.856333760987035
Energy: 0.671920641238114
Energy: 1.3582790591445744
Energy: 0.6716294625109996
Energy: 0.8612249670999279
Energy: 0.6716294625109996
Energy: 1.0727255098124182
Energy: 0.6731295447427829
Energy: 1.061034043403788
Energy: 0.6731295447435973
Energy: 1.0617582044573344
Energy: 0.7424699043397275
Energy: 1.2000029149682006
Energy: 0.742469904340542
Energy: 1.0372554338915425
Energy: 0.7398155211254462
Energy: 1.2025759835384298
Energy: 0.7398155211270753
Energy: 1.0430381238560278
Energy: 0.7416394987425807
Energy: 1.0625019780044125
Energy: 0.7416394987417663
Energy: 1.0611898934855657
Energy: 0.6729479080644407
Energy: 1.1966733805303507
Energy: 0.6729479080652552
Energy: 0.8605948006693095
Energy: 0.6719037559135489
Energy: 1.2000401838577988
Energy: 0.6719037559127343
Energy: 0.8628688319603889
Energy: 0.6718295692641345
Energy: 1.2009762906640793
Energy: 0.671829569266578
Energy: 0.6738015202768292
Energy: 0.6763073429082628
Energy: 1.3263388821516007
Energy: 0.6763073429082628
Energy: 0.6793453353592459
Energy: 0.6731827773135087
Energy: 1.2016059615535384
Energy: 0.6731827773135087
Energy: 0.6759831314402588
Energy: 0.6721568872953262
Energy: 1.0430702635875913
Energy: 0.6721568872945117
Energy: 0.8560717739047152
Energy: 0.6768867763735024
Energy: 1.349711707415581
Energy: 0.6768867763726879
Energy: 0.8608227928255425
Energy: 0.671620138406281
Energy: 1.0646991095658098
Energy: 0.6716201384054665
Energy: 0.8640200070731529
Energy: 0.6722959115930369
Energy: 1.3511477485687369
Energy: 0.672295911594666
Energy: 1.0646674630999091
Energy: 0.6721893402755202
Energy: 1.3512831795556115
Energy: 0.6721893402763347
Energy: 0.8586100639199951
Energy: 0.7446629472078833
Energy: 1.0624373204008417
Energy: 0.7446629472086977
Energy: 1.1993666328751367
Energy: 0.7405157697065314
Energy: 1.0410936524267687
Energy: 0.7405157697065314
Energy: 1.2009136298942888
Energy: 0.739889369388035
Energy: 1.0381311149426502
Energy: 0.739889369386406
Energy: 1.3280207507602202
Energy: 0.6725413335936611
Energy: 0.8557519504901775
Energy: 0.6725413335928466
Energy: 1.2013727580518057
Energy: 0.6711527028863584
Energy: 0.6728457148417714
Energy: 0.671152702885544
Energy: 1.1968515066991974
Energy: 0.6735265753064278
Energy: 0.8558119432928519
Energy: 0.6735265753072424
Energy: 1.195957330949571
Energy: 0.6727192568575634
Energy: 0.6737125022184428
Energy: 0.6727192568551199
Energy: 1.0645807540297239
Energy: 0.6722238737489126
Energy: 0.6729502654614532
Energy: 0.672223873749727
Energy: 1.3492166417190352
Energy: 0.6739046253227824
Energy: 0.6812059803685588
Energy: 0.6739046253227824

minimum gb energy = 0.671152702885544 eV
minimum distance =  2.46841118315837 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.77020399005086
Energy: 0.6428089788302369
Energy: 0.9087421745045797
Energy: 0.6257344538981418
Energy: 1.2124916293743437
Energy: 0.6249756475013717
Energy: 0.7795431966579611
Energy: 0.624975647503375
Energy: 1.2094795748187193
Energy: 0.6236527646354976
Energy: 0.7837461293565926
Energy: 0.6236527646381685
Energy: 1.208123754971358
Energy: 0.6267801247855364
Energy: 0.9618337239308984
Energy: 0.6267801247868718
Energy: 1.2228279708525567
Energy: 0.6246150687618752
Energy: 1.07900403123736
Energy: 0.6246150687645463
Energy: 1.21354534201303
Energy: 0.7749081450648828
Energy: 1.075048431274651
Energy: 0.7749081450622117
Energy: 1.2193653903440642
Energy: 0.7774921245726742
Energy: 1.222987587596398
Energy: 0.777492124573342
Energy: 1.0756193684491215
Energy: 0.6810307019254662
Energy: 1.0803124395474477
Energy: 0.6810307019161177
Energy: 0.9353834169597125
Energy: 0.6238237881848637
Energy: 1.347115679170877
Energy: 0.6238237881868669
Energy: 0.9353069754315252
Energy: 0.6242959825008788
Energy: 1.2245095782583524
Energy: 0.6242959825048855
Energy: 0.7801447801350884
Energy: 0.6270921855395736
Energy: 1.2200718405501931
Energy: 0.6270921855389059
Energy: 0.7821192652950373
Energy: 0.6231536070711583
Energy: 1.2255449627939645
Energy: 0.6231536070765004
Energy: 0.7812257865411438
Energy: 0.6263112700855115
Energy: 1.3435042444781498
Energy: 0.6263112700841759
Energy: 0.6247209846289709
Energy: 0.6270694809703773
Energy: 1.219435862205917
Energy: 0.6270694809603609
Energy: 0.6247729514151739
Energy: 0.6243693625910601
Energy: 1.2221215200543694
Energy: 0.6243693625903924
Energy: 0.6343583772747351
Energy: 0.6259750127567295
Energy: 1.2085402888376193
Energy: 0.6259750127560617
Energy: 0.7791779892920325
Energy: 0.6281860536811973
Energy: 1.2081656293687288
Energy: 0.6281860536798618
Energy: 0.7867533289502283
Energy: 0.6242265966295941
Energy: 1.2216420156898586
Energy: 0.6242265966282586
Energy: 0.7835751854954681
Energy: 0.6250338310366479
Energy: 1.2168471424861675
Energy: 0.6250338310359801
Energy: 1.077495438025024
Energy: 0.6285931741172185
Energy: 1.2127903237616249
Energy: 0.6285931741218929
Energy: 1.0908892495106637
Energy: 0.6254183328178294
Energy: 1.2234274858702883
Energy: 0.6254183328184972
Energy: 1.0787281478385393
Energy: 0.6265530580645968
Energy: 1.222856817803645
Energy: 0.6265530580605904
Energy: 1.3474359036547787
Energy: 0.8849972241338215
Energy: 1.2105886331817455
Energy: 0.8849972241338215
Energy: 1.0821741920738386
Energy: 0.7755333609588828
Energy: 1.0802715078267773
Energy: 0.7755333609535406
Energy: 1.2255704557773033
Energy: 0.6247283961850663
Energy: 0.9471750891863561
Energy: 0.6247283961850663
Energy: 1.351568337616664
Energy: 0.6270474672399168
Energy: 1.076619780742778
Energy: 0.6270474672412522
Energy: 1.2186625643948368
Energy: 0.6252895228470977
Energy: 0.8009134624232512
Energy: 0.6252895228450944
Energy: 1.2221617642902702
Energy: 0.6237182252440414
Energy: 0.7849660652103634
Energy: 0.6237182252440414
Energy: 1.2202232926075762
Energy: 0.6275484128891068
Energy: 0.7927062745817369
Energy: 0.6275484128904424
Energy: 1.350805077677253
Energy: 0.6266762583491599
Energy: 0.6360879076473768
Energy: 0.626676258348492
Energy: 1.2219290133724734
Energy: 0.6244247759799296
Energy: 0.6239979260445284
Energy: 0.6244247759792618
Energy: 1.2086472729636355
Energy: 0.6256835357308207
Energy: 0.625677180375939
Energy: 0.625683535730153

minimum gb energy = 0.6231536070711583 eV
minimum distance =  2.46997571855388 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.5202883295125231
Energy: 0.6084722330492951
Energy: 0.8806188960623561
Energy: 0.5949071731415128
Energy: 1.3957870495740945
Energy: 0.5870670990292092
Energy: 0.7311088470755627
Energy: 0.5870670990280779
Energy: 1.349871369826618
Energy: 0.5899154963746519
Energy: 0.725611098486448
Energy: 0.5899154963718234
Energy: 1.3323858259194452
Energy: 0.5871440950232831
Energy: 0.991378621953066
Energy: 0.5871440950221519
Energy: 1.346483709971724
Energy: 0.5927810372098885
Energy: 0.9800092455987884
Energy: 0.5927810372081915
Energy: 1.3415732578703834
Energy: 0.5925124408745217
Energy: 0.9780031947778672
Energy: 0.5925124408739562
Energy: 1.1015707813883484
Energy: 0.5905621852207158
Energy: 1.2213170583047377
Energy: 0.5905621852156245
Energy: 1.228417214392488
Energy: 0.6389711644449839
Energy: 0.9817709717088713
Energy: 0.6389711644432869
Energy: 1.0988417766059047
Energy: 0.8366759903221006
Energy: 1.2171549179471306
Energy: 0.8366759903215348
Energy: 1.0972640021175357
Energy: 0.835203009047189
Energy: 1.4515851854735455
Energy: 0.8352030090466233
Energy: 0.9931975043634143
Energy: 0.5858277224293057
Energy: 1.2149545373665591
Energy: 0.5858277224310028
Energy: 0.8578562636878106
Energy: 0.592790731848508
Energy: 1.4514523771949372
Energy: 0.5927907318451139
Energy: 0.9786299778930448
Energy: 0.5938485540468577
Energy: 1.4556747786272657
Energy: 0.5938485540491204
Energy: 0.7349870023128253
Energy: 0.5869526853591981
Energy: 1.226730292376332
Energy: 0.5869526853614608
Energy: 0.7220572903527568
Energy: 0.5879249549942569
Energy: 1.3460232049181664
Energy: 0.5879249549959539
Energy: 0.7273977044837199
Energy: 0.5871258456666765
Energy: 1.346201482135719
Energy: 0.5871258456678078
Energy: 0.5994273225738034
Energy: 0.5888849984799247
Energy: 1.337924968479124
Energy: 0.5888849984793589
Energy: 0.5861627996978097
Energy: 0.5847143885264848
Energy: 1.3446104962829408
Energy: 0.5847143885270506
Energy: 0.6025762859041245
Energy: 0.5884010188077323
Energy: 1.343434294247204
Energy: 0.5884010188077323
Energy: 0.7295031308989333
Energy: 0.5874410837281693
Energy: 1.332806325555622
Energy: 0.5874410837276036
Energy: 0.7209212106505154
Energy: 0.5854386160275257
Energy: 1.3452572785522252
Energy: 0.5854386160280914
Energy: 0.7332692799208188
Energy: 0.5878450349364922
Energy: 1.3494457186790163
Energy: 0.5878450349364922
Energy: 0.979359654001881
Energy: 0.5946745121669373
Energy: 1.3382243414061195
Energy: 0.5946745121686344
Energy: 0.9802049406529728
Energy: 0.5850649062073526
Energy: 1.34580178667139
Energy: 0.5850649062090497
Energy: 0.9891478081842011
Energy: 0.5865077236699296
Energy: 1.1063079146131236
Energy: 0.5865077236710609
Energy: 1.2206796052421445
Energy: 0.8345114842786978
Energy: 1.3497080258340601
Energy: 0.8345114842786978
Energy: 0.9771530532599437
Energy: 0.8317175601734
Energy: 1.2179947313024981
Energy: 0.8317175601722686
Energy: 1.2266465329534204
Energy: 0.6385158375511355
Energy: 1.1113105057740882
Energy: 0.6385158375488729
Energy: 1.2229166808526555
Energy: 0.5886991922320487
Energy: 1.218278551446757
Energy: 0.5886991922309174
Energy: 1.2188769709678802
Energy: 0.5896590842736364
Energy: 0.9783148835472967
Energy: 0.5896590842775963
Energy: 1.3445546312654664
Energy: 0.592356540519735
Energy: 0.8577042470046174
Energy: 0.592356540519735
Energy: 1.225952887310686
Energy: 0.5873156159206008
Energy: 0.9903150033271808
Energy: 0.587315615923995
Energy: 1.3442398966937685
Energy: 0.5852619580130466
Energy: 0.7248116632230075
Energy: 0.5852619580153092
Energy: 1.3458530185581181
Energy: 0.5875065720813795
Energy: 0.7248481903566416
Energy: 0.587506572083642
Energy: 1.3436900413445356
Energy: 0.5894635970728587
Energy: 0.6129926668704616
Energy: 0.589463597066636
Energy: 1.3456926390910455
Energy: 0.5870638829539875
Energy: 0.5927475284538104
Energy: 0.5870638829551188
Energy: 1.3571137985286765
Energy: 0.587923515950663
Energy: 0.5901536664058533
Energy: 0.587923515950663

minimum gb energy = 0.5847143885264848 eV
minimum distance =  2.47468856688725 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.6376522066059107
Energy: 0.5693551394217965
Energy: 0.534717959870718
Energy: 0.5332944753428612
Energy: 1.4130170051970976
Energy: 0.5324033170475849
Energy: 0.6620795126371637
Energy: 0.5324033170461131
Energy: 1.4057797376266046
Energy: 0.5318073698189174
Energy: 0.6568684165410655
Energy: 0.5318073698184268
Energy: 1.1908885587986886
Energy: 0.532040801076563
Energy: 0.8755679340062092
Energy: 0.5320408010760724
Energy: 1.4127868642516128
Energy: 0.533495749285509
Energy: 0.8773379158190014
Energy: 0.533495749221238
Energy: 1.1937867951703183
Energy: 0.5309879675943934
Energy: 0.8786556888213868
Energy: 0.5309879675958653
Energy: 1.191521203812864
Energy: 0.5310003586829649
Energy: 1.089269725288128
Energy: 0.5310003586932678
Energy: 1.3013325492527128
Energy: 0.5310117335361143
Energy: 0.8764329927087031
Energy: 0.5310117335331705
Energy: 1.1935513692126185
Energy: 0.5337999989840285
Energy: 1.0905901578605237
Energy: 0.5337999989334946
Energy: 1.1989626073424446
Energy: 0.7756563915287485
Energy: 1.3003924471045554
Energy: 0.7756563915287485
Energy: 1.0891664444847526
Energy: 0.6145258895229395
Energy: 1.0866501070141157
Energy: 0.6145258895219583
Energy: 0.9862372451220056
Energy: 0.5311621997968
Energy: 1.3011334960328678
Energy: 0.5311621998051406
Energy: 1.0888980624750908
Energy: 0.5308949963411291
Energy: 1.2999214692146104
Energy: 0.5308949963641884
Energy: 0.876257567637009
Energy: 0.5314613847011549
Energy: 1.0857050429569373
Energy: 0.5314613847060612
Energy: 0.763205971331555
Energy: 0.5312291302275683
Energy: 1.411845638039497
Energy: 0.5312291302295307
Energy: 0.8761343569228425
Energy: 0.5335700241549985
Energy: 1.2973103222130478
Energy: 0.533570024154508
Energy: 0.65081341129896
Energy: 0.532188527028972
Energy: 1.297096713151347
Energy: 0.5321885270260283
Energy: 0.648417522894895
Energy: 0.5312862158834707
Energy: 1.4114147614512969
Energy: 0.5312862158824895
Energy: 0.6503204542635799
Energy: 0.5342712489625053
Energy: 1.406060305726117
Energy: 0.5342712489629959
Energy: 0.5314568726813587
Energy: 0.5350905998802253
Energy: 1.4067784226118385
Energy: 0.5350905998802253
Energy: 0.5335449877707998
Energy: 0.531552729571984
Energy: 1.4119357282612468
Energy: 0.5315527295734558
Energy: 0.5316062141866246
Energy: 0.5345124886402505
Energy: 1.4003228764479723
Energy: 0.534512488638288
Energy: 0.6505969172438136
Energy: 0.5326264307812143
Energy: 1.4073885348802753
Energy: 0.5326264307831767
Energy: 0.651441370817636
Energy: 0.5313711616207537
Energy: 1.413595201814815
Energy: 0.5313711616187912
Energy: 0.6508139273280668
Energy: 0.5336235112216664
Energy: 1.1908462156707222
Energy: 0.5336235112187228
Energy: 0.8765548948261603
Energy: 0.5338610271816824
Energy: 1.4041943431252137
Energy: 0.5338610271831541
Energy: 0.8759621433138837
Energy: 0.5310208337973297
Energy: 1.4052303719545784
Energy: 0.5310208337963485
Energy: 1.0138787051697615
Energy: 0.5314338961304342
Energy: 1.1915997465492703
Energy: 0.5314338961304342
Energy: 1.0890825030945563
Energy: 0.5310547257141447
Energy: 1.4127261603227312
Energy: 0.5310547257038416
Energy: 1.0898465998718259
Energy: 0.5322774540056657
Energy: 1.1936502278843841
Energy: 0.5322774540100813
Energy: 1.3054185685504036
Energy: 0.6148843717330175
Energy: 0.9825909731352468
Energy: 0.6148843717325269
Energy: 1.086776341433826
Energy: 0.614716961715557
Energy: 1.2109948261253038
Energy: 0.6147169617170287
Energy: 1.303049984616812
Energy: 0.5313319106451508
Energy: 0.979525754952808
Energy: 0.5313319106407354
Energy: 1.415081720168038
Energy: 0.5308810661459383
Energy: 0.9810800971246165
Energy: 0.5308810661429947
Energy: 1.086146447223483
Energy: 0.5334714094972672
Energy: 0.8768445783486369
Energy: 0.533471409497758
Energy: 1.4132754377500123
Energy: 0.53121192283965
Energy: 0.8765884268440307
Energy: 0.53121192283965
Energy: 1.4088692655073223
Energy: 0.5328059392110703
Energy: 0.877383996409626
Energy: 0.5328059392115609
Energy: 1.297112843654885
Energy: 0.533392661894072
Energy: 0.6509135556676346
Energy: 0.533392661894072
Energy: 1.4132304696807636
Energy: 0.5313894450946354
Energy: 0.6510475526327798
Energy: 0.5313894450941447
Energy: 1.4076252746339577
Energy: 0.533055612692162
Energy: 0.6502274415840981
Energy: 0.5330556126916713
Energy: 1.2967690603911446
Energy: 0.533692687179221
Energy: 0.5322556456298103
Energy: 0.533692687179221
Energy: 1.411811290615953
Energy: 0.5318418506047109
Energy: 0.5327727329101473
Energy: 0.5318418506047109
Energy: 1.4003971083116726
Energy: 0.5358731879155675
Energy: 0.5318641467738061
Energy: 0.5358731879160581

minimum gb energy = 0.5308810661429947 eV
minimum distance =  2.48717666618946 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.021411261765315666
Energy: 0.023129719852210247
Energy: 1.2339153208965947
Energy: 0.43722994441398183
Energy: 0.02298158907091016
Energy: 0.13087882638367537
Energy: 0.9211749930696392
Energy: 0.13087882638405252
Energy: 0.022897465764310242
Energy: 0.12965972047164107
Energy: 0.9209588629024745
Energy: 0.12965972047164107
Energy: 0.02484915684247256
Energy: 0.12930597387726564
Energy: 0.91813229867721
Energy: 0.1293059738765113
Energy: 0.9192142506515412
Energy: 0.12924625237107654
Energy: 0.9182729269072242
Energy: 0.12924625237220805
Energy: 0.02272527121532978
Energy: 0.12898050050586046
Energy: 0.9194918236515841
Energy: 0.12898050050510615

minimum gb energy = 0.021411261765315666 eV
minimum distance =  2.73837764924603 Angstroms
sigma value = 1