Model name: model_name=EAM_Dynamo_MendelevKramerHao_2012_NiZr__MO_149104665840_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.518121123313904
cohesive_energy=4.385853675361089
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.0 eV

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

Energy: 0.0179109836287908
Energy: 0.01850202172555329
Energy: 1.2907801853164091
Energy: 0.01850202172617874
Energy: 0.01850202172684097
Energy: 1.3362851195608338
Energy: 0.01850202172617874
Energy: 1.3362851195608338
Energy: 1.2907801853164091
Energy: 0.01850202172555329
Energy: 0.0179109836287908
Energy: 0.01850202172555329
Energy: 0.01850202172684097
Energy: 1.3362851195608338
Energy: 0.01850202172617874
Energy: 1.3362851195608338

minimum gb energy = 0.0179109836287908 eV
minimum distance =  2.43156951630748 Angstroms
sigma value = 1


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

Energy: 1.3482281113977825
Energy: 1.396054381286717
Energy: 1.1904896356654804
Energy: 1.3960543812851107
Energy: 1.2532367146807324
Energy: 1.3515255972302964
Energy: 1.256496522995265
Energy: 1.3515255972310996
Energy: 1.214967946129722
Energy: 1.3825871481722118
Energy: 1.2470659033839004
Energy: 1.3825871481714087
Energy: 1.2391712774815926
Energy: 1.403860703965707
Energy: 1.2291485040651935
Energy: 1.40386070396651
Energy: 1.2428437379356234
Energy: 1.3998357812040862
Energy: 1.2310862126450814
Energy: 1.3998357812024798
Energy: 1.1915291690521435
Energy: 1.3457265678258832
Energy: 1.1947186346389291
Energy: 1.3457265678258832
Energy: 1.257124374270946
Energy: 1.3801203421475128
Energy: 1.1930992986046436
Energy: 1.3801203421482429
Energy: 1.1182440756449754
Energy: 1.3973064316215968
Energy: 1.1861151718890992
Energy: 1.397306431620794
Energy: 1.2350340513881009
Energy: 1.2521355224986679
Energy: 1.2499153729980068
Energy: 1.2521355225002744
Energy: 1.1872445567327576
Energy: 1.383706411900695
Energy: 1.1131355471126505
Energy: 1.3837064118998919
Energy: 1.2482109946248392
Energy: 1.351051643687624
Energy: 1.2351335925634483
Energy: 1.3510516436852877
Energy: 1.205663971056147
Energy: 1.3971422512400742
Energy: 1.1986019762921911
Energy: 1.3971422512424836
Energy: 1.2551512591850196
Energy: 1.3813974424663806
Energy: 1.257142796028202
Energy: 1.381397442467987
Energy: 1.248065810283156
Energy: 1.3830805193017324
Energy: 1.2187394016065045
Energy: 1.3830805193017324
Energy: 1.2425114809778723
Energy: 1.3971195675883354
Energy: 1.2471610428922273
Energy: 1.397119567589942
Energy: 1.2404545659728652
Energy: 1.3995788112462637
Energy: 1.2492582134745982
Energy: 1.3995788112470668
Energy: 1.2473823263460326
Energy: 1.3837825779996467
Energy: 1.1753036303971969
Energy: 1.3837825780052684
Energy: 1.2567045556840892
Energy: 1.3325706742487486
Energy: 1.2540831047388235
Energy: 1.3325706742511583
Energy: 1.1561550196021104
Energy: 1.3962516562410368
Energy: 1.1976362299997139
Energy: 1.39625165624184
Energy: 1.2602177120919706
Energy: 1.2523231295785986
Energy: 1.2384332262807685
Energy: 1.2523231295769925
Energy: 1.1906653023217066
Energy: 1.3799196476314148
Energy: 1.131350495384124
Energy: 1.3799196476338242
Energy: 1.22823867346249
Energy: 1.2635925224203843
Energy: 1.2406850539197924
Energy: 1.263592522422794
Energy: 1.2307735031139584
Energy: 1.3999519641259301
Energy: 1.1800215037642248
Energy: 1.3999519641275364
Energy: 1.2186061167401399
Energy: 1.3803395762128332
Energy: 1.1916213277623595
Energy: 1.3803395762144395
Energy: 1.1929550206451611
Energy: 1.3447864659279039
Energy: 1.2569247726494774
Energy: 1.344786465928707
Energy: 1.238272903519307
Energy: 1.3968427492451878
Energy: 1.1817812185300873
Energy: 1.396842749241975
Energy: 1.2414650724043093
Energy: 1.3370634060622109
Energy: 1.2342462581637292
Energy: 1.3370634060638171
Energy: 1.1807727742436838
Energy: 1.3809283578004596
Energy: 1.3284345517076683
Energy: 1.3809283577988536
Energy: 1.251924892370631
Energy: 1.321764286741208
Energy: 1.252615681053216
Energy: 1.3217642867387984
Energy: 1.3459263356865572
Energy: 1.3975369992721896
Energy: 1.208348818452582
Energy: 1.3975369992729927
Energy: 1.257079628275573
Energy: 1.382107475992492
Energy: 1.2554487995511052
Energy: 1.3821074759908856
Energy: 1.2192830680293056
Energy: 1.3824792812791697
Energy: 1.248178659411974
Energy: 1.3824792812783666
Energy: 1.2426186385238496
Energy: 1.4033507418660602
Energy: 1.228565480394277
Energy: 1.4033507418676667

minimum gb energy = 1.1131355471126505 eV
minimum distance =  2.16868951511609 Angstroms
sigma value = 1


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

Energy: 1.445087665575731
Energy: 1.4855773482410173
Energy: 1.2380745270486446
Energy: 1.4855773482455958
Energy: 1.3033023508316786
Energy: 1.4279733882806134
Energy: 1.3189410485435842
Energy: 1.4279733882879388
Energy: 1.2431220637652323
Energy: 1.4884808416487108
Energy: 1.30902572758333
Energy: 1.4884808416569524
Energy: 1.262309457888856
Energy: 1.2982412439398407
Energy: 1.2486688135727606
Energy: 1.298241243943504
Energy: 1.2627222448402158
Energy: 1.4577680116426515
Energy: 1.273680668683406
Energy: 1.457768011644483
Energy: 1.2987615399208108
Energy: 1.4571854501786
Energy: 1.2953582913768447
Energy: 1.457185450189589
Energy: 1.302451721592453
Energy: 1.3031007148644849
Energy: 1.2489213468429143
Energy: 1.3031007148635692
Energy: 1.1666250150702762
Energy: 1.4884644696737686
Energy: 1.2638772815407109
Energy: 1.4884644696636955
Energy: 1.288694829527496
Energy: 1.3349896027626147
Energy: 1.3242270681868065
Energy: 1.334989602765362
Energy: 1.2611113848973734
Energy: 1.4838620501598558
Energy: 1.2025259300057027
Energy: 1.4838620501726347
Energy: 1.301905444191789
Energy: 1.4000020092441194
Energy: 1.3190850521305977
Energy: 1.4000020092477827
Energy: 1.2279524598280638
Energy: 1.471555979556656
Energy: 1.3088524314018168
Energy: 1.4715559795484148
Energy: 1.3281258180478193
Energy: 1.4599254333534706
Energy: 1.3020286891021757
Energy: 1.4599254333424818
Energy: 1.32800856760752
Energy: 1.4599706535972434
Energy: 1.2735133063957123
Energy: 1.4599706535890016
Energy: 1.2277676368765904
Energy: 1.4716528863544072
Energy: 1.3140893758541863
Energy: 1.4716528863580702
Energy: 1.3016951148981377
Energy: 1.3999339273085498
Energy: 1.318981952637698
Energy: 1.3999339273058025
Energy: 1.2611094458398033
Energy: 1.4836678373156762
Energy: 1.2167080607448237
Energy: 1.4836678373074346
Energy: 1.288753136964127
Energy: 1.3348977442252594
Energy: 1.3243316428566858
Energy: 1.3348977442188494
Energy: 1.1666233261835266
Energy: 1.4888763229088287
Energy: 1.2400487673159348
Energy: 1.4888763229051656
Energy: 1.302365756459568
Energy: 1.3030052682589526
Energy: 1.2547131237196978
Energy: 1.303005268257121
Energy: 1.2990403802858164
Energy: 1.457251970609379
Energy: 1.239755806555914
Energy: 1.4572519706185363
Energy: 1.2626860398827746
Energy: 1.457700936017694
Energy: 1.2741732909616552
Energy: 1.4577009360167783
Energy: 1.2623656539491572
Energy: 1.2982998634460414
Energy: 1.2485793040728468
Energy: 1.2982998634524519
Energy: 1.2431226469967425
Energy: 1.4884827741635127
Energy: 1.3139188018546928
Energy: 1.4884827741781643
Energy: 1.303387567307537
Energy: 1.4279669824596395
Energy: 1.3188327332091019
Energy: 1.42796698246605
Energy: 1.4450876655729838
Energy: 1.4855773482410173
Energy: 1.2787377697034452
Energy: 1.4855773482465116
Energy: 1.3033023508325943
Energy: 1.4279733882815289
Energy: 1.3189410485445
Energy: 1.427973388288855
Energy: 1.243122063762485
Energy: 1.4884808416496265
Energy: 1.3090257275842454
Energy: 1.4884808416560367
Energy: 1.262309457885193
Energy: 1.2982412439398407
Energy: 1.2511028976666114
Energy: 1.298241243943504

minimum gb energy = 1.1666233261835266 eV
minimum distance =  2.18780502796834 Angstroms
sigma value = 25


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

Energy: 1.38415247186207
Energy: 1.5627114157392237
Energy: 1.3116293795110503
Energy: 1.5627114157381592
Energy: 1.3980693541928846
Energy: 1.4749827107451388
Energy: 1.3553069270091054
Energy: 1.474982710746203
Energy: 1.317398881684907
Energy: 1.6097159464546837
Energy: 1.355003849567137
Energy: 1.6097159464546837
Energy: 1.3702540851194336
Energy: 1.5025869217518004
Energy: 1.3152855542926523
Energy: 1.5025869217518004
Energy: 1.316852015246461
Energy: 1.563335404409654
Energy: 1.3299553568425113
Energy: 1.5633354044085896
Energy: 1.385238801512384
Energy: 1.602068445252433
Energy: 1.3955371233291853
Energy: 1.6020684452534977
Energy: 1.3779892354141956
Energy: 1.3679808613325601
Energy: 1.3483840945707641
Energy: 1.3679808613314957
Energy: 1.3793641827372658
Energy: 1.5695270557169048
Energy: 1.2466129969510729
Energy: 1.5695270557158405
Energy: 1.348421601619592
Energy: 1.4845947563658268
Energy: 1.3985983522139906
Energy: 1.484594756367956
Energy: 1.3563181307686865
Energy: 1.6027477756637976
Energy: 1.301193197510523
Energy: 1.6027477756659263
Energy: 1.3790937525341824
Energy: 1.5632702516172163
Energy: 1.3553071530468377
Energy: 1.5632702516172163
Energy: 1.3370226518611699
Energy: 1.5615255682722486
Energy: 1.354700618625367
Energy: 1.5615255682711842
Energy: 1.3550068943697924
Energy: 1.4939906559235205
Energy: 1.3037711726689163
Energy: 1.4939906559256495
Energy: 1.3486222467007836
Energy: 1.431539826355683
Energy: 1.3963287534950375
Energy: 1.431539826355683
Energy: 1.2939542236821235
Energy: 1.5623089199786706
Energy: 1.2440842428944046
Energy: 1.5623089199776061
Energy: 1.3552663823962752
Energy: 1.3670457297043024
Energy: 1.3166596521339209
Energy: 1.3670457297021732
Energy: 1.2272019454210699
Energy: 1.6019714508125766
Energy: 1.2268244804543658
Energy: 1.6019714508125766
Energy: 1.3151486829743366
Energy: 1.5021756198874094
Energy: 1.3849358917852175
Energy: 1.5021756198874094
Energy: 1.2926986470414001
Energy: 1.4987669426462686
Energy: 1.3171128522327178
Energy: 1.4987669426452042
Energy: 1.315699627312748
Energy: 1.6016351930484674
Energy: 1.3555884266467513
Energy: 1.6016351930484674
Energy: 1.3806343710284572
Energy: 1.4742956918985977
Energy: 1.3779431964510926
Energy: 1.4742956919007266
Energy: 1.385520469111799
Energy: 1.5651511952254489
Energy: 1.3693038638515636
Energy: 1.5651511952254489
Energy: 1.3991954954379129
Energy: 1.5028954498621574
Energy: 1.3545942243202946
Energy: 1.502895449861093
Energy: 1.2269797037275627
Energy: 1.608181182993965
Energy: 1.3562955254102738
Energy: 1.608181182993965
Energy: 1.3544141978870279
Energy: 1.3828049342223243
Energy: 1.3149945690205207
Energy: 1.3828049342212596

minimum gb energy = 1.2268244804543658 eV
minimum distance =  2.19055983395272 Angstroms
sigma value = 9


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

Energy: 1.5613025755878776
Energy: 1.467558213381221
Energy: 1.4333385503282803
Energy: 1.467558213381221
Energy: 1.4289456175014303
Energy: 1.5742059064742853
Energy: 1.4481566053489365
Energy: 1.5742059064768252
Energy: 1.3081539890556224
Energy: 1.4809421407848615
Energy: 1.476627588342401
Energy: 1.4809421407874013
Energy: 1.482646633363288
Energy: 1.602612572673754
Energy: 1.3350070949470683
Energy: 1.6026125726775633
Energy: 1.4869258851573315
Energy: 1.582285758070858
Energy: 1.4434674614117977
Energy: 1.5822857580733976
Energy: 1.3415575963611654
Energy: 1.4810392948570745
Energy: 1.382749365220015
Energy: 1.4810392948558047
Energy: 1.4731169435387899
Energy: 1.3352819946711736
Energy: 1.3364485276764504
Energy: 1.3352819946699037
Energy: 1.3390520790436617
Energy: 1.4810626090591823
Energy: 1.3757003560869572
Energy: 1.4810626090604233
Energy: 1.4742692122494034
Energy: 1.582095790977042
Energy: 1.3843099798461818
Energy: 1.5820957909745024
Energy: 1.4823372365282166
Energy: 1.4673743481313632
Energy: 1.335047042482811
Energy: 1.4673743481313632
Energy: 1.3599034845233924
Energy: 1.4427784670342805
Energy: 1.4475290140460892
Energy: 1.442778446323971
Energy: 1.4827060659987021
Energy: 1.5161667978500715
Energy: 1.3363840331721026
Energy: 1.5161667978500715
Energy: 1.341647987864806
Energy: 1.4754786263581499
Energy: 1.3494503465954815
Energy: 1.4754786263606896
Energy: 1.400566223341983
Energy: 1.4400334503491732
Energy: 1.4673522500721783
Energy: 1.4400334503428525
Energy: 1.3415692212314718
Energy: 1.475177337988127
Energy: 1.319734206934951
Energy: 1.4751773379906667
Energy: 1.482599119442002
Energy: 1.5159360065734184
Energy: 1.334941806438907
Energy: 1.5159360065734184
Energy: 1.4439290227683106
Energy: 1.576736373666392
Energy: 1.4372264333237272
Energy: 1.5767363736613125
Energy: 1.46855666355117
Energy: 1.4687273443191784
Energy: 1.3352419190338307
Energy: 1.4687273443204194
Energy: 1.4663578675825517
Energy: 1.5593817300599533
Energy: 1.3956612573437488
Energy: 1.5593817300599533
Energy: 1.3810582185533449
Energy: 1.4811047677348306
Energy: 1.375840130432741
Energy: 1.4811047677335605
Energy: 1.4742495372979376
Energy: 1.3353907969819976
Energy: 1.3363898649568648
Energy: 1.335390796978188

minimum gb energy = 1.3081539890556224 eV
minimum distance =  2.28198194682012 Angstroms
sigma value = 25


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

Energy: 1.4132380307100625
Energy: 1.6084733845370718
Energy: 1.5934720633706612
Energy: 1.6084733845386423
Energy: 1.3885021244758586
Energy: 1.5945645761964455
Energy: 1.3718639431272281
Energy: 1.5945645761933047
Energy: 1.3728737888345612
Energy: 1.5122934362840572
Energy: 1.3716582720491175
Energy: 1.5122934362840572
Energy: 1.4127081438503497
Energy: 1.4760375097930365
Energy: 1.487191434757945
Energy: 1.4760375098008889
Energy: 1.486228127078053
Energy: 1.3894707936394028
Energy: 1.422194268652315
Energy: 1.3894707936394028
Energy: 1.376216555228813
Energy: 1.708041060284961
Energy: 1.3743237855682087
Energy: 1.7080410602818201
Energy: 1.4385074579290862
Energy: 1.476628598862273
Energy: 1.3718164512730826
Energy: 1.4766285988607024
Energy: 1.4875704603410767
Energy: 1.6098399570555861
Energy: 1.4154463946637836
Energy: 1.6098399570571564
Energy: 1.3716779278478253
Energy: 1.5878745841653026
Energy: 1.390211959552034
Energy: 1.5878745841684434
Energy: 1.5412754105867295
Energy: 1.5116823897570733
Energy: 1.3733746101217592
Energy: 1.5116823897586438
Energy: 1.4122188654523236
Energy: 1.476108386914754
Energy: 1.5884149664392198
Energy: 1.4761083869194656
Energy: 1.372237087731066
Energy: 1.4257296686921512
Energy: 1.5392964240698734
Energy: 1.4257296686937215
Energy: 1.4774417752893478
Energy: 1.5127420150722766
Energy: 1.3719935179685034
Energy: 1.5127420150691357
Energy: 1.371610919040884
Energy: 1.4770707950897033
Energy: 1.4126351787576272
Energy: 1.4770707950865622
Energy: 1.4228035031262776
Energy: 1.4767627306139486
Energy: 1.4814730241712735
Energy: 1.4767627306139486
Energy: 1.390860676475355
Energy: 1.5152088650077853
Energy: 1.3761172921245541
Energy: 1.5152088650030737
Energy: 1.3720384882693362
Energy: 1.5008285154618703
Energy: 1.5400258403230453
Energy: 1.5008285154618703

minimum gb energy = 1.371610919040884 eV
minimum distance =  2.26447572656489 Angstroms
sigma value = 17


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

Energy: 1.5532426198036982
Energy: 1.5525248445533404
Energy: 1.6370754759173736
Energy: 1.552524844550672
Energy: 1.5359389765085576
Energy: 1.5160015262471576
Energy: 1.417879709405545
Energy: 1.516001526245379
Energy: 1.5223324858683147
Energy: 1.5448618145032047
Energy: 1.4180325829805112
Energy: 1.5448618145040944
Energy: 1.4197834343940219
Energy: 1.6393713265175298
Energy: 1.4940624034561605
Energy: 1.6393713265166403
Energy: 1.566556548139514
Energy: 1.4917022578548074
Energy: 1.4630245302996108
Energy: 1.491702257849471
Energy: 1.4360392602050187
Energy: 1.468159984820822
Energy: 1.5209309160619109
Energy: 1.4681599848217113
Energy: 1.4237387135103416
Energy: 1.5762752494547856
Energy: 1.4184374510583515
Energy: 1.5762752494565642
Energy: 1.5139787041637036
Energy: 1.5509139036423318
Energy: 1.4332566087613636
Energy: 1.5509139036432211
Energy: 1.4393814734431654
Energy: 1.6290068341922725
Energy: 1.5613192451678233
Energy: 1.6290068341922725
Energy: 1.6315828308639004
Energy: 1.5196917119509805
Energy: 1.4185574422429292
Energy: 1.5196917119492424
Energy: 1.4233886569808243
Energy: 1.5515611039233703
Energy: 1.5263455367994787
Energy: 1.5515611039242598
Energy: 1.4343080973712814
Energy: 1.573551057451221
Energy: 1.4340791799782941
Energy: 1.573551057453
Energy: 1.5229241342521656
Energy: 1.5520119044656515
Energy: 1.5533452888818695
Energy: 1.5520119044656515
Energy: 1.418254670862629
Energy: 1.5655184402869042
Energy: 1.5336989826263117
Energy: 1.5655184402860147
Energy: 1.5144601515113028
Energy: 1.5779534014029961
Energy: 1.4393166837491569
Energy: 1.577953401406554
Energy: 1.5228067946893773
Energy: 1.5510010313507803
Energy: 1.5139559018297586
Energy: 1.5510010313507803
Energy: 1.418838206343511
Energy: 1.5768390489906423
Energy: 1.6311685859939362
Energy: 1.5768390489906423
Energy: 1.541550862321324
Energy: 1.5461522539492787
Energy: 1.4358778997350916
Energy: 1.5461522539501684
Energy: 1.4505952090297918
Energy: 1.5804982082744647
Energy: 1.508127877123316
Energy: 1.5804982082744647
Energy: 1.41840012294984
Energy: 1.6393354990480213
Energy: 1.4201497925548987
Energy: 1.639335499045353
Energy: 1.4661988418172365
Energy: 1.5447289788824803
Energy: 1.5220284497044911
Energy: 1.5447289788842593
Energy: 1.4187588016028196
Energy: 1.638241923322345
Energy: 1.6327919826177362
Energy: 1.6382419233241239
Energy: 1.5513625992687554
Energy: 1.5514477612036082
Energy: 1.41827147314408
Energy: 1.5514477612027189
Energy: 1.4335382462950028
Energy: 1.5783552368392175
Energy: 1.523864192842063
Energy: 1.5783552368427751
Energy: 1.433047607595996
Energy: 1.5440590359816766
Energy: 1.5225797301005477
Energy: 1.544059035984345
Energy: 1.544582714978289
Energy: 1.5513840722837695
Energy: 1.4194419540493701
Energy: 1.5513840722846586
Energy: 1.4624338948926592
Energy: 1.606139309886648
Energy: 1.6761933943386882
Energy: 1.60613930989817
Energy: 1.5216136107056915
Energy: 1.4688890357224522
Energy: 1.5235265078268867
Energy: 1.46888903572601
Energy: 1.6312724732974615
Energy: 1.6381707125224625
Energy: 1.4234107221770516
Energy: 1.6381707125215732
Energy: 1.4332623591853817
Energy: 1.6273822950085233
Energy: 1.54169439132661
Energy: 1.6273822950094126

minimum gb energy = 1.417879709405545 eV
minimum distance =  2.16150401241509 Angstroms
sigma value = 53


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

Energy: 1.3772404437150392
Energy: 1.375711991684791
Energy: 1.6288585251293557
Energy: 1.3757119916827432
Energy: 1.5749743794178697
Energy: 1.4876197579920893
Energy: 1.498188342402699
Energy: 1.4876197579982322
Energy: 1.3780111792986507
Energy: 1.375331200411533
Energy: 1.5418369037260042
Energy: 1.3753312004094853
Energy: 1.3780083979595048
Energy: 1.3753439795289404
Energy: 1.4807861214815345
Energy: 1.3753439795268927
Energy: 1.574520001170323
Energy: 1.4876028223382205
Energy: 1.5385397497979285
Energy: 1.4876028223402684
Energy: 1.3772404437150392
Energy: 1.375711991684791
Energy: 1.679276449633223
Energy: 1.3757119916827432
Energy: 1.5749743794199176
Energy: 1.4876197579920893
Energy: 1.5195582787657362
Energy: 1.4876197579961847
Energy: 1.3780111793006984
Energy: 1.3753312004074376
Energy: 1.5418369037280517
Energy: 1.3753312004094853
Energy: 1.3780083979615525
Energy: 1.3753439795268927
Energy: 1.520220240611905
Energy: 1.3753439795248452
Energy: 1.574520001170323
Energy: 1.4876028223382205
Energy: 1.5385397497999762
Energy: 1.4876028223382205
Energy: 1.3772404437150392
Energy: 1.375711991684791
Energy: 1.6792845780198253
Energy: 1.3757119916827432
Energy: 1.5749743794199176
Energy: 1.4876197579900416
Energy: 1.519905776026783
Energy: 1.4876197579982322
Energy: 1.3780111792986507
Energy: 1.3753312004094853
Energy: 1.5418369037260042
Energy: 1.3753312004094853

minimum gb energy = 1.3753312004074376 eV
minimum distance =  2.24912414630139 Angstroms
sigma value = 9


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

Energy: 1.4911023371591734
Energy: 1.6517203035618062
Energy: 1.7027949182548383
Energy: 1.6517203035602908
Energy: 1.6137406681110644
Energy: 1.552124583632335
Energy: 1.4827814896550038
Energy: 1.5521245836353663
Energy: 1.4641852429746594
Energy: 1.472944346242436
Energy: 1.4764424400094605
Energy: 1.472944346242436
Energy: 1.5734700867620643
Energy: 1.6954104545724085
Energy: 1.4817657862981088
Energy: 1.695410454591355
Energy: 1.6231158801322008
Energy: 1.55613030252493
Energy: 1.4761245209142102
Energy: 1.5561303025256878
Energy: 1.47340517861051
Energy: 1.4727457148271799
Energy: 1.5831045678818212
Energy: 1.472745714831727
Energy: 1.7642511047856175
Energy: 1.5497823827752415
Energy: 1.4791479517249737
Energy: 1.5497823827767572
Energy: 1.47165278600796
Energy: 1.6922048176717999
Energy: 1.5894463402475985
Energy: 1.6922048176717999
Energy: 1.4648873963523315
Energy: 1.7131830788215818
Energy: 1.4807287413911445
Energy: 1.7131830788117297
Energy: 1.4641743169390398
Energy: 1.5462038945244194
Energy: 1.4756563333524795
Energy: 1.546203894526693
Energy: 1.4719124735131268
Energy: 1.6963665204214649
Energy: 1.7235061525199344
Energy: 1.6963665204131284
Energy: 1.6059913175870646
Energy: 1.6370218321167171
Energy: 1.4669336293820008
Energy: 1.637021832115959
Energy: 1.4638590973264725
Energy: 1.5688042069087633
Energy: 1.6715612571851026
Energy: 1.568804206910279
Energy: 1.5784988339798802
Energy: 1.5871009671295775
Energy: 1.4944651790158083
Energy: 1.5871009671250302
Energy: 1.4730812827934576
Energy: 1.6394964412569242
Energy: 1.5863962302511143
Energy: 1.639496441251619
Energy: 1.466291561696353
Energy: 1.733158175349604
Energy: 1.5741563447281963
Energy: 1.733158175350362
Energy: 1.532714983682055
Energy: 1.6405460718032139
Energy: 1.4729392182747658
Energy: 1.640546071808519
Energy: 1.4737611290798414
Energy: 1.5504490702604474
Energy: 1.6626498058581742
Energy: 1.5504490702612055
Energy: 1.6203252092435816
Energy: 1.5679082851390052
Energy: 1.4745098581852776
Energy: 1.5679082851397628
Energy: 1.467568979511451
Energy: 1.56464175013677
Energy: 1.5502848889682568
Energy: 1.5646417501314651
Energy: 1.5795940766950112
Energy: 1.7206397215744371
Energy: 1.5757054727515156
Energy: 1.7206397215721636
Energy: 1.5581013453362722
Energy: 1.6129912508783866
Energy: 1.4636360899589524
Energy: 1.612991250876871
Energy: 1.4806386489355892
Energy: 1.644773384096303
Energy: 1.4650013176876222
Energy: 1.6447733840955454
Energy: 1.7691185127433533
Energy: 1.5904666554087656
Energy: 1.4715640399155685
Energy: 1.590466655769371
Energy: 1.4801673192211375
Energy: 1.6524992513861254
Energy: 1.7037636074082936
Energy: 1.6524992513838521
Energy: 1.5310921853883495
Energy: 1.4730945547548622
Energy: 1.4637969959268706
Energy: 1.4730945547548622
Energy: 1.5929027554887212
Energy: 1.6418964075309155
Energy: 1.5727328784534245
Energy: 1.6418964075248526
Energy: 1.5011459725996787
Energy: 1.6963207760132448
Energy: 1.5733183921643612
Energy: 1.6963207760208232
Energy: 1.527867007225564
Energy: 1.4726401149977886
Energy: 1.4643846222436456
Energy: 1.4726401149970305
Energy: 1.4825750168584797
Energy: 1.7430723755544666
Energy: 1.7026216522922406
Energy: 1.7430723755552244
Energy: 1.711258897658452
Energy: 1.5713197563604806
Energy: 1.4720068775620199
Energy: 1.5713197052591714
Energy: 1.4833661881408051
Energy: 1.5512844091304732
Energy: 1.4648626445953195
Energy: 1.5512844091304732
Energy: 1.481743981851168
Energy: 1.6165400503582326
Energy: 1.4645272504163747
Energy: 1.6165400503582326
Energy: 1.5724989928669433
Energy: 1.6960525038955674
Energy: 1.5733160077288988
Energy: 1.6960525039054195
Energy: 1.4765212508968844
Energy: 1.679037924330523
Energy: 1.763564491918963
Energy: 1.6790379243320386

minimum gb energy = 1.4636360899589524 eV
minimum distance =  2.18547490253191 Angstroms
sigma value = 73


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

Energy: 1.5645965143195677
Energy: 1.5617154680986307
Energy: 1.7030636298269097
Energy: 1.5617154680998333
Energy: 1.5586055009994577
Energy: 1.6096912046158849
Energy: 1.480533843433661
Energy: 1.6096912046206946
Energy: 1.480502353767121
Energy: 1.4779763856095909
Energy: 1.4752538384040703
Energy: 1.477976385615603
Energy: 1.4604097871724635
Energy: 1.667808891072969
Energy: 1.494217799211284
Energy: 1.6678088910693618
Energy: 1.5233907390579313
Energy: 1.6027631837657113
Energy: 1.4899184587063532
Energy: 1.6027631837681162
Energy: 1.492477470527102
Energy: 1.737823289874041
Energy: 1.6445205112957264
Energy: 1.737823289874041
Energy: 1.763589652286894
Energy: 1.6608109965202191
Energy: 1.4775454526627811
Energy: 1.6608109965214215
Energy: 1.4662510583191695
Energy: 1.4728450682340342
Energy: 1.6722889711189672
Energy: 1.4728450682352363
Energy: 1.6983023990896637
Energy: 1.475308501031379
Energy: 1.4792920891803918
Energy: 1.4753085010325817
Energy: 1.477275571204889
Energy: 1.5858401850189423
Energy: 1.47707862539738
Energy: 1.5858401850141324
Energy: 1.4682597267401614
Energy: 1.4754659145780573
Energy: 1.646728334781589
Energy: 1.4754659145756523
Energy: 1.603561127680653
Energy: 1.6646727150222527
Energy: 1.4601788486460474
Energy: 1.66467271502105
Energy: 1.4931270123578282
Energy: 1.5792827160260619
Energy: 1.6983444369204133
Energy: 1.579282716023657
Energy: 1.6950772008673807
Energy: 1.6610754417100844
Energy: 1.492479780134667
Energy: 1.6610754417100844
Energy: 1.465425040743298
Energy: 1.7018662281573533
Energy: 1.6577018386125129
Energy: 1.7018662281585557
Energy: 1.6452326550798122
Energy: 1.4737785145008435
Energy: 1.466808096927925
Energy: 1.4737785145008435
Energy: 1.5526168079093825
Energy: 1.554812258780097
Energy: 1.480609425071102
Energy: 1.5548122587764894
Energy: 1.5550156371832786
Energy: 1.67917598341264
Energy: 1.4812234354040337
Energy: 1.6791759834138422
Energy: 1.4672302105542594
Energy: 1.4729224307940862
Energy: 1.468452808921428
Energy: 1.4729224307952888
Energy: 1.480664011368398
Energy: 1.5847295610131371
Energy: 1.724878661928662
Energy: 1.584729561011935
Energy: 1.67015052743683
Energy: 1.4772255782402133
Energy: 1.4936897278219743
Energy: 1.4772255782450232
Energy: 1.494044160407857
Energy: 1.6026264663092906
Energy: 1.5673613402192919
Energy: 1.6026264663104932

minimum gb energy = 1.4601788486460474 eV
minimum distance =  2.18596680928581 Angstroms
sigma value = 7


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

Energy: 1.5082951381201979
Energy: 1.5066575666435977
Energy: 1.789579721385321
Energy: 1.5066575666537618
Energy: 1.7523840447362615
Energy: 1.5701230190490179
Energy: 1.4789816467138235
Energy: 1.5701230190549693
Energy: 1.4688911875396955
Energy: 1.6869825961549907
Energy: 1.4993868525227754
Energy: 1.6869825961481888
Energy: 1.4972882252616682
Energy: 1.6050967459601453
Energy: 1.4784857882650388
Energy: 1.6050967459711984
Energy: 1.468936475637904
Energy: 1.5744441329370171
Energy: 1.4876961265035418
Energy: 1.574444132939568
Energy: 1.4652269987414168
Energy: 1.5069239552903195
Energy: 1.677318334663423
Energy: 1.5069239552852178
Energy: 1.6195310039118767
Energy: 1.6496325807861494
Energy: 1.493597530042157
Energy: 1.649632580772546
Energy: 1.4653557150207512
Energy: 1.5078529934995175
Energy: 1.7293441630364121
Energy: 1.5078529935020681
Energy: 1.6559947949476257
Energy: 1.5848458227073219
Energy: 1.4805796753619715
Energy: 1.5848458227064717
Energy: 1.4651521140089452
Energy: 1.6072217653128762
Energy: 1.5943935723843066
Energy: 1.6072217653137264
Energy: 1.4989707495220965
Energy: 1.6994030851313446
Energy: 1.497117447687096
Energy: 1.6994030851542623
Energy: 1.5137928080756737
Energy: 1.5748233050296436
Energy: 1.503746102355564
Energy: 1.5748233050398464
Energy: 1.514357723256212
Energy: 1.5123292645541144
Energy: 1.5044484932764226
Energy: 1.512329264553264
Energy: 1.4983212865239284
Energy: 1.4957105879311825
Energy: 1.502541320949425
Energy: 1.4957105879243806
Energy: 1.4628480126122327
Energy: 1.694978167737617
Energy: 1.7791824822611326
Energy: 1.694978167737617
Energy: 1.8140600821629704
Energy: 1.495473991797083
Energy: 1.4846563267955541
Energy: 1.4954739917911313
Energy: 1.462711108480498
Energy: 1.5751892174971385
Energy: 1.539606275645029
Energy: 1.5751892175124427
Energy: 1.4880947619981177
Energy: 1.672648724290647
Energy: 1.5020756431496818
Energy: 1.672648724283845
Energy: 1.4629103169208975
Energy: 1.7012152534189373
Energy: 1.5040249268383086
Energy: 1.7012152534299905
Energy: 1.4647414921294089
Energy: 1.5770226201232986
Energy: 1.5017653684763206
Energy: 1.5770226201147963
Energy: 1.498702346958735
Energy: 1.6997466284456966
Energy: 1.4806219293491214
Energy: 1.6997466284644018
Energy: 1.4650234143247534
Energy: 1.6876050729844663
Energy: 1.5958210178020324
Energy: 1.687605072987017
Energy: 1.7110479159773835
Energy: 1.5863003146279084
Energy: 1.4971441803873538
Energy: 1.58630031463216
Energy: 1.5107412979152386
Energy: 1.507628740475241
Energy: 1.6772919882026736
Energy: 1.5076287404735405
Energy: 1.511285002231791
Energy: 1.5777454620221392
Energy: 1.4971681333497142
Energy: 1.577745462039994
Energy: 1.4970388561151526
Energy: 1.697655915493249
Energy: 1.4983596398843604
Energy: 1.6976559155034519
Energy: 1.469272686018359
Energy: 1.6042444063871655
Energy: 1.5983104813145432
Energy: 1.604244406385465
Energy: 1.4977820273230664
Energy: 1.574639773463671
Energy: 1.4786565085206433
Energy: 1.574639773463671
Energy: 1.4684464417530358
Energy: 1.5072206959707772
Energy: 1.6354068965985875
Energy: 1.5072206959758785
Energy: 1.8217164098745615
Energy: 1.5076036938326767
Energy: 1.4787423464723282
Energy: 1.50760369384543
Energy: 1.4684718838837252
Energy: 1.5071801729251868
Energy: 1.689508683754572
Energy: 1.5071801729268872

minimum gb energy = 1.462711108480498 eV
minimum distance =  2.16702330585446 Angstroms
sigma value = 29


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

Energy: 1.4628936796431133
Energy: 1.4318596685156635
Energy: 1.4355259195125538
Energy: 1.4318596685153675
Energy: 1.4075493595739033
Energy: 1.4640663652523604
Energy: 1.4646002082207208
Energy: 1.4640663652514718
Energy: 1.448034201973759
Energy: 1.5487597529912684
Energy: 1.5765075618733326
Energy: 1.5487597529924202
Energy: 1.464725798350281
Energy: 1.4076018111887874
Energy: 1.4639138007571264
Energy: 1.4076018111882278
Energy: 1.463047391648325
Energy: 1.5038105069405394
Energy: 1.577464894437377
Energy: 1.5038105069402432
Energy: 1.4311704266495355
Energy: 1.5468987007103183
Energy: 1.4311637015936798
Energy: 1.5468987007085742
Energy: 1.4301451636014946
Energy: 1.5038017195562168
Energy: 1.4630288895216477
Energy: 1.5038017195559206
Energy: 1.4640572658192368
Energy: 1.4075628939519882
Energy: 1.4646445663473149
Energy: 1.4075628939542917
Energy: 1.5765318456524058
Energy: 1.548578147991325
Energy: 1.4086110462746537
Energy: 1.5485781479918843

minimum gb energy = 1.4075493595739033 eV
minimum distance =  2.2484798380595 Angstroms
sigma value = 5


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

Energy: 1.409033984844191
Energy: 1.3942496302767706
Energy: 1.5890941797791065
Energy: 1.3942496302599774
Energy: 1.357179135220324
Energy: 1.4751172390381777
Energy: 1.3352193430552213
Energy: 1.4751172390429963
Energy: 1.346014449783343
Energy: 1.3827769334709958
Energy: 1.5962171553905673
Energy: 1.3827769334750115
Energy: 1.3453396674836848
Energy: 1.4608347616644097
Energy: 1.3736241784290708
Energy: 1.4608347616579846
Energy: 1.363776301924984
Energy: 1.4699049424919992
Energy: 1.6219606446031556
Energy: 1.4699049424928023
Energy: 1.3722673119689097
Energy: 1.4000894751378292
Energy: 1.3537241173991315
Energy: 1.4000894751402388
Energy: 1.3643470808058122
Energy: 1.4801802201986962
Energy: 1.351104621848262
Energy: 1.4801802202011058
Energy: 1.3602874569198542
Energy: 1.401605214914733
Energy: 1.347840111582437
Energy: 1.4016052149259772
Energy: 1.3864392594417345
Energy: 1.6067168526698725
Energy: 1.3420142049276917
Energy: 1.606716852673888
Energy: 1.3815217479999287
Energy: 1.467176727423471
Energy: 1.3614289819924854
Energy: 1.467176727423471
Energy: 1.3583729049137205
Energy: 1.4606757077562689
Energy: 1.3482295789118117
Energy: 1.4606757077651034
Energy: 1.3468925739933533
Energy: 1.627895548535309
Energy: 1.5402337731215505
Energy: 1.6278955485361122
Energy: 1.382577895648247
Energy: 1.398522021151481
Energy: 1.401088318397801
Energy: 1.3985220211482683
Energy: 1.3612122417180046
Energy: 1.3983221483123467
Energy: 1.391270399861001
Energy: 1.3983221483187718
Energy: 1.4987293475153787
Energy: 1.4613776948079966
Energy: 1.3481943105973497
Energy: 1.461377694799965
Energy: 1.3739245894920327
Energy: 1.3757734991492196
Energy: 1.5787128287449388
Energy: 1.3757734991476132
Energy: 1.5960723532236487
Energy: 1.46577532126177
Energy: 1.3513315064181743
Energy: 1.4657753212593603
Energy: 1.369792132161795
Energy: 1.3983322312510937
Energy: 1.4525963389105698
Energy: 1.3983322312470778
Energy: 1.3686423094345042
Energy: 1.4824652872867732
Energy: 1.3573196015467932
Energy: 1.482465287289986
Energy: 1.3434425492919149
Energy: 1.4452285535437626
Energy: 1.3831151919893516
Energy: 1.4452285535413536
Energy: 1.3322429019196196
Energy: 1.4580249725044787
Energy: 1.377576630914446
Energy: 1.4580249725141166
Energy: 1.3677448908514493
Energy: 1.4679422839867144
Energy: 1.3707562921677054
Energy: 1.4679422839875176
Energy: 1.339996005471775
Energy: 1.4000561913951304
Energy: 1.3340582760678252
Energy: 1.4000561913919178
Energy: 1.5317451778919402
Energy: 1.4099235867574107
Energy: 1.3434697364978154
Energy: 1.4099235867670485
Energy: 1.5333434272876159
Energy: 1.3890417889918658
Energy: 1.335516068593887
Energy: 1.3890417889910627
Energy: 1.385331836689561
Energy: 1.3986424920907274
Energy: 1.3613590694983833
Energy: 1.3986424920867118
Energy: 1.3398633644404456
Energy: 1.4473006585418604
Energy: 1.4754563038244333
Energy: 1.4473006585314194
Energy: 1.3819861363720094
Energy: 1.4685906730535547
Energy: 1.3727027171639419
Energy: 1.4685906730487357
Energy: 1.3445004073377214
Energy: 1.3591178181029389
Energy: 1.5068323292794226
Energy: 1.359117818094907
Energy: 1.623431986928625
Energy: 1.3977833130456188
Energy: 1.3684268257113696
Energy: 1.3977833130440127
Energy: 1.3509697855387646
Energy: 1.3831324570115926
Energy: 1.4810169366961794
Energy: 1.3831324570027579
Energy: 1.623111744634643
Energy: 1.4154479703639413
Energy: 1.3454144938524728
Energy: 1.4154479703759886
Energy: 1.3775207138888168
Energy: 1.4625206199624454
Energy: 1.3319584134765134
Energy: 1.4625206199576264

minimum gb energy = 1.3319584134765134 eV
minimum distance =  2.17496066981824 Angstroms
sigma value = 1


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

Energy: 1.3325020657900855
Energy: 1.3312837194928673
Energy: 1.536152345716869
Energy: 1.3312837194984195
Energy: 1.3437327406129662
Energy: 1.3540646258981115
Energy: 1.2998821582786622
Energy: 1.3540646258958908
Energy: 1.2649226705277647
Energy: 1.331319751986584
Energy: 1.7621895579129403
Energy: 1.3313197519854736
Energy: 1.2941563772514397
Energy: 1.4222299930091262
Energy: 1.2908367223079906
Energy: 1.4222299930046842
Energy: 1.2645225251232681
Energy: 1.463137497425626
Energy: 1.5835668936550513
Energy: 1.4631374974311784
Energy: 1.2636659471694476
Energy: 1.3376476428808313
Energy: 1.2905171156692568
Energy: 1.3376476428786106
Energy: 1.264147651199107
Energy: 1.4661279157819547
Energy: 1.2948006755371337
Energy: 1.4661279157797336
Energy: 1.2642630051280515
Energy: 1.3377650144608957
Energy: 1.3248551034175848
Energy: 1.3377650144564537
Energy: 1.3315342057815531
Energy: 1.3384330799673199
Energy: 1.3031695464998534
Energy: 1.3384330799650987
Energy: 1.3314531227728514
Energy: 1.3382504197400447
Energy: 1.3397021935687445
Energy: 1.338250419736713
Energy: 1.264257316214757
Energy: 1.3377696769224898
Energy: 1.3029853245911487
Energy: 1.3377696769202687
Energy: 1.2641415471972048
Energy: 1.4661089711168585
Energy: 1.312182867595584
Energy: 1.4661089711179687
Energy: 1.263478347471784
Energy: 1.3374275913674045
Energy: 1.2900947244813419
Energy: 1.3374275913740676
Energy: 1.2642804779755366
Energy: 1.4631526648885251
Energy: 1.6074986866296255
Energy: 1.4631526648796411
Energy: 1.2940518127139968
Energy: 1.4222527611774824
Energy: 1.2907786773535799
Energy: 1.422252761176372
Energy: 1.264921191037956
Energy: 1.331101571480799
Energy: 1.3697990790414736
Energy: 1.3311015714830199
Energy: 1.3424688645035452
Energy: 1.3542896916910867
Energy: 1.2998531154014483
Energy: 1.3542896917044127
Energy: 1.3325020657889748
Energy: 1.3312837194928673
Energy: 1.3354238401264666
Energy: 1.3312837194984195
Energy: 1.3437327406129662
Energy: 1.3540646258981115
Energy: 1.299882158277552
Energy: 1.3540646258947802
Energy: 1.264922670526654
Energy: 1.331319751986584
Energy: 1.7621895579151108
Energy: 1.3313197519854736
Energy: 1.2941563772481082
Energy: 1.4222299930091262
Energy: 1.29083672230688
Energy: 1.4222299930046842
Energy: 1.2645225251232681
Energy: 1.463137497425626
Energy: 1.5835668936583827
Energy: 1.4631374974311784
Energy: 1.2636659471705578
Energy: 1.337647642881942
Energy: 1.2905171156703168
Energy: 1.337647642879721
Energy: 1.2641476511979968
Energy: 1.4661279157819547
Energy: 1.2948006755382444
Energy: 1.4661279157786231

minimum gb energy = 1.263478347471784 eV
minimum distance =  2.19682082575356 Angstroms
sigma value = 17


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

Energy: 1.3145113611596948
Energy: 1.3123735705545332
Energy: 1.516483676880279
Energy: 1.3123735705552195
Energy: 1.5142897121884917
Energy: 1.299752296115493
Energy: 1.273141369745512
Energy: 1.2997522961175523
Energy: 1.271610263760016
Energy: 1.2937090262800783
Energy: 1.6116371213748855
Energy: 1.2937090262835105
Energy: 1.3084419757764558
Energy: 1.2612537860293052
Energy: 1.2674999758086518
Energy: 1.2612537860368553
Energy: 1.260292206349645
Energy: 1.3992839493958484
Energy: 1.289239685462875
Energy: 1.399283949397221
Energy: 1.2516586618122674
Energy: 1.2815997710114373
Energy: 1.289285428037983
Energy: 1.28159977101281
Energy: 1.2756584165297244
Energy: 1.375232147625322
Energy: 1.2965692630459327
Energy: 1.3752321476246356
Energy: 1.25313445587027
Energy: 1.3654054000778744
Energy: 1.261770144832592
Energy: 1.3654054000813063
Energy: 1.3068721848054012
Energy: 1.3670445774265785
Energy: 1.294046824023423
Energy: 1.3670445774286375
Energy: 1.2933439835796954
Energy: 1.3690225006545726
Energy: 1.2739502965061658
Energy: 1.3690225006525134
Energy: 1.271242798115615
Energy: 1.3370251529938602
Energy: 1.2625687620686983
Energy: 1.3370251529966057
Energy: 1.2754354322061865
Energy: 1.3703647294598857
Energy: 1.2734036419909927
Energy: 1.3703647294557677
Energy: 1.2500228822405939
Energy: 1.3572442980582078
Energy: 1.2745336423482456
Energy: 1.357244298056835
Energy: 1.2670197552920985
Energy: 1.3977955315922963
Energy: 1.3122712143785398
Energy: 1.3977955315964143
Energy: 1.2516361298794072
Energy: 1.270830570162164
Energy: 1.323769496629444
Energy: 1.270830570166282
Energy: 1.2710929082628677
Energy: 1.2955388597977597
Energy: 1.5104289187314786
Energy: 1.2955388597984463
Energy: 1.2865990708583988
Energy: 1.2703742038436783
Energy: 1.2740469552184241
Energy: 1.2703742038436783
Energy: 1.2625588244448354
Energy: 1.3130588770545926
Energy: 1.2745777051355798
Energy: 1.3130588770559655
Energy: 1.4781793153480012
Energy: 1.3740507227934518
Energy: 1.271801897369771
Energy: 1.3740507223008258
Energy: 1.2841870259148502
Energy: 1.2939881386842456
Energy: 1.3146561809081552
Energy: 1.2939881386821865
Energy: 1.2689970905443044
Energy: 1.2869079298935666
Energy: 1.2642934129492862
Energy: 1.2869079298949395
Energy: 1.2636697295457169
Energy: 1.370689105271561
Energy: 1.4989352663004332
Energy: 1.370689105271561
Energy: 1.2974804707060077
Energy: 1.281433574416641
Energy: 1.2861465614138696
Energy: 1.281433574419324
Energy: 1.2716007200593578
Energy: 1.3767175390763748
Energy: 1.5049213411857538
Energy: 1.3767175390770612
Energy: 1.2863779781446227
Energy: 1.3141189211059163
Energy: 1.2643252729977055
Energy: 1.3141189211079753
Energy: 1.2623673205266042
Energy: 1.4006864343956915
Energy: 1.2859423380490507
Energy: 1.4006864343956915
Energy: 1.4833933897692917
Energy: 1.3590729447678906
Energy: 1.2722955325272578
Energy: 1.3590729447692633
Energy: 1.3224181934154722
Energy: 1.5568448761878282
Energy: 1.2516120420508539
Energy: 1.5568448761905735
Energy: 1.3123710461773603
Energy: 1.3972838579955307
Energy: 1.2613656227265744
Energy: 1.3972838579955307
Energy: 1.2624567087329417
Energy: 1.3571002069390568
Energy: 1.2864918435947719
Energy: 1.3571002069424885
Energy: 1.263992393236527
Energy: 1.3975873885538248
Energy: 1.2793282516910909
Energy: 1.3975873885517656
Energy: 1.2516757246405654
Energy: 1.3378691412088886
Energy: 1.2678066357799802
Energy: 1.3378691412088886
Energy: 1.272004120557555
Energy: 1.368503186468269
Energy: 1.5122462652208057
Energy: 1.3685031864710147
Energy: 1.322651099069162
Energy: 1.3002242221878486
Energy: 1.2887234795655427
Energy: 1.300224222025928
Energy: 1.2622155857014266
Energy: 1.314842292024206
Energy: 1.3023667468195157
Energy: 1.314842292024206
Energy: 1.354759915995781
Energy: 1.3770687057675788
Energy: 1.2740988586512365
Energy: 1.3770687057655195
Energy: 1.2862417111692068
Energy: 1.804215396847979
Energy: 1.2548415927196248
Energy: 1.8042153968472927
Energy: 1.2905036499753162
Energy: 1.4007789284583836
Energy: 1.263904748275014
Energy: 1.400778928461129

minimum gb energy = 1.2500228822405939 eV
minimum distance =  2.17934853099846 Angstroms
sigma value = 89


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

Energy: 1.159089031217868
Energy: 1.1584687988002083
Energy: 1.4232159548242782
Energy: 1.1584687988002083
Energy: 1.1616688634334722
Energy: 1.2052818810023809
Energy: 1.1762850177737845
Energy: 1.2052818810023809
Energy: 1.1734327602708101
Energy: 1.3933143631123175
Energy: 1.969441707975822
Energy: 1.3933143631123175
Energy: 1.1483118319396481
Energy: 1.20512036922558
Energy: 1.1764842894801024
Energy: 1.205120369227376
Energy: 1.1729599361873986
Energy: 1.2812366326831093
Energy: 1.1597462762066464
Energy: 1.2812366326813134
Energy: 1.1603852056425572
Energy: 1.160709998123047
Energy: 1.1583167651278194
Energy: 1.1607099981212512
Energy: 1.1734093809003066
Energy: 1.3935058150397002
Energy: 1.175639606475703
Energy: 1.3935058150397002
Energy: 1.1628425188181994
Energy: 1.392941134259024
Energy: 1.1764988899654263
Energy: 1.3929411342554323
Energy: 1.173263000234264
Energy: 1.2815933782253106
Energy: 1.1502995076685711
Energy: 1.2815933782253106
Energy: 1.2054597165384804
Energy: 1.280087458193637
Energy: 1.1609571307943802
Energy: 1.280087458191841
Energy: 1.158530430655263
Energy: 1.2065920872434561
Energy: 1.1732488815944002
Energy: 1.206592087245252
Energy: 1.1589805957676977
Energy: 1.3935478132591494
Energy: 1.175641461321306
Energy: 1.3935478132591494
Energy: 1.1742084479819916
Energy: 1.1639117827990222
Energy: 1.1595703216679305
Energy: 1.1639117827990222
Energy: 1.160283433958956
Energy: 1.2810047616440947
Energy: 1.1609354965620962
Energy: 1.2810047616440947
Energy: 1.1506011620558136
Energy: 1.1639070428636442
Energy: 1.1600635538988695
Energy: 1.1639070428618483

minimum gb energy = 1.1483118319396481 eV
minimum distance =  2.21534420644116 Angstroms
sigma value = 13


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

Energy: 1.148759088706709
Energy: 1.103013518039141
Energy: 1.3847841018421356
Energy: 1.1030135180519374
Energy: 1.1375157156834759
Energy: 1.1353860556403927
Energy: 1.0932991731034192
Energy: 1.1353860556253383
Energy: 1.1050540978923629
Energy: 1.103583695364625
Energy: 1.3337370396835206
Energy: 1.103583695379611
Energy: 1.1086138007382802
Energy: 1.1375934577124054
Energy: 1.0874202475333932
Energy: 1.1375934449081997
Energy: 1.1165924410696944
Energy: 1.1949464903159908
Energy: 1.1108345600849912
Energy: 1.1949464902986782
Energy: 1.0864192118743157
Energy: 1.135665211778568
Energy: 1.1183827507267734
Energy: 1.1356652117717938
Energy: 1.1166524177414803
Energy: 1.198452317904811
Energy: 1.2222260701146028
Energy: 1.1984523178927677
Energy: 1.0763162494671368
Energy: 1.1348386150643583
Energy: 1.1185256759964117
Energy: 1.1348386150748964
Energy: 1.1152676232408387
Energy: 1.1986818623968734
Energy: 1.4166154031253781
Energy: 1.1986818624036477
Energy: 1.341303810732379
Energy: 1.2227379646508552
Energy: 1.0877538545944496
Energy: 1.2227379649157462
Energy: 1.1164563867572777
Energy: 1.2229644309942735
Energy: 1.092667991337376
Energy: 1.2229644310018006
Energy: 1.1268808417077598
Energy: 1.222827757769108
Energy: 1.0870183001369096
Energy: 1.222827757777388
Energy: 1.1587617162943644
Energy: 1.1245835974937024
Energy: 1.092823284227204
Energy: 1.1245835974914442
Energy: 1.5631141484817894
Energy: 1.2222921260625939
Energy: 1.0868916098565289
Energy: 1.2222921260558197
Energy: 1.1106234445006178
Energy: 1.103591133932713
Energy: 1.0913129032013127
Energy: 1.103591133926691
Energy: 1.1175355403016098
Energy: 1.2229090174564328
Energy: 1.0924815234917589
Energy: 1.2229090174556803
Energy: 1.1166041785428418
Energy: 1.1027516333327916
Energy: 1.0919117428000191
Energy: 1.1027516333433298
Energy: 1.1079579864512672
Energy: 1.1946266883437964
Energy: 1.1148649622431634
Energy: 1.19462668833928
Energy: 1.1166276477363963
Energy: 1.1957007750479485
Energy: 1.115068669781449
Energy: 1.1957007750328936
Energy: 1.116674602364657
Energy: 1.195551250996431
Energy: 1.1150832880100305
Energy: 1.1955512510001947
Energy: 1.1080064229596307
Energy: 1.1947033397912525
Energy: 1.1151005041448485
Energy: 1.1947033398017908
Energy: 1.1169699434731262
Energy: 1.102543697895292
Energy: 1.0916523575178625
Energy: 1.1025436979028194
Energy: 1.117500648526133
Energy: 1.2232046149137081
Energy: 1.092524744347101
Energy: 1.2232046149234936
Energy: 1.1106228709382913
Energy: 1.1035353084289956
Energy: 1.0939901294020353
Energy: 1.1035353084320065
Energy: 1.563223721010036
Energy: 1.2226238464019459
Energy: 1.0869183727898322
Energy: 1.2226238463974295
Energy: 1.1545421846260098
Energy: 1.1246724302873348
Energy: 1.0928315461215803
Energy: 1.1246724302722801
Energy: 1.1268538852382823
Energy: 1.2227168294840527
Energy: 1.087176620350659
Energy: 1.22271682947502
Energy: 1.1164785908098094
Energy: 1.223089407835397
Energy: 1.0928787242943827
Energy: 1.223089407835397
Energy: 1.3413355923230705
Energy: 1.222030559629124
Energy: 1.0877729877483182
Energy: 1.222030559599836
Energy: 1.11643710314771
Energy: 1.1984376491019597
Energy: 1.4958822207483602
Energy: 1.1984376490959376
Energy: 1.076523040053694
Energy: 1.1348793561713464
Energy: 1.1184465564768822
Energy: 1.134879356172852
Energy: 1.1163157035059939
Energy: 1.1983469314879387
Energy: 1.3137982942030753
Energy: 1.1983469314917026
Energy: 1.0865633336924383
Energy: 1.1354982306749875
Energy: 1.118599773606641
Energy: 1.1354982306727295
Energy: 1.1165788101171448
Energy: 1.194646303414339
Energy: 1.1064872220088469
Energy: 1.1946463034241246
Energy: 1.1082375111437128
Energy: 1.1374206192967795
Energy: 1.0876444006287784
Energy: 1.13742061324377

minimum gb energy = 1.0763162494671368 eV
minimum distance =  2.23096084255415 Angstroms
sigma value = 37


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

Energy: 1.0528771276008524
Energy: 1.0513646738967892
Energy: 1.319455953850562
Energy: 1.0513646738980844
Energy: 1.032118955127904
Energy: 1.0512748541507524
Energy: 0.9987977500252067
Energy: 1.0512748541494572
Energy: 1.0095739847461003
Energy: 1.1994708430507872
Energy: 1.4353056802452648
Energy: 1.199470843052082
Energy: 0.9901192657785391
Energy: 1.05138646201773
Energy: 0.9985869165572823
Energy: 1.0513864620190252
Energy: 0.9976130054147787
Energy: 1.050851069057494
Energy: 0.9925242755996444
Energy: 1.050851069057494
Energy: 0.9858772317350742
Energy: 1.0512703589535815
Energy: 0.9926983317117712
Energy: 1.0512703589535815
Energy: 1.0308069189179838
Energy: 1.1070092137560346
Energy: 1.3630121519878764
Energy: 1.1070092137560346
Energy: 0.9903040967155684
Energy: 1.0524805744200192
Energy: 1.05550247013509
Energy: 1.0524805744200192
Energy: 0.9976732207108
Energy: 1.0516717914829556
Energy: 1.0620128486420743
Energy: 1.0516717914842508
Energy: 1.4180275216166793
Energy: 1.5035470397408213
Energy: 0.9928259517968577
Energy: 1.5035470397447064
Energy: 1.0310853272156415
Energy: 1.1074068863589381
Energy: 0.9906628928390603
Energy: 1.1074068863576432
Energy: 1.4371161917172726
Energy: 1.0517144426936267
Energy: 0.9986477868439663
Energy: 1.0517144426962168
Energy: 0.9894407879397773
Energy: 1.0516927487176975
Energy: 0.9857071133970181
Energy: 1.0516927487164025
Energy: 1.3754098596304491
Energy: 1.1067549600109496
Energy: 0.9899127234874332
Energy: 1.1067549600122446
Energy: 1.0511386206527151
Energy: 1.107730922864806
Energy: 0.9906469025245808
Energy: 1.107730922866101
Energy: 1.0519907523116325
Energy: 1.0520016455747274
Energy: 0.9989981731955901
Energy: 1.0520016455734322
Energy: 0.9896078573275586
Energy: 1.1846694657177481
Energy: 0.9858145970651983
Energy: 1.1846694657190433
Energy: 0.9984292374688527
Energy: 1.106864694024565
Energy: 0.9990618235440551
Energy: 1.10686469402586
Energy: 0.9972493915747337
Energy: 1.0542667171594677
Energy: 0.9902738908203652
Energy: 1.0542667171581726
Energy: 0.990010723698952
Energy: 1.0518953470860384
Energy: 0.9895843651660852
Energy: 1.0518953470873336

minimum gb energy = 0.9857071133970181 eV
minimum distance =  2.24159675420964 Angstroms
sigma value = 25


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

Energy: 0.9689296336408314
Energy: 0.9103449370390927
Energy: 0.9210740019918143
Energy: 0.910344937040104
Energy: 1.214489999814313
Energy: 0.9343526564105281
Energy: 0.9114032548445462
Energy: 0.9343526564115395
Energy: 0.9068230178365807
Energy: 0.9064419858071974
Energy: 1.245704169744965
Energy: 0.9064419858071974
Energy: 0.9129963618833338
Energy: 0.934944862658495
Energy: 0.9143355652713094
Energy: 0.9350712752838124
Energy: 0.9128912452003816
Energy: 0.9347521138309521
Energy: 0.9101696993909177
Energy: 0.9347521138319634
Energy: 0.8784611092464796
Energy: 1.2131652150224599
Energy: 0.9141594165224498
Energy: 1.2129458474854427
Energy: 0.914162511817605
Energy: 0.9064634955191166
Energy: 0.9134289513964026
Energy: 0.9064634955181053
Energy: 0.877871415955465
Energy: 0.9676509055397723
Energy: 0.9084866997587447
Energy: 0.9676509055377498
Energy: 0.9130226955654949
Energy: 0.9346051477758013
Energy: 1.2144828141613004
Energy: 0.9346051477747901
Energy: 0.8788070602401148
Energy: 1.2677662372091407
Energy: 0.9702172589764713
Energy: 1.2677662371252527
Energy: 0.9140822220978042
Energy: 0.9066587296163244
Energy: 1.4819985347142173
Energy: 0.9066587296183468
Energy: 1.2143817987012666
Energy: 1.2382690421990943
Energy: 0.9085334961714199
Energy: 1.2382690422334766
Energy: 0.9130299027224307
Energy: 0.9347021685595664
Energy: 1.3280876356773008
Energy: 0.9347021685595664
Energy: 1.2248513706829105
Energy: 0.907433980895648
Energy: 0.9142330184152548
Energy: 0.9074339809148619
Energy: 0.91390631466775
Energy: 0.9066060847783041
Energy: 0.8783869803911958
Energy: 0.906606084777293
Energy: 1.2237899584455458
Energy: 1.3345059792763
Energy: 0.9122348698505895
Energy: 1.3345059792843903
Energy: 0.9131551118093653
Energy: 0.9673417512340299
Energy: 0.8786309147917616
Energy: 0.9673417512350411
Energy: 1.216794600844647
Energy: 0.9337650057802567
Energy: 0.9142712682034886
Energy: 0.9337650057741891
Energy: 0.9743388707310275
Energy: 0.9063085917965782
Energy: 0.8789106501943557
Energy: 0.9063085917955669
Energy: 1.4795214531306151
Energy: 1.3357202167825966
Energy: 0.9121208230921839
Energy: 1.3357202163772675
Energy: 0.9129613787368364
Energy: 0.9673341939026214
Energy: 0.8832662471915348
Energy: 0.9673341939026214
Energy: 0.9071768457441175
Energy: 0.9348738764788792
Energy: 0.9143514936734354
Energy: 0.9348738764788792
Energy: 0.9141552578796011
Energy: 0.9067071185153922
Energy: 1.2246106131407286
Energy: 0.9067071185153922
Energy: 0.8789100298344369
Energy: 1.0760899135577264
Energy: 0.9122133661145436
Energy: 1.0760899135587376
Energy: 0.9120518634047231
Energy: 1.07395630091338
Energy: 1.2251369946007657
Energy: 1.07395630091338
Energy: 0.87852891176123
Energy: 0.9677884687784136
Energy: 0.9150697701685631
Energy: 0.9677884687814475

minimum gb energy = 0.877871415955465 eV
minimum distance =  2.24506926231652 Angstroms
sigma value = 41


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

Energy: 1.3008589612226615
Energy: 0.8466608726950943
Energy: 1.1611121019480832
Energy: 0.846660872691778
Energy: 1.3297641764136192
Energy: 0.8264387441297945
Energy: 0.8153692883893079
Energy: 0.8264387441314526
Energy: 0.8452692973893462
Energy: 0.8127669958367141
Energy: 1.1037369307100402
Energy: 0.812766995833398
Energy: 1.0777470756163505
Energy: 1.1382905433450927
Energy: 0.8154145222298187
Energy: 1.138290547283897
Energy: 0.8105260370019927
Energy: 1.0923866584103845
Energy: 0.8272810753398129
Energy: 1.0923866584832669
Energy: 0.8272385041853108
Energy: 0.8275389772743905
Energy: 0.8153385954934642
Energy: 0.8275389772843393
Energy: 0.8143343883279872
Energy: 0.8264111651696023
Energy: 0.827618987985096
Energy: 0.8264111651662861
Energy: 0.7960401709710552
Energy: 0.8456730656303597
Energy: 0.8116356298751027
Energy: 0.8456730656287015
Energy: 0.8180096476562827
Energy: 0.8469666106723323
Energy: 1.1989503656127358
Energy: 0.8469666106739905
Energy: 0.7968380776049759
Energy: 0.8134005703305899
Energy: 0.846050685777767
Energy: 0.8134005675627244
Energy: 0.8144487482177556
Energy: 0.8265853596481236
Energy: 1.5106027056032283
Energy: 0.8265853596423202
Energy: 0.7961460252768571
Energy: 1.1692230265506578
Energy: 1.3016715529566611
Energy: 1.1692230265150836
Energy: 0.818123653179461
Energy: 0.8498403414659477
Energy: 1.4991653710429813
Energy: 0.8498403414642896
Energy: 1.0721145288833671
Energy: 0.9443023128684037
Energy: 0.8459012382150972
Energy: 0.9443023128684037
Energy: 0.8145548500614258
Energy: 0.826728008320352
Energy: 1.2985179600716374
Energy: 0.8267280083220101
Energy: 1.0819387597946288
Energy: 1.0723477866864939
Energy: 0.8115528375167026
Energy: 1.0723477866541602
Energy: 0.8180186518521668
Energy: 0.8481147223759131
Energy: 1.1872230670521848
Energy: 0.8481147223808875
Energy: 1.077782807654563
Energy: 0.9440987635938711
Energy: 0.8152287371148118
Energy: 0.9440987635938711
Energy: 0.8143098177749974
Energy: 0.8453159156903045
Energy: 0.7958826672912743
Energy: 0.8453159156894755
Energy: 1.0962797336427
Energy: 1.0722633656429408
Energy: 0.8219274408188901
Energy: 1.0722633668851036
Energy: 0.848653416630563
Energy: 0.8475732844681817
Energy: 0.8007319480180299
Energy: 0.8475732844673526
Energy: 1.504083731321584
Energy: 0.8713676619655679
Energy: 0.8154721444642823
Energy: 0.8713676619704671
Energy: 1.3043018089790444
Energy: 0.8454649385243118
Energy: 0.7960476770277475
Energy: 0.8454649893390318
Energy: 1.309482921339445
Energy: 1.4382247417475331
Energy: 0.8209846270277883
Energy: 1.4382247417483622
Energy: 0.8485601474609307
Energy: 0.9347938203498019
Energy: 0.7974626230271502
Energy: 0.9347938203473146
Energy: 1.2932619613999983
Energy: 1.5086754134697469
Energy: 0.8152710772603297
Energy: 1.5086754134680889
Energy: 0.8145202663405136
Energy: 0.8445956889192332
Energy: 1.0815212248639035
Energy: 0.8445956889126005
Energy: 0.8249865723637547
Energy: 0.8476847276235148
Energy: 0.8179177318611444
Energy: 0.8476847276309762
Energy: 0.8179667086426378
Energy: 0.9349089258739046
Energy: 1.0846833298013205
Energy: 0.9349089258714175
Energy: 0.795938951368625
Energy: 0.899113977689096
Energy: 0.8189085138338752
Energy: 0.8991139776932413
Energy: 0.8217234896570664
Energy: 0.8449209150129559
Energy: 1.0962771807236888
Energy: 0.8449209150121266
Energy: 0.7961142459823038
Energy: 0.8469617657854426
Energy: 0.8527669129252615
Energy: 0.8469617657895878

minimum gb energy = 0.7958826672912743 eV
minimum distance =  2.22816704032282 Angstroms
sigma value = 15


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

Energy: 1.1756458985813356
Energy: 0.7669673278839806
Energy: 0.990611344793595
Energy: 0.7669673278825759
Energy: 1.3596708039069383
Energy: 0.7626551217088646
Energy: 0.7640722345079419
Energy: 0.7626551217060553
Energy: 0.7934875323849416
Energy: 0.7623243348351092
Energy: 0.7479187634632339
Energy: 0.7623243348365139
Energy: 1.1891308518361459
Energy: 0.7641976281633827
Energy: 0.7639165268550421
Energy: 0.7641976281612757
Energy: 0.7610455267900655
Energy: 0.7669602033866452
Energy: 0.7629386105094172
Energy: 0.7669602033859427
Energy: 1.1647659584105585
Energy: 0.7635678980635182
Energy: 0.7640567967709051
Energy: 0.7635678980628159
Energy: 0.7633947697422141
Energy: 1.0600278637421867
Energy: 0.7613923611040677
Energy: 1.0600278638861012
Energy: 0.7625498638457873
Energy: 0.777355585639053
Energy: 0.7639693336583104
Energy: 0.7773555856292204
Energy: 0.7656214963558541
Energy: 0.7789578334096255
Energy: 0.9759822594652094
Energy: 0.7789578334089233
Energy: 0.7323049497425774
Energy: 0.7628744711044995
Energy: 0.7616190756466193
Energy: 0.7628744711044995
Energy: 0.7633888557296252
Energy: 0.7636284040387245
Energy: 1.1921429854512788
Energy: 0.7636284040387245
Energy: 0.7336659443511273
Energy: 0.7624154718791134
Energy: 0.7941362844868972
Energy: 0.7624154718777088
Energy: 0.7659327557974677
Energy: 0.7791140839826057
Energy: 1.5221773141831627
Energy: 0.7791140839868198
Energy: 0.7321469486486777
Energy: 0.7670522594397566
Energy: 1.1761656200101105
Energy: 0.767052259427817
Energy: 0.7634725653907427
Energy: 0.7630212443805052
Energy: 1.522400539391193
Energy: 0.7630212443791006
Energy: 0.9664301551016331
Energy: 0.7625644860736711
Energy: 0.7941826826678612
Energy: 0.7625644860681163
Energy: 0.7660161284778271
Energy: 0.7780051540443725
Energy: 1.3474815102157174
Energy: 0.7780051540401584
Energy: 0.9750344261901784
Energy: 0.770416473493294
Energy: 0.7616011766433449
Energy: 0.7704164735108523
Energy: 0.7634733692661947
Energy: 0.7616513532397052
Energy: 1.1631112901548433
Energy: 0.7616513532383006
Energy: 0.9860014703650859
Energy: 0.7636376521685612
Energy: 0.763916557788856
Energy: 0.7636376521664542
Energy: 0.7657485950784938
Energy: 0.7942698886033808
Energy: 1.0746269939238855
Energy: 0.794269888599869
Energy: 0.9806589491686242
Energy: 0.7796133554080898
Energy: 0.7687400165049869
Energy: 0.7796133554052804
Energy: 0.7634569119148578
Energy: 0.7617474576016672
Energy: 0.7319460234089028
Energy: 0.7617474575967509
Energy: 1.4005211797744166
Energy: 0.7637660787420003
Energy: 0.7640640377545893
Energy: 0.7637660787405958
Energy: 0.7957954454421917
Energy: 0.7943260736586999
Energy: 0.7333808861694044
Energy: 0.7943260736572952
Energy: 1.3611404176882356
Energy: 0.7792579488391778
Energy: 0.7687138860067514
Energy: 0.779257948835666
Energy: 1.177876675322805
Energy: 0.7622780704650083
Energy: 0.7320270040282456
Energy: 0.762278070464306
Energy: 1.5213396767175336
Energy: 1.289119265202798
Energy: 0.7643632240442624
Energy: 1.2891192651964771
Energy: 0.7960735862509928
Energy: 0.8678738992292155
Energy: 0.7398956674725929
Energy: 0.867873899217276
Energy: 1.1549440692414763
Energy: 0.7772074745667642
Energy: 0.7687279884452569
Energy: 0.7772074745611456
Energy: 0.7635843650914729
Energy: 0.7618468270301056
Energy: 0.9747039685321227
Energy: 0.7618468270244868
Energy: 1.1725820507663713
Energy: 0.7610103785056663
Energy: 0.7639533272327836
Energy: 0.7610103784979406
Energy: 0.765890533220801
Energy: 0.8710695230634785
Energy: 0.9867445408222575
Energy: 0.8710695230627762
Energy: 0.7412931425381163
Energy: 0.7939197195540135
Energy: 0.7687081877857497
Energy: 0.7939197195497995
Energy: 0.7451504915860024
Energy: 0.8413934962764319
Energy: 0.9831195795054326
Energy: 0.8413934962708133
Energy: 0.7322776077571104
Energy: 0.761335954540234
Energy: 0.7663975375461096
Energy: 0.7613359545430435
Energy: 0.7661098522308885
Energy: 0.8700230417301585
Energy: 1.3973692036887673
Energy: 0.8700230417252421

minimum gb energy = 0.7319460234089028 eV
minimum distance =  2.23137600336445 Angstroms
sigma value = 85


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

Energy: 1.1006251184101177
Energy: 0.7439400423709319
Energy: 0.6860646069737366
Energy: 0.7439400423721502
Energy: 1.3834778512562733
Energy: 0.7393518887480197
Energy: 0.6989759059925394
Energy: 0.7393518887486288
Energy: 1.0560771416619836
Energy: 0.7392143404364029
Energy: 0.6624699344597478
Energy: 0.739214340437012
Energy: 1.3464045189233005
Energy: 0.739517028801366
Energy: 0.6991499769868667
Energy: 0.7395170288038028
Energy: 0.738824427000399
Energy: 0.6970371425768714
Energy: 0.7011949274502838
Energy: 0.6970371425762623
Energy: 1.1847660606950081
Energy: 0.7399976971596168
Energy: 0.6990782996141525
Energy: 0.7399976971596168
Energy: 0.6962665559750724
Energy: 0.9197332775136515
Energy: 0.7056889630059404
Energy: 0.9197332775124332
Energy: 1.0204282115464949
Energy: 0.7383242570642841
Energy: 0.69918085797371
Energy: 0.7383242570630658
Energy: 0.6984078157728548
Energy: 0.8758281182134071
Energy: 0.8944197276671667
Energy: 0.8758281142716409
Energy: 0.8484080595430749
Energy: 0.7647143031550303
Energy: 0.696819592787735
Energy: 0.7647143031550303
Energy: 0.6995104406001875
Energy: 0.7394887676577919
Energy: 1.0827084102236955
Energy: 0.7394887676577919
Energy: 0.6582553294614244
Energy: 0.7383676256899867
Energy: 0.7393830755198959
Energy: 0.7383676256930323
Energy: 0.698589859268642
Energy: 0.7154959437270877
Energy: 1.2311872103422865
Energy: 0.715495943728306
Energy: 0.6594000712874771
Energy: 0.7395770989731271
Energy: 1.056698179741462
Energy: 0.739577098972518
Energy: 0.6997274267697362
Energy: 0.7393411413766983
Energy: 1.5060296907365895
Energy: 0.7393411413779165
Energy: 0.658420521136753
Energy: 0.7440720299729735
Energy: 1.1008554698836228
Energy: 0.7440720299753824
Energy: 0.6986992135523967
Energy: 0.7154805127346867
Energy: 1.505893957434839
Energy: 0.7154805127328594
Energy: 0.8658999344056074
Energy: 0.7394421961020334
Energy: 1.0567082600154893
Energy: 0.7394421961032517
Energy: 0.6998894838545007
Energy: 0.7394510326641474
Energy: 1.3475807948392013
Energy: 0.7394510326617107
Energy: 0.8697024609748594
Energy: 0.7439592088560477
Energy: 0.7392744227708126
Energy: 0.743959208853002
Energy: 0.6985497199331906
Energy: 0.715615230854437
Energy: 1.18571096777938
Energy: 0.715615230854437
Energy: 0.8663599672934887
Energy: 0.7396329387563303
Energy: 0.6969392689982691
Energy: 0.739632938755721
Energy: 0.6993171313977586
Energy: 0.7381100015854105
Energy: 1.0218371137077145
Energy: 0.7381100015848013
Energy: 0.8773119488425396
Energy: 0.7673276642572395
Energy: 0.6991001524998945
Energy: 0.7673276642529757
Energy: 0.6985272473246679
Energy: 0.7378592803891667
Energy: 0.9417386484328419
Energy: 0.7378592803885575
Energy: 1.2364718874241365
Energy: 0.7394959802716313
Energy: 0.7000213354399102
Energy: 0.7394959802795501
Energy: 0.7407869978341824
Energy: 0.7381187043057525
Energy: 0.6580883751720621
Energy: 0.7381187043057525
Energy: 1.2485480469837724
Energy: 0.7675337788976637
Energy: 0.6992632420310055
Energy: 0.7675337788958364
Energy: 1.058320933352613
Energy: 0.8964532138764719
Energy: 0.659626641541934
Energy: 0.896453213884972
Energy: 1.5062204551534988
Energy: 0.7395302797739979
Energy: 0.699994690896175
Energy: 0.7395302797733887
Energy: 1.1020433644319148
Energy: 0.7378042701251611
Energy: 0.6581329982664439
Energy: 0.7378042701263794
Energy: 1.3731847878911936
Energy: 0.7675425481784639
Energy: 0.6991958322210691
Energy: 0.7675425481845553
Energy: 1.0583615095512524
Energy: 0.8961810437393958
Energy: 0.6602734350600572
Energy: 0.8961810437326952
Energy: 1.3469442670034006
Energy: 0.7396110670450851
Energy: 0.6999863230487666
Energy: 0.7396110670463033
Energy: 0.7407521019674975
Energy: 0.7379006582672479
Energy: 0.8690472304617911
Energy: 0.7379006582672479
Energy: 1.0274190563712504
Energy: 0.7643139842858817
Energy: 0.699268570788272
Energy: 0.7643139842822546
Energy: 0.6987456847447888
Energy: 0.896313736140822
Energy: 0.865948837457773
Energy: 0.8963137361371671
Energy: 1.030668642053687
Energy: 0.738015629472169
Energy: 0.7001507260213558
Energy: 0.738015629472169
Energy: 0.7000193807663007
Energy: 0.737906474806411
Energy: 0.8771063340108793
Energy: 0.7379064748076293
Energy: 0.6690713029282626
Energy: 0.7931278880844542
Energy: 0.698809250908835
Energy: 0.7931278880862817
Energy: 0.6980064812218554
Energy: 0.8962311775428318
Energy: 1.234589206885609
Energy: 0.8962311775446592
Energy: 0.6580248612674576
Energy: 0.738032288430018
Energy: 0.7420889754711243
Energy: 0.7380322884318453
Energy: 0.6990564204960781
Energy: 0.7382196719336518
Energy: 1.2475782742818562
Energy: 0.7382196719330425

minimum gb energy = 0.6580248612674576 eV
minimum distance =  2.24774573082942 Angstroms
sigma value = 113


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

Energy: 0.0202542097336686
Energy: 0.02102691933076567
Energy: 0.8979625052051028
Energy: 0.021026919333002967
Energy: 0.8979445087840612
Energy: 0.43627572778589013
Energy: 0.43767264253919197
Energy: 0.4362757277854219
Energy: 0.020254209734136875
Energy: 0.021026919329829127
Energy: 0.897962130255995
Energy: 0.021026919333002967
Energy: 0.8979445087840612
Energy: 0.4362757277854219
Energy: 0.4376726425382554
Energy: 0.43627572778589013
Energy: 0.0202542097336686
Energy: 0.02102691933076567
Energy: 0.898219874997481
Energy: 0.021026919333002967
Energy: 0.8979445087844774
Energy: 0.43627572778677465
Energy: 0.43767264253731886
Energy: 0.43627572778495355

minimum gb energy = 0.0202542097336686 eV
minimum distance =  2.48313075554831 Angstroms
sigma value = 1