Model name: model_name=EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_000
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=3.5192936509847637
cohesive_energy=4.450092204567907
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: 0.018175328473975776
Energy: 0.018749092033795746
Energy: 1.1662553220043503
Energy: 0.018749092033795746
Energy: 0.018749092033795746
Energy: 0.8453097891736333
Energy: 0.01874909203442077
Energy: 0.8453097891729716
Energy: 1.1662553220043503
Energy: 0.018749092033795746
Energy: 0.018175328473975776
Energy: 0.018749092033795746
Energy: 0.018749092033795746
Energy: 0.8453097891729716
Energy: 0.018749092033795746
Energy: 0.8453097891736333

minimum gb energy = 0.018175328473975776 eV
minimum distance =  2.44486651699521 Angstroms
sigma value = 1


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

Energy: 1.3005598260762603
Energy: 1.3627719454413205
Energy: 1.236597818820336
Energy: 1.3627719454429257
Energy: 1.3247743665901361
Energy: 1.3758508534225347
Energy: 1.3219480340992764
Energy: 1.3758508534233373
Energy: 1.2504314017030669
Energy: 1.3516611596850716
Energy: 1.2845272458963946
Energy: 1.3516611596842691
Energy: 1.301879156227064
Energy: 1.2949272865622892
Energy: 1.2627059161004741
Energy: 1.2949272865598815
Energy: 1.3028461388118509
Energy: 1.386818970908836
Energy: 1.3072651004283873
Energy: 1.386818970908836
Energy: 1.2325666786436837
Energy: 1.2798500475222474
Energy: 1.193320766750673
Energy: 1.2798500475238526
Energy: 1.366332699352884
Energy: 1.3696731574463046
Energy: 1.2359740577220282
Energy: 1.3696731574495151
Energy: 1.1789584268064974
Energy: 1.3889218820603684
Energy: 1.1947330056394612
Energy: 1.3889218820595657
Energy: 1.259901057145814
Energy: 1.2809758449206772
Energy: 1.3506391192842828
Energy: 1.2809758449222823
Energy: 1.193646920425623
Energy: 1.3502632320522785
Energy: 1.1651465749029999
Energy: 1.3502632320546866
Energy: 1.3461882116660535
Energy: 1.3850916072640864
Energy: 1.259416652512856
Energy: 1.385091607264889
Energy: 1.2281604362313407
Energy: 1.3871431920520867
Energy: 1.2048608435725174
Energy: 1.3871431920528892
Energy: 1.3157486289321434
Energy: 1.411704767833214
Energy: 1.3655704072420773
Energy: 1.4117047678308063
Energy: 1.3079693956406444
Energy: 1.336827256133908
Energy: 1.2334032913350017
Energy: 1.3368272561331054
Energy: 1.313772840785813
Energy: 1.384705207353097
Energy: 1.318039958626171
Energy: 1.384705207353097
Energy: 1.3095209261050103
Energy: 1.4266906794497827
Energy: 1.31917873699091
Energy: 1.4266906794521905
Energy: 1.284557843264596
Energy: 1.3518100642970556
Energy: 1.2013693982820701
Energy: 1.3518100642930424
Energy: 1.3202990465222195
Energy: 1.4392498149371613
Energy: 1.3664901596975976
Energy: 1.4392498149363588
Energy: 1.1857810722341995
Energy: 1.38968887235129
Energy: 1.2034581708692484
Energy: 1.3896888723520926
Energy: 1.362551413019056
Energy: 1.2793446861339086
Energy: 1.2593347202151202
Energy: 1.2793446861339086
Energy: 1.1970347336953528
Energy: 1.351568734960698
Energy: 1.1722492975137515
Energy: 1.3515687349615007
Energy: 1.2612984149008168
Energy: 1.2945862700788255
Energy: 1.3383112114074367
Energy: 1.2945862700780228
Energy: 1.2870064059329196
Energy: 1.384572465110816
Energy: 1.2242168654694714
Energy: 1.3845724651116185
Energy: 1.2786331544252327
Energy: 1.3747205267897613
Energy: 1.2327099513162805
Energy: 1.3747205267873532
Energy: 1.2359700112675323
Energy: 1.2797010740068402
Energy: 1.3548893165808022
Energy: 1.2797010740060375
Energy: 1.3027306706126458
Energy: 1.3885162631472998
Energy: 1.2581188808440225
Energy: 1.3885162631489052
Energy: 1.3052332362648342
Energy: 1.4406272443461536
Energy: 1.2585142984807018
Energy: 1.4406272443461536
Energy: 1.2529383273632053
Energy: 1.3473772451742052
Energy: 1.2853965927618787
Energy: 1.3473772451742052
Energy: 1.326959819774107
Energy: 1.4372218996974262
Energy: 1.313895032238392
Energy: 1.4372218996990316
Energy: 1.3009014938617818
Energy: 1.3651957598907438
Energy: 1.2690011136352777
Energy: 1.3651957598899414
Energy: 1.3278492032809326
Energy: 1.3841957774169384
Energy: 1.3160636330845497
Energy: 1.384195777415333
Energy: 1.280252148375165
Energy: 1.3471707530727495
Energy: 1.3081989366185933
Energy: 1.3471707530751573
Energy: 1.3070244324792188
Energy: 1.2925859576447412
Energy: 1.2656475565019762
Energy: 1.2925859576495566

minimum gb energy = 1.1651465749029999 eV
minimum distance =  2.18867245221038 Angstroms
sigma value = 1


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

Energy: 1.3675631482893968
Energy: 1.4077462071932694
Energy: 1.3468708546851573
Energy: 1.4077462071886937
Energy: 1.3563325478756783
Energy: 1.4623441721012416
Energy: 1.3779861294228475
Energy: 1.4623441720975807
Energy: 1.314288127013733
Energy: 1.393965537464312
Energy: 1.363572239742412
Energy: 1.393965537456076
Energy: 1.2525156206050971
Energy: 1.2999546002381115
Energy: 1.2836290440242437
Energy: 1.2999546002326205
Energy: 1.2523468374421858
Energy: 1.4492664872168974
Energy: 1.3464793322668347
Energy: 1.4492664872132368
Energy: 1.2826727002675462
Energy: 1.4501976601012794
Energy: 1.3595120870115665
Energy: 1.450197660100364
Energy: 1.3638079048629277
Energy: 1.2999474930983352
Energy: 1.2846732611497969
Energy: 1.2999474930992503
Energy: 1.209667728768056
Energy: 1.406496892809774
Energy: 1.2547767996219157
Energy: 1.4064968928079435
Energy: 1.2591033451124316
Energy: 1.3536383675282797
Energy: 1.4217249945112325
Energy: 1.3536383675328556
Energy: 1.251329671292557
Energy: 1.469002799626172
Energy: 1.275674792644521
Energy: 1.469002799626172
Energy: 1.363270011292059
Energy: 1.4851754848961245
Energy: 1.3760929670872064
Energy: 1.4851754848897603
Energy: 1.2348862192118284
Energy: 1.4141259073112327
Energy: 1.3402257134568967
Energy: 1.4141259073103174
Energy: 1.4049449030165233
Energy: 1.4558684774948958
Energy: 1.3416029334943327
Energy: 1.4558684774967259
Energy: 1.4048408212017995
Energy: 1.4561399912123258
Energy: 1.330265716143557
Energy: 1.456139991213241
Energy: 1.2348179946508486
Energy: 1.4141670186919055
Energy: 1.363598631988217
Energy: 1.4141670186882451
Energy: 1.363216231182795
Energy: 1.4851606660080765
Energy: 1.3780399952545017
Energy: 1.4851606660117374
Energy: 1.251324367415283
Energy: 1.469021449842044
Energy: 1.2318255759232086
Energy: 1.4690214498429592
Energy: 1.2590903389916575
Energy: 1.353222318511524
Energy: 1.4216883986186546
Energy: 1.3532223185060333
Energy: 1.209686845993906
Energy: 1.4066504993034101
Energy: 1.2447953007068995
Energy: 1.4066504992943003
Energy: 1.3637803779227402
Energy: 1.30010824749869
Energy: 1.2831455895252417
Energy: 1.3001082475005201
Energy: 1.2828156668059247
Energy: 1.450486279086435
Energy: 1.2448185537148342
Energy: 1.4504862790836894
Energy: 1.2523742931051143
Energy: 1.4494446735055713
Energy: 1.3506459392572674
Energy: 1.4494446734982502
Energy: 1.252466045078195
Energy: 1.299915970311673
Energy: 1.2863437757871816
Energy: 1.299915970304352
Energy: 1.3143186359963481
Energy: 1.3936918245284957
Energy: 1.3638023853637777
Energy: 1.393691824524835
Energy: 1.356433418779234
Energy: 1.4622764089539881
Energy: 1.3779500898629282
Energy: 1.462276408955777
Energy: 1.3675631482911854
Energy: 1.4077462071932694
Energy: 1.3165033439273297
Energy: 1.4077462071886937
Energy: 1.356332547874763
Energy: 1.4623441721012416
Energy: 1.3779861294228475
Energy: 1.4623441720975807
Energy: 1.314288127013733
Energy: 1.393965537464312
Energy: 1.3096862222267958
Energy: 1.393965537456076
Energy: 1.2525156206014367
Energy: 1.2999546002381115
Energy: 1.262702448432713
Energy: 1.2999546002326205

minimum gb energy = 1.209667728768056 eV
minimum distance =  2.17856055362877 Angstroms
sigma value = 25


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

Energy: 1.341663498936126
Energy: 1.468937422224573
Energy: 1.438204263739264
Energy: 1.468937422224573
Energy: 1.4225099288044378
Energy: 1.4356879754397003
Energy: 1.3180798144375994
Energy: 1.4356879754397003
Energy: 1.3755110821862306
Energy: 1.5149957170257242
Energy: 1.3164461626563138
Energy: 1.5149957170246606
Energy: 1.319999884732958
Energy: 1.3258603913547642
Energy: 1.2963096338490676
Energy: 1.325860391355828
Energy: 1.29494795986934
Energy: 1.4946425623836124
Energy: 1.430108824006204
Energy: 1.4946425623836124
Energy: 1.351552970507441
Energy: 1.5128502057716702
Energy: 1.43598479364456
Energy: 1.5128502057716702
Energy: 1.4359530900480064
Energy: 1.3208639014878705
Energy: 1.337254412706457
Energy: 1.3208639014868067
Energy: 1.4128541564570514
Energy: 1.4290333780578783
Energy: 1.3019060149892119
Energy: 1.4290333780610696
Energy: 1.3361397328465627
Energy: 1.5147633698780887
Energy: 1.4362585449085485
Energy: 1.5147633698780887
Energy: 1.3178768248416206
Energy: 1.5084744217794186
Energy: 1.2875236337169944
Energy: 1.5084744217794186
Energy: 1.416162905846538
Energy: 1.5070316748489958
Energy: 1.4142501031475405
Energy: 1.507031674847932
Energy: 1.4004076101288265
Energy: 1.4177923284744347
Energy: 1.4143425828410818
Energy: 1.4177923284744347
Energy: 1.3162230780792723
Energy: 1.4103230192623073
Energy: 1.2885081662924385
Energy: 1.4103230192612437
Energy: 1.3415299964702405
Energy: 1.4365582855975014
Energy: 1.4358463747251125
Energy: 1.4365582855996293
Energy: 1.338879491820744
Energy: 1.4801573248712712
Energy: 1.3026770278136353
Energy: 1.4801573248702073
Energy: 1.430193260794908
Energy: 1.3211345876679537
Energy: 1.310629922376843
Energy: 1.3211345876679537
Energy: 1.2551741227858844
Energy: 1.5009772396170162
Energy: 1.2545025225289277
Energy: 1.5009772396170162
Energy: 1.2961730656112853
Energy: 1.4935599600329699
Energy: 1.4192334267121307
Energy: 1.493559960034034
Energy: 1.3209121315699832
Energy: 1.324874769325165
Energy: 1.2951705001356142
Energy: 1.3248747693241016
Energy: 1.4355814979444865
Energy: 1.520556619211725
Energy: 1.3165353472680241
Energy: 1.520556619211725
Energy: 1.326418127759156
Energy: 1.4437182773598192
Energy: 1.3163350678429182
Energy: 1.4437182773608832
Energy: 1.3426886576159285
Energy: 1.476910250488894
Energy: 1.4254972163694524
Energy: 1.4769102504867664
Energy: 1.4223356475172515
Energy: 1.4144106083110046
Energy: 1.3175076296137593
Energy: 1.4144106083131323
Energy: 1.3908615364753445
Energy: 1.5283080776930371
Energy: 1.317890409616395
Energy: 1.528308077694101
Energy: 1.4303441147206273
Energy: 1.3260906551120386
Energy: 1.3117792853582082
Energy: 1.326090655110975

minimum gb energy = 1.2545025225289277 eV
minimum distance =  2.22352740510592 Angstroms
sigma value = 9


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

Energy: 1.4633454139998794
Energy: 1.4927139539938015
Energy: 1.5096787910364198
Energy: 1.4927139539938015
Energy: 1.474048739808279
Energy: 1.486218602657759
Energy: 1.4383633352164424
Energy: 1.486218602659028
Energy: 1.443436815569864
Energy: 1.4779693655184418
Energy: 1.4592063901211023
Energy: 1.477969365517173
Energy: 1.4652629046591148
Energy: 1.4842224945451388
Energy: 1.3822487313048097
Energy: 1.4842224945451388
Energy: 1.4232593532239077
Energy: 1.5117018805077767
Energy: 1.4910862556836266
Energy: 1.5117018805065074
Energy: 1.3176915017309547
Energy: 1.3952000686968684
Energy: 1.394201741431776
Energy: 1.3952000686981376
Energy: 1.5018873884967272
Energy: 1.3071384961135948
Energy: 1.308415199103371
Energy: 1.307138496116133
Energy: 1.3680982155026686
Energy: 1.3952430700813865
Energy: 1.3415252065867547
Energy: 1.3952430700826557
Energy: 1.3923445177082647
Energy: 1.5092817743727724
Energy: 1.5018939185092115
Energy: 1.5092817743727724
Energy: 1.3914695970532094
Energy: 1.4916133342460705
Energy: 1.4995440535709326
Energy: 1.4916133342448012
Energy: 1.3795302008439327
Energy: 1.5323884558986602
Energy: 1.4428048176283423
Energy: 1.532388455899929
Energy: 1.5183006268144508
Energy: 1.4712455179408985
Energy: 1.3824893812203214
Energy: 1.4712455179396293
Energy: 1.3176401554998132
Energy: 1.4510809671461276
Energy: 1.3482098460757777
Energy: 1.4510809671448588
Energy: 1.4162692062214797
Energy: 1.494531334815777
Energy: 1.4675658380315668
Energy: 1.4945313348183151
Energy: 1.317540696231954
Energy: 1.562751436606252
Energy: 1.3303116192221909
Energy: 1.562751436606252
Energy: 1.5260798851953912
Energy: 1.4778945146332119
Energy: 1.3071870102221133
Energy: 1.4778945146319427
Energy: 1.3924176143056768
Energy: 1.4927027851039771
Energy: 1.368907871618358
Energy: 1.4927027851039771
Energy: 1.4517862407013455
Energy: 1.4504387118186615
Energy: 1.4999492609944698
Energy: 1.4504387118186615
Energy: 1.5473331070662815
Energy: 1.488234708527113
Energy: 1.4579359027723935
Energy: 1.488234708525844
Energy: 1.4107151047977735
Energy: 1.4238521118226768
Energy: 1.340791574319548
Energy: 1.423852111823946
Energy: 1.4816983398851105
Energy: 1.430334054039604
Energy: 1.3915806664178936
Energy: 1.4303340540408727

minimum gb energy = 1.3071384961135948 eV
minimum distance =  2.27386988956664 Angstroms
sigma value = 25


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

Energy: 1.3311298578206359
Energy: 1.5755992818930744
Energy: 1.584759336611958
Energy: 1.5755992818930744
Energy: 1.3078528105844436
Energy: 1.511286335581723
Energy: 1.3099727038631728
Energy: 1.511286335581723
Energy: 1.5133031152882304
Energy: 1.4881288460120117
Energy: 1.31016744965453
Energy: 1.4881288460120117
Energy: 1.544893226018702
Energy: 1.4656833957806603
Energy: 1.4632413082126603
Energy: 1.4656833957806603
Energy: 1.46144605266869
Energy: 1.3072391698231767
Energy: 1.3877595939523597
Energy: 1.3072391698231767
Energy: 1.3117103653893933
Energy: 1.641361352358236
Energy: 1.5105588656124547
Energy: 1.6413613523598052
Energy: 1.5102145366882314
Energy: 1.4109352810533913
Energy: 1.4981343512194816
Energy: 1.4109352810533913
Energy: 1.6431619956668788
Energy: 1.5777175247331647
Energy: 1.333070428361551
Energy: 1.5777175247315953
Energy: 1.3099185455399724
Energy: 1.4545856073895056
Energy: 1.3102724788544136
Energy: 1.4545856073895056
Energy: 1.4658445493422256
Energy: 1.4864330387947553
Energy: 1.5105532925396497
Energy: 1.4864330387947553
Energy: 1.3992673269642757
Energy: 1.4569601431564994
Energy: 1.611410249560374
Energy: 1.4569601431580688
Energy: 1.5107281919479438
Energy: 1.3469930169661122
Energy: 1.4639669503444201
Energy: 1.3469930169676814
Energy: 1.4651158045799253
Energy: 1.4878155611075041
Energy: 1.3097370823045766
Energy: 1.4878155611075041
Energy: 1.4990603475244606
Energy: 1.4604454555887967
Energy: 1.5450333543879726
Energy: 1.4604454555872275
Energy: 1.353259940551658
Energy: 1.4598665039855812
Energy: 1.6468109413217327
Energy: 1.4598665039871506
Energy: 1.309269304509447
Energy: 1.4871709408050002
Energy: 1.3118887948100284
Energy: 1.4871709408050002
Energy: 1.5133789777983673
Energy: 1.431356623198943
Energy: 1.46253733423378
Energy: 1.4313566231973733

minimum gb energy = 1.3072391698231767 eV
minimum distance =  2.29753767943179 Angstroms
sigma value = 17


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

Energy: 1.4639054664680329
Energy: 1.4640226444719293
Energy: 1.6473326438520257
Energy: 1.464022644469263
Energy: 1.5470715712112426
Energy: 1.4499646367249306
Energy: 1.3628492589292085
Energy: 1.4499646367258192
Energy: 1.6373925403340361
Energy: 1.5026226976051107
Energy: 1.3626314594732805
Energy: 1.5026226976024442
Energy: 1.461632123066763
Energy: 1.5998273482929029
Energy: 1.4524903053902307
Energy: 1.5998273482920142
Energy: 1.544024412472923
Energy: 1.5004394841708126
Energy: 1.4501997834510305
Energy: 1.5004394841699238
Energy: 1.3671175055989315
Energy: 1.5104749485507816
Energy: 1.6282445209506706
Energy: 1.5104749485507816
Energy: 1.4507976603022963
Energy: 1.4478874238751254
Energy: 1.451082798182668
Energy: 1.4478874238760142
Energy: 1.6283188346597592
Energy: 1.5111714684655237
Energy: 1.366511810513451
Energy: 1.5111714684664124
Energy: 1.4687523281262171
Energy: 1.5983283278012983
Energy: 1.512373247337551
Energy: 1.5983283278021871
Energy: 1.6054288481552534
Energy: 1.4309577693129656
Energy: 1.465873329204712
Energy: 1.4309577693138544
Energy: 1.3655543257652203
Energy: 1.529526917433857
Energy: 1.6370046758579175
Energy: 1.529526917434746
Energy: 1.4768512166892467
Energy: 1.4476649319600312
Energy: 1.4546329268364662
Energy: 1.4476649319618087
Energy: 1.657052361702216
Energy: 1.4479567101127209
Energy: 1.4657088816110748
Energy: 1.4479567101136097
Energy: 1.3645157108627524
Energy: 1.5541899415584157
Energy: 1.5512619166952364
Energy: 1.5541899415584157
Energy: 1.4633434033121633
Energy: 1.512712471498739
Energy: 1.4765732067387478
Energy: 1.512712471498739
Energy: 1.499511649546968
Energy: 1.4100539027650028
Energy: 1.5079609832257714
Energy: 1.4100539027641141
Energy: 1.4740297144877654
Energy: 1.475487869851042
Energy: 1.638156295745446
Energy: 1.475487869851042
Energy: 1.5930709995309222
Energy: 1.4716397519832907
Energy: 1.3671794565005957
Energy: 1.4716397519841797
Energy: 1.4506135568950531
Energy: 1.4477285473587802
Energy: 1.489617419851742
Energy: 1.4477285473525583
Energy: 1.4505014009372306
Energy: 1.5964912445560588
Energy: 1.4736247241453608
Energy: 1.5964912445560588
Energy: 1.434329176636236
Energy: 1.559391550530328
Energy: 1.4996805924235326
Energy: 1.559391550530328
Energy: 1.4628888495612038
Energy: 1.5852814024285091
Energy: 1.608253116160816
Energy: 1.5852814024302866
Energy: 1.530740524632982
Energy: 1.5561850876750705
Energy: 1.3627580645266433
Energy: 1.5561850876741816
Energy: 1.4529037654926138
Energy: 1.512858894223393
Energy: 1.6612912009879215
Energy: 1.512858894223393
Energy: 1.4530378953458956
Energy: 1.5459680147177859
Energy: 1.6562839853498736
Energy: 1.545968014716897
Energy: 1.5990356128787118
Energy: 1.5552802016618261
Energy: 1.3633298562998788
Energy: 1.5552802016618261
Energy: 1.4222880696310527
Energy: 1.5819751548828243
Energy: 1.6190888838866107
Energy: 1.5819751548819354
Energy: 1.5069850299226077
Energy: 1.410271199128854
Energy: 1.5011625028255782
Energy: 1.4102711991297425
Energy: 1.638643228660778
Energy: 1.600920505267254
Energy: 1.4736341544927594
Energy: 1.600920505267254
Energy: 1.3664460868942552
Energy: 1.5101684247179112
Energy: 1.5937123309305457
Energy: 1.5101684247170226

minimum gb energy = 1.3626314594732805 eV
minimum distance =  2.22109395784474 Angstroms
sigma value = 53


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

Energy: 1.3073498741058338
Energy: 1.3080937847329048
Energy: 1.714882639708082
Energy: 1.308093784734951
Energy: 1.496445256457491
Energy: 1.426522516469256
Energy: 1.4701419994916882
Energy: 1.426522516469256
Energy: 1.3724401070346293
Energy: 1.3270857926008028
Energy: 1.4630339972393327
Energy: 1.3270857925987567
Energy: 1.372480115825214
Energy: 1.3271539942698425
Energy: 1.4695160121005322
Energy: 1.3271539942698425
Energy: 1.4965603117065196
Energy: 1.4265310134513791
Energy: 1.3742399824719997
Energy: 1.4265310134595643
Energy: 1.3073498741058338
Energy: 1.3080937847329048
Energy: 1.738310028650393
Energy: 1.3080937847329048
Energy: 1.4964524996078254
Energy: 1.4265225164672097
Energy: 1.5067763134404362
Energy: 1.426522516469256
Energy: 1.3724413635192692
Energy: 1.3270857926008028
Energy: 1.510120464252821
Energy: 1.3270857926008028
Energy: 1.3724782376056284
Energy: 1.3271539942698425
Energy: 1.5072274354183743
Energy: 1.3271539942698425
Energy: 1.4965558371323422
Energy: 1.4265310134534255
Energy: 1.4783508292700835
Energy: 1.4265310134595643
Energy: 1.3073498741099263
Energy: 1.3080937847329048
Energy: 1.738310028650393
Energy: 1.308093784734951
Energy: 1.496447557312408
Energy: 1.426522516469256
Energy: 1.5067758606728798
Energy: 1.426522516469256
Energy: 1.372440002054368
Energy: 1.3270857926008028
Energy: 1.510120464250775
Energy: 1.3270857925987567

minimum gb energy = 1.3073498741058338 eV
minimum distance =  2.2971121743845 Angstroms
sigma value = 9


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

Energy: 1.417710577340665
Energy: 1.6702787306672606
Energy: 1.7842440941894244
Energy: 1.6702787306687754
Energy: 1.7150496557046722
Energy: 1.4913352061754817
Energy: 1.4475023093920891
Energy: 1.4913352061732097
Energy: 1.4787070812046867
Energy: 1.5787905497994228
Energy: 1.4362143727955639
Energy: 1.5787905497994228
Energy: 1.6044612087013461
Energy: 1.5070796924923537
Energy: 1.4342766116681962
Energy: 1.507079692493111
Energy: 1.7025039598776524
Energy: 1.4790924678941704
Energy: 1.4132336560116208
Energy: 1.4790924678949278
Energy: 1.4042420724438525
Energy: 1.4054525558508304
Energy: 1.6319151645171706
Energy: 1.4054525558508304
Energy: 1.8055072499788467
Energy: 1.609496890439498
Energy: 1.4609016510275206
Energy: 1.6094968904372258
Energy: 1.4654541625892317
Energy: 1.6526232007068735
Energy: 1.5871967665824986
Energy: 1.6526232007068735
Energy: 1.4690283940625124
Energy: 1.6017608572878137
Energy: 1.4078271160451306
Energy: 1.6017608572847841
Energy: 1.4056149366751411
Energy: 1.4828923671189498
Energy: 1.4040173073891014
Energy: 1.482892367117435
Energy: 1.4308754368561551
Energy: 1.5485239226253555
Energy: 1.8016749728128418
Energy: 1.5485239226283847
Energy: 1.6222356490703755
Energy: 1.7233940569916277
Energy: 1.4740234117141893
Energy: 1.7233940569923851
Energy: 1.4517643829723754
Energy: 1.6898091594933458
Energy: 1.7096258757465927
Energy: 1.6898091594903164
Energy: 1.607363537334357
Energy: 1.6730133977979929
Energy: 1.4175797344392336
Energy: 1.6730133977964783
Energy: 1.4471384966155796
Energy: 1.543482804697155
Energy: 1.6071711410967913
Energy: 1.5434828046986695
Energy: 1.450448784820229
Energy: 1.6865149022315231
Energy: 1.6037038917553743
Energy: 1.6865149022315231
Energy: 1.5355811302495572
Energy: 1.4421472969950635
Energy: 1.4737764732042307
Energy: 1.4421472969927915
Energy: 1.432547941573139
Energy: 1.484355163047115
Energy: 1.6992593895277217
Energy: 1.4843551630478724
Energy: 1.6829507410715923
Energy: 1.5406332381818186
Energy: 1.4062152514723287
Energy: 1.5406332381818186
Energy: 1.4520369727938662
Energy: 1.5132607253171644
Energy: 1.547351648036702
Energy: 1.5132607253156496
Energy: 1.6042146280770617
Energy: 1.6585311272710226
Energy: 1.5993068387883675
Energy: 1.658531127269508
Energy: 1.5361556644059922
Energy: 1.5868992464481149
Energy: 1.4478700388895447
Energy: 1.5868992464466005
Energy: 1.4081701340394892
Energy: 1.5401817475593955
Energy: 1.4645806141750826
Energy: 1.5401817475586381
Energy: 1.802974168640421
Energy: 1.6012072399122046
Energy: 1.4310350920301669
Energy: 1.6012072399091752
Energy: 1.4677236119159036
Energy: 1.7618634123746701
Energy: 1.7329633836597642
Energy: 1.7618634123754278
Energy: 1.5047556501347523
Energy: 1.5465996543452116
Energy: 1.4341978816967105
Energy: 1.5465996543467262
Energy: 1.4956114314008468
Energy: 1.5415884020866437
Energy: 1.6102249088933713
Energy: 1.5415884020874009
Energy: 1.4142516429796976
Energy: 1.6451450616127532
Energy: 1.6075882677076478
Energy: 1.6451450616157826
Energy: 1.4983833366280754
Energy: 1.5484113414514529
Energy: 1.4329680055309761
Energy: 1.5484113414514529
Energy: 1.4655508819691865
Energy: 1.7660879953161743
Energy: 1.7291349156773166
Energy: 1.7660879953184465
Energy: 1.7179088805124278
Energy: 1.5499498582528373
Energy: 1.4309649462842782
Energy: 1.5499498582551092
Energy: 1.4053415227412869
Energy: 1.4800528254395586
Energy: 1.4064629346093538
Energy: 1.4800528254403158
Energy: 1.4041504552382966
Energy: 1.5801801865511333
Energy: 1.4468238660566377
Energy: 1.5801801865518907
Energy: 1.6000290573040783
Energy: 1.6569984805935576
Energy: 1.5977775579176317
Energy: 1.6569984805928002
Energy: 1.454564636798207
Energy: 1.646709556677227
Energy: 1.8054471139163546
Energy: 1.6467095566764693

minimum gb energy = 1.4040173073891014 eV
minimum distance =  2.20139992175902 Angstroms
sigma value = 73


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

Energy: 1.497415325662233
Energy: 1.5457506170209696
Energy: 1.8445036908566654
Energy: 1.5457506170209696
Energy: 1.5135405432794045
Energy: 1.6261418988508567
Energy: 1.4461422041979919
Energy: 1.6261418988484535
Energy: 1.4809764270384196
Energy: 1.5199321811242674
Energy: 1.4327975436925209
Energy: 1.5199321811266706
Energy: 1.5355216992469238
Energy: 1.6355802172025093
Energy: 1.4462459072609943
Energy: 1.635580217201308
Energy: 1.492048727266134
Energy: 1.5265563621904636
Energy: 1.4235223197007498
Energy: 1.5265563621892622
Energy: 1.4422224667327768
Energy: 1.4637203253511548
Energy: 1.7504035565195173
Energy: 1.4637203253511548
Energy: 1.7995018881851343
Energy: 1.6604681508588774
Energy: 1.4746751021683495
Energy: 1.6604681508612806
Energy: 1.447632132224198
Energy: 1.5948360330874296
Energy: 1.6958400799289075
Energy: 1.5948360330910347
Energy: 1.796044350818165
Energy: 1.401585496105438
Energy: 1.4010180650414619
Energy: 1.401585496105438
Energy: 1.4452885057461402
Energy: 1.485589583873267
Energy: 1.4011940161204879
Energy: 1.485589583873267
Energy: 1.4452473402863897
Energy: 1.5195014046841706
Energy: 1.712901259068617
Energy: 1.5195014046817674
Energy: 1.5906588217380233
Energy: 1.6136568606808677
Energy: 1.4713351389971459
Energy: 1.6136568606820691
Energy: 1.4435318031960283
Energy: 1.5415164896513098
Energy: 1.6645933223058065
Energy: 1.5415164896501083
Energy: 1.7636894316280416
Energy: 1.5850519607622289
Energy: 1.4483413410282469
Energy: 1.5850519607622289
Energy: 1.439625193606288
Energy: 1.6152673299776255
Energy: 1.676230098578481
Energy: 1.615267329976424
Energy: 1.717393012266243
Energy: 1.595095549316008
Energy: 1.4431093302628426
Energy: 1.5950955493136048
Energy: 1.4985127401499978
Energy: 1.4995639723698548
Energy: 1.464883842245302
Energy: 1.4995639723674514
Energy: 1.4938517284050299
Energy: 1.4959492211999559
Energy: 1.446091705474659
Energy: 1.4959492211999559
Energy: 1.4521144780843411
Energy: 1.5202848891133207
Energy: 1.4405222585251654
Energy: 1.520284889112119
Energy: 1.4826061175873517
Energy: 1.5613919545548578
Energy: 1.7728093861216327
Energy: 1.5613919545524544
Energy: 1.7245734284884149
Energy: 1.4961612662677017
Energy: 1.4478417061444104
Energy: 1.4961612662677017
Energy: 1.4463077011006418
Energy: 1.5268828030139385
Energy: 1.5333958410368826
Energy: 1.5268828030127366

minimum gb energy = 1.4010180650414619 eV
minimum distance =  2.20476497016782 Angstroms
sigma value = 7


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

Energy: 1.4372430865278518
Energy: 1.4371268168518108
Energy: 1.8818559505463752
Energy: 1.4371268168450133
Energy: 1.7568582253483105
Energy: 1.7016064788372114
Energy: 1.463874945607327
Energy: 1.7016064788406102
Energy: 1.4527965684583588
Energy: 1.634990615261237
Energy: 1.4996923978450336
Energy: 1.634990615261237
Energy: 1.5273282082997375
Energy: 1.5488366350631082
Energy: 1.4182341078714809
Energy: 1.5488366350597096
Energy: 1.4130159754037204
Energy: 1.5051811189720263
Energy: 1.429743296132234
Energy: 1.5051811189694773
Energy: 1.4150469556691294
Energy: 1.5795213309211342
Energy: 1.7708735743246506
Energy: 1.5795213309270821
Energy: 1.5819427941295736
Energy: 1.716573078579492
Energy: 1.5259743232855476
Energy: 1.7165730785743936
Energy: 1.4149777593531045
Energy: 1.5802011456542222
Energy: 1.8699282587872674
Energy: 1.5802011456576208
Energy: 1.6028214640282676
Energy: 1.5279905331778791
Energy: 1.4213163153071486
Energy: 1.5279905331753298
Energy: 1.4624981495405822
Energy: 1.5302682841823736
Energy: 1.550781866704131
Energy: 1.5302682841849224
Energy: 1.5190196181489248
Energy: 1.6358554231557607
Energy: 1.4667062384292457
Energy: 1.6358554231600089
Energy: 1.435134149108239
Energy: 1.5055384069027555
Energy: 1.4775599132537642
Energy: 1.505538406901906
Energy: 1.4357831783295651
Energy: 1.4380144815471756
Energy: 1.5142807802828495
Energy: 1.4380144815505744
Energy: 1.503483907550541
Energy: 1.5897848535082408
Energy: 1.4621400013490118
Energy: 1.5897848535158492
Energy: 1.4591523736152432
Energy: 1.6691259087736334
Energy: 1.5810186999432925
Energy: 1.6691259087643258
Energy: 1.8814240903646269
Energy: 1.4302160796817902
Energy: 1.41861260981265
Energy: 1.4302160796851888
Energy: 1.4124046372163024
Energy: 1.52714104654755
Energy: 1.4778891572187358
Energy: 1.5271410465492494
Energy: 1.4230697498371603
Energy: 1.6355450470903874
Energy: 1.5189050557981427
Energy: 1.6355450470954855
Energy: 1.4175036529152414
Energy: 1.5918293608668812
Energy: 1.5193148572731736
Energy: 1.5918293608753777
Energy: 1.4125284206883468
Energy: 1.5359521464805326
Energy: 1.4292299794900396
Energy: 1.5359521464788335
Energy: 1.5275864895504643
Energy: 1.5313906478293104
Energy: 1.4213910231036635
Energy: 1.5313906478242125
Energy: 1.453919961484054
Energy: 1.6397767667718757
Energy: 1.6254734959882544
Energy: 1.6397767667710261
Energy: 1.763782300450561
Energy: 1.6276781381064307
Energy: 1.4545410974740884
Energy: 1.6276781381072802
Energy: 1.441038389796052
Energy: 1.4380765690939123
Energy: 1.7189217595759407
Energy: 1.438076569097311
Energy: 1.4352695460601141
Energy: 1.5066722112499236
Energy: 1.4784720313134236
Energy: 1.5066722112566826
Energy: 1.5187768432156759
Energy: 1.6361519913468738
Energy: 1.506486048623995
Energy: 1.6361519913460243
Energy: 1.4529450379382982
Energy: 1.5430473391274906
Energy: 1.5564069524742912
Energy: 1.5430473391308894
Energy: 1.5112454906724946
Energy: 1.5130136746178713
Energy: 1.4179558271399904
Energy: 1.513013674616172
Energy: 1.4115525621391003
Energy: 1.5796101888659062
Energy: 1.708040329601035
Energy: 1.5796101888548606
Energy: 1.6727749764632498
Energy: 1.8547893102367445
Energy: 1.4633672295202762
Energy: 1.8547893102375943
Energy: 1.411547231106501
Energy: 1.579566557654207
Energy: 1.7606484745407776
Energy: 1.5795665576508084

minimum gb energy = 1.411547231106501 eV
minimum distance =  2.1796276531071 Angstroms
sigma value = 29


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

Energy: 1.3845692511825385
Energy: 1.5523758603916789
Energy: 1.7225511410243917
Energy: 1.5523758603914155
Energy: 1.4217736388388278
Energy: 1.4556816618808628
Energy: 1.3843028717459716
Energy: 1.455681661880008
Energy: 1.3157681663921539
Energy: 1.4559227376314623
Energy: 1.3164523558073544
Energy: 1.4559227376314623
Energy: 1.3827631025975937
Energy: 1.4835130217451764
Energy: 1.384006328646833
Energy: 1.4835130217457682
Energy: 1.3850879042800261
Energy: 1.4834127593405941
Energy: 1.3901360773747011
Energy: 1.483412759339706
Energy: 1.3979440879140916
Energy: 1.5233036497232637
Energy: 1.3979614754793204
Energy: 1.5233036497232637
Energy: 1.3435660783215755
Energy: 1.4835887898370426
Energy: 1.3843529550785523
Energy: 1.4835887898370426
Energy: 1.3844347891348268
Energy: 1.4835414929803374
Energy: 1.3827962588896028
Energy: 1.4835414929797786
Energy: 1.3168055924434883
Energy: 1.4558939172440157
Energy: 1.4207820108955256
Energy: 1.4558939172437197

minimum gb energy = 1.3157681663921539 eV
minimum distance =  2.22394617920418 Angstroms
sigma value = 5


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

Energy: 1.4243437217794421
Energy: 1.5264893442414322
Energy: 1.4429996611204894
Energy: 1.5264893442470506
Energy: 1.4905359962349534
Energy: 1.7289912482997618
Energy: 1.3732409866244772
Energy: 1.7289912482941432
Energy: 1.357797684974766
Energy: 1.516844993969089
Energy: 1.6051054597693442
Energy: 1.5168449939642734
Energy: 1.354327439585997
Energy: 1.5684292248438323
Energy: 1.382855595928569
Energy: 1.5684292248446348
Energy: 1.4006106866422443
Energy: 1.649216771454379
Energy: 1.7149184140246398
Energy: 1.649216771451169
Energy: 1.4421745561200479
Energy: 1.5262985439808514
Energy: 1.3667332892848751
Energy: 1.5262985439888774
Energy: 1.3588658029984106
Energy: 1.4861700637137192
Energy: 1.353899470059338
Energy: 1.486170063709706
Energy: 1.354275363144438
Energy: 1.4599713050306384
Energy: 1.3868697951665347
Energy: 1.4599713050242176
Energy: 1.379566384020726
Energy: 1.4707445633098402
Energy: 1.4027578718882767
Energy: 1.4707445633130507
Energy: 1.3901437665030363
Energy: 1.4763943547117624
Energy: 1.3576537790670877
Energy: 1.4763943547069467
Energy: 1.3835957478559495
Energy: 1.609662228783542
Energy: 1.3639695880111284
Energy: 1.6096622287907654
Energy: 1.392007637627314
Energy: 1.400865002550437
Energy: 1.5068404934803539
Energy: 1.4008650025520424
Energy: 1.4801111744410334
Energy: 1.3867568330060926
Energy: 1.3947120911380744
Energy: 1.3867568330076978
Energy: 1.3894905391501489
Energy: 1.5266713105332324
Energy: 1.5850689525844108
Energy: 1.5266713105324299
Energy: 1.480858911904531
Energy: 1.754335143239981
Energy: 1.3637319311724319
Energy: 1.7543351432423888
Energy: 1.3780707670288734
Energy: 1.5141893317949588
Energy: 1.6306324007762485
Energy: 1.5141893317901436
Energy: 1.4968112417149804
Energy: 1.3618671879066904
Energy: 1.4058802086076432
Energy: 1.361867187907493
Energy: 1.3946173486115256
Energy: 1.5264484323221692
Energy: 1.4522017631841753
Energy: 1.5264484323221692
Energy: 1.3616941750310247
Energy: 1.4845997725267603
Energy: 1.3576957935032175
Energy: 1.4845997725275628
Energy: 1.3876366741499169
Energy: 1.5054209809711336
Energy: 1.3863348746224864
Energy: 1.5054209809655152
Energy: 1.39090687991346
Energy: 1.5611608437905962
Energy: 1.3811786260771144
Energy: 1.5611608437849778
Energy: 1.389332188814941
Energy: 1.4757933976057003
Energy: 1.3873962640022586
Energy: 1.4757933976105162
Energy: 1.3601643840887652
Energy: 1.6036044376801113
Energy: 1.3557313730052005
Energy: 1.603604437674493
Energy: 1.5061026818387617
Energy: 1.5327974314702824
Energy: 1.3873609851593212
Energy: 1.5327974314646644
Energy: 1.508152422541104
Energy: 1.5237604951296668
Energy: 1.3763607745279687
Energy: 1.5237604951232462
Energy: 1.3919772264918655
Energy: 1.576303232162345
Energy: 1.3832130471125934
Energy: 1.5763032321615424
Energy: 1.3656728185276674
Energy: 1.3470005137475212
Energy: 1.4744843908536045
Energy: 1.3470005137419032
Energy: 1.4104115629535225
Energy: 1.431976738296544
Energy: 1.3779296949886966
Energy: 1.4319767382917286
Energy: 1.362647391848808
Energy: 1.8059806543501906
Energy: 1.521514057086311
Energy: 1.8059806543493884
Energy: 1.553655805377172
Energy: 1.5274425805999363
Energy: 1.3948078812269062
Energy: 1.5274425805951206
Energy: 1.362697989206566
Energy: 1.3782756353414367
Energy: 1.505322205403439
Energy: 1.3782756353462522
Energy: 1.493000145449355
Energy: 1.4119700114218614
Energy: 1.3865074001566862
Energy: 1.4119700114178482
Energy: 1.379652527065613
Energy: 1.5639705740181002
Energy: 1.3894978720443203
Energy: 1.5639705740140872

minimum gb energy = 1.3470005137419032 eV
minimum distance =  2.18726232745221 Angstroms
sigma value = 1


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

Energy: 1.3372685186497786
Energy: 1.3378931391789228
Energy: 1.386808203975173
Energy: 1.337893139175594
Energy: 1.372255550514904
Energy: 1.618939734780504
Energy: 1.349783200523829
Energy: 1.6189397347793943
Energy: 1.291492689536101
Energy: 1.536616469978185
Energy: 1.7747694227687154
Energy: 1.5366164699748557
Energy: 1.395071973783499
Energy: 1.4387701648595257
Energy: 1.327325950469462
Energy: 1.438770164858416
Energy: 1.3134337025006695
Energy: 1.6340578824173457
Energy: 1.4690008480400805
Energy: 1.6340578824129068
Energy: 1.3119346681712343
Energy: 1.4024195168696512
Energy: 1.3273621989076432
Energy: 1.4024195168696512
Energy: 1.2920641198029885
Energy: 1.475943735185377
Energy: 1.3081872217435826
Energy: 1.4759437351842675
Energy: 1.2922759590910051
Energy: 1.5416774249726484
Energy: 1.332295427845207
Energy: 1.5416774249770873
Energy: 1.3509010073663812
Energy: 1.3495439319720128
Energy: 1.383607892943985
Energy: 1.349543931967574
Energy: 1.3507154867479862
Energy: 1.3495331270223767
Energy: 1.3210789580725582
Energy: 1.349533127021267
Energy: 1.292024257682908
Energy: 1.541539583145843
Energy: 1.361778275344877
Energy: 1.541539583149172
Energy: 1.2921405971703297
Energy: 1.4758757107097116
Energy: 1.3089412005169665
Energy: 1.4758757107041627
Energy: 1.3120050231731601
Energy: 1.402433049116616
Energy: 1.327414373784639
Energy: 1.4024330491199453
Energy: 1.3134580653709986
Energy: 1.6339551170024194
Energy: 1.3491894055538993
Energy: 1.63395511699909
Energy: 1.3951005252663211
Energy: 1.438754865532736
Energy: 1.327365667637863
Energy: 1.438754865532736
Energy: 1.291503073393116
Energy: 1.5366388582218211
Energy: 1.397082557109479
Energy: 1.5366388582262602
Energy: 1.3720486251448338
Energy: 1.618855701838875
Energy: 1.3500669826359262
Energy: 1.618855701832217
Energy: 1.3372685186508881
Energy: 1.3378931391789228
Energy: 1.433068372423839
Energy: 1.337893139175594
Energy: 1.3722555505126846
Energy: 1.618939734780504
Energy: 1.3497832005249386
Energy: 1.6189397347793943
Energy: 1.291492689536101
Energy: 1.5366164699792946
Energy: 1.7747694227698252
Energy: 1.5366164699748557
Energy: 1.3950719737823891
Energy: 1.438770164858416
Energy: 1.3273259504683523
Energy: 1.438770164858416
Energy: 1.3134337025039988
Energy: 1.6340578824173457
Energy: 1.469000921786605
Energy: 1.6340578824129068
Energy: 1.3119346681690147
Energy: 1.4024195168696512
Energy: 1.3273621989076432
Energy: 1.4024195168696512
Energy: 1.2920641198240739
Energy: 1.4759437351842675
Energy: 1.3081872217402533
Energy: 1.4759437351842675

minimum gb energy = 1.291492689536101 eV
minimum distance =  2.1984841173866 Angstroms
sigma value = 17


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

Energy: 1.3460668709162844
Energy: 1.3328438600311805
Energy: 1.5916682722242614
Energy: 1.3328438600359818
Energy: 1.404568851868576
Energy: 1.5452901495394369
Energy: 1.311486131486508
Energy: 1.5452901495401228
Energy: 1.3150026881782961
Energy: 1.447409239666726
Energy: 1.6184118558195169
Energy: 1.447409239665354
Energy: 1.335711763458653
Energy: 1.4946648034230243
Energy: 1.3133086799950635
Energy: 1.4946648034257677
Energy: 1.3016568666693917
Energy: 1.5812924980703722
Energy: 1.3945858315672943
Energy: 1.5812924980690004
Energy: 1.3162714336152572
Energy: 1.6881542874388968
Energy: 1.3320690225790368
Energy: 1.688154287436153
Energy: 1.3201247521775645
Energy: 1.3972887415431448
Energy: 1.3217815603455332
Energy: 1.3972887415431448
Energy: 1.2914173390957342
Energy: 1.5268769508552542
Energy: 1.3002769666339127
Energy: 1.52687695085594
Energy: 1.3385972598945457
Energy: 1.519877282464147
Energy: 1.3440210982809293
Energy: 1.5198772824655187
Energy: 1.3205558058967202
Energy: 1.5349411807467765
Energy: 1.313232533870591
Energy: 1.5349411807474624
Energy: 1.312370889297905
Energy: 1.508969037495845
Energy: 1.3026453894590304
Energy: 1.508969037496531
Energy: 1.3069688005314504
Energy: 1.398618672130311
Energy: 1.2851854207293836
Energy: 1.3986186721296252
Energy: 1.2986235271004503
Energy: 1.7179803216380782
Energy: 1.3155317092827647
Energy: 1.7179803216367064
Energy: 1.3192057892231945
Energy: 1.4251791765939843
Energy: 1.3408111188165202
Energy: 1.4251791765926127
Energy: 1.3106040934942276
Energy: 1.7293784537778405
Energy: 1.347934050869623
Energy: 1.7293784537771546
Energy: 1.324231190296429
Energy: 1.4464544990608974
Energy: 1.396872029023117
Energy: 1.4464544990608974
Energy: 1.3082003097546613
Energy: 1.500355259941574
Energy: 1.309391868396631
Energy: 1.500355259941574
Energy: 1.2950259154367232
Energy: 1.462891346645696
Energy: 1.3136620786136999
Energy: 1.4628913466450102
Energy: 1.5279560149616467
Energy: 1.6910313276695679
Energy: 1.312395203201255
Energy: 1.691031327671626
Energy: 1.3364569661096795
Energy: 1.313481410608522
Energy: 1.4521319641990578
Energy: 1.3134814106092079
Energy: 1.3972246424830363
Energy: 1.3134177272758234
Energy: 1.3233289746984114
Energy: 1.3134177272758234
Energy: 1.3154427436023775
Energy: 1.4622881951968647
Energy: 1.5880453420119274
Energy: 1.4622881951975506
Energy: 1.5703781293671504
Energy: 1.5110299406240948
Energy: 1.3384112041343
Energy: 1.5110299406247805
Energy: 1.311646279169652
Energy: 1.5567318938216679
Energy: 1.5291803584822348
Energy: 1.5567318938209822
Energy: 1.3741621443128558
Energy: 1.46437951574826
Energy: 1.2968345479815429
Energy: 1.4643795157496318
Energy: 1.3129249150658557
Energy: 1.4242060902937577
Energy: 1.3067589370487356
Energy: 1.424206090292386
Energy: 1.5289424529930353
Energy: 1.557973498763233
Energy: 1.3187937800101732
Energy: 1.5579734987639189
Energy: 1.3515397823567932
Energy: 1.5001173402167782
Energy: 1.310085063414743
Energy: 1.5001173402167782
Energy: 1.3398375981698132
Energy: 1.4247981399854552
Energy: 1.3103648527561127
Energy: 1.4247981399861411
Energy: 1.312762378547998
Energy: 1.719332364036559
Energy: 1.3393799085930904
Energy: 1.719332364036559
Energy: 1.2845202834955933
Energy: 1.4198398194042443
Energy: 1.3067136299904327
Energy: 1.4198398194035586
Energy: 1.3022816682199854
Energy: 1.680847069114566
Energy: 1.3093771022876695
Energy: 1.6808470691131943
Energy: 1.3100333952298187
Energy: 1.5333429924005124
Energy: 1.5365911644176056
Energy: 1.5333429924005124
Energy: 1.345910023822596
Energy: 1.5194611740880188
Energy: 1.3384170582952326
Energy: 1.5194611740880188
Energy: 1.2985673994981108
Energy: 1.462686556048142
Energy: 1.3303124802552546
Energy: 1.4626865560453983
Energy: 1.3226759333670766
Energy: 1.399090381451067
Energy: 1.3285105403636406
Energy: 1.399090381449695
Energy: 1.338712631676055
Energy: 1.6876974787964751
Energy: 1.3149732331297945
Energy: 1.6876974787964751
Energy: 1.3958348693836569
Energy: 1.5547712979951647
Energy: 1.320344944759934
Energy: 1.554771297994479

minimum gb energy = 1.2845202834955933 eV
minimum distance =  2.18760943247692 Angstroms
sigma value = 89


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

Energy: 1.4267837659402645
Energy: 1.4462911731332424
Energy: 1.2505270422273866
Energy: 1.4462911731332424
Energy: 1.4265711073649394
Energy: 1.236882369918721
Energy: 1.2399889925030505
Energy: 1.236882369918721
Energy: 1.2746437234691448
Energy: 1.4739551787749943
Energy: 1.676275862803311
Energy: 1.4739551787731997
Energy: 1.256151609234476
Energy: 1.28874062997108
Energy: 1.277037251172902
Energy: 1.2887406299728748
Energy: 1.2357334691107509
Energy: 1.186868456928695
Energy: 1.387573065575205
Energy: 1.186868456928695
Energy: 1.204885482281072
Energy: 1.1889195164906858
Energy: 1.188678725932189
Energy: 1.1889195164906858
Energy: 1.2420425533326014
Energy: 1.436652911292362
Energy: 1.1872223491167249
Energy: 1.4366529112905673
Energy: 1.220555717818036
Energy: 1.3029441309500684
Energy: 1.2770926891066996
Energy: 1.302944130946479
Energy: 1.2750341399713356
Energy: 1.3128249189632546
Energy: 1.4378462909412022
Energy: 1.3128249189650494
Energy: 1.327322861320022
Energy: 1.1866163320315273
Energy: 1.235854314487984
Energy: 1.1866163320315273
Energy: 1.4736167169902756
Energy: 1.4723668490565927
Energy: 1.2060433752285975
Energy: 1.4723668490530033
Energy: 1.426222582069501
Energy: 1.434082852747832
Energy: 1.2397404703810606
Energy: 1.434082852747832
Energy: 1.2749688639114904
Energy: 1.426368315284011
Energy: 1.2205568406084932
Energy: 1.4263683152822164
Energy: 1.2471965643066858
Energy: 1.3133619769219658
Energy: 1.2747264436741141
Energy: 1.3133619769219658
Energy: 1.177755873497852
Energy: 1.5835030794102376
Energy: 1.246854673548321
Energy: 1.5835030794120324

minimum gb energy = 1.177755873497852 eV
minimum distance =  2.20640081080016 Angstroms
sigma value = 13


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

Energy: 1.2140697302122176
Energy: 1.1579816235644818
Energy: 1.4895316793687687
Energy: 1.1579816235652338
Energy: 1.2590944866992297
Energy: 1.374068457013993
Energy: 1.1635940207150834
Energy: 1.3740684570170019
Energy: 1.1737214792592825
Energy: 1.6455061866864886
Energy: 1.623864986277817
Energy: 1.645506186680471
Energy: 1.1594786109950108
Energy: 1.3745117297402596
Energy: 1.1501358753421604
Energy: 1.374511729731985
Energy: 1.183307676798184
Energy: 1.6092513374329815
Energy: 1.2243299564275165
Energy: 1.6092513374292203
Energy: 1.142442733869886
Energy: 1.4234582674449292
Energy: 1.1752981891264491
Energy: 1.4234582674479381
Energy: 1.1833477005344368
Energy: 1.6991945273969982
Energy: 1.324971688152073
Energy: 1.6991945273894762
Energy: 1.1395567647220617
Energy: 1.6535403950929037
Energy: 1.1753681854130675
Energy: 1.6535403951109573
Energy: 1.182681609065747
Energy: 1.4382315169098276
Energy: 1.3507022514369087
Energy: 1.4382315169188544
Energy: 1.366765996559131
Energy: 1.6201730587972427
Energy: 1.1500288182998866
Energy: 1.620173058791977
Energy: 1.1826201212342995
Energy: 1.277116631419076
Energy: 1.136354345955439
Energy: 1.2771166314123745
Energy: 1.2384138548613575
Energy: 1.6202743344893877
Energy: 1.15805685178762
Energy: 1.6202743344901398
Energy: 1.2163113446697997
Energy: 1.176525640935619
Energy: 1.1770039991996277
Energy: 1.176525640935619
Energy: 1.556664370647895
Energy: 1.6613056403507969
Energy: 1.1573244815242059
Energy: 1.6613056403485402
Energy: 1.182679531281039
Energy: 1.1564074049013624
Energy: 1.150125818610534
Energy: 1.1564074048915836
Energy: 1.143487723954226
Energy: 1.4627958338821725
Energy: 1.1697834133742822
Energy: 1.4627958338829248
Energy: 1.171266190831766
Energy: 1.2404572890056293
Energy: 1.1578118558084374
Energy: 1.240457289004125
Energy: 1.1739831487479995
Energy: 1.2543216644188881
Energy: 1.1645499064771958
Energy: 1.2543216644128705
Energy: 1.1567388845079118
Energy: 1.1768358959073568
Energy: 1.1649341802188653
Energy: 1.1768358959148792
Energy: 1.156720617009326
Energy: 1.1770052106497157
Energy: 1.16397897020368
Energy: 1.1770052106452022
Energy: 1.1741184971990979
Energy: 1.254669607575318
Energy: 1.1654531985904
Energy: 1.2546696075662913
Energy: 1.171151364409362
Energy: 1.24024631386504
Energy: 1.157842363788838
Energy: 1.2402463138612787
Energy: 1.1435730635533594
Energy: 1.4628430716269205
Energy: 1.1697983130272245
Energy: 1.4628430716299297
Energy: 1.1826591457663331
Energy: 1.1587009756434392
Energy: 1.144878126079916
Energy: 1.1587009756479525
Energy: 1.5575255587221015
Energy: 1.66131885311924
Energy: 1.1580962209334562
Energy: 1.6613188531342846
Energy: 1.2164224167848163
Energy: 1.1766608337018167
Energy: 1.1769955710771456
Energy: 1.1766608337040734
Energy: 1.5355282537695918
Energy: 1.6202987254526062
Energy: 1.1576091014107364
Energy: 1.6202987254616328
Energy: 1.1826467700810417
Energy: 1.2770906987816741
Energy: 1.1392545367267568
Energy: 1.277090698791453
Energy: 1.3667855042524795
Energy: 1.6200878606519538
Energy: 1.150074810785078
Energy: 1.6200878606399183
Energy: 1.1826838987955026
Energy: 1.437776367254913
Energy: 1.451050066812813
Energy: 1.4377763672488955
Energy: 1.1397893955056504
Energy: 1.6531254894306835
Energy: 1.1754047509520462
Energy: 1.6531254894254177
Energy: 1.1833368066804069
Energy: 1.6995232458940746
Energy: 1.4083977641899248
Energy: 1.6995232458918177
Energy: 1.1415199040590935
Energy: 1.4228645297485238
Energy: 1.1752958972981933
Energy: 1.4228645297507807
Energy: 1.1833109459477051
Energy: 1.6091588177430736
Energy: 1.2265222203777646
Energy: 1.6091588177505955
Energy: 1.1593072050376647
Energy: 1.3749944069286049
Energy: 1.1501712015404244
Energy: 1.3749944069301092

minimum gb energy = 1.136354345955439 eV
minimum distance =  2.16505416765247 Angstroms
sigma value = 37


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

Energy: 1.1068857625294761
Energy: 1.107008825263851
Energy: 1.520099870018387
Energy: 1.107008825262557
Energy: 1.1848077186350034
Energy: 1.4297048272971096
Energy: 1.0515995800098525
Energy: 1.4297048272971096
Energy: 1.0845999607517036
Energy: 1.4575051630466362
Energy: 1.6691533918656791
Energy: 1.4575051630479303
Energy: 1.0402797640665364
Energy: 1.4450379546203982
Energy: 1.0520514906605707
Energy: 1.4450379546216923
Energy: 1.0501844520108603
Energy: 1.4448025314439563
Energy: 1.0404886343325885
Energy: 1.444802531442662
Energy: 1.0361144110416165
Energy: 1.4295588676775408
Energy: 1.0435839160089622
Energy: 1.4295588676775408
Energy: 1.1143900179146422
Energy: 1.7453660487202516
Energy: 1.1834517379026521
Energy: 1.7453660487202516
Energy: 1.049548412417351
Energy: 1.1074096033357548
Energy: 1.1218699060248976
Energy: 1.1074096033344605
Energy: 1.049922219119679
Energy: 1.428388737298142
Energy: 1.184222326347992
Energy: 1.428388737298142
Energy: 1.3615245939408003
Energy: 1.4595277632895016
Energy: 1.043041139971421
Energy: 1.4595277632882075
Energy: 1.0987214738966615
Energy: 1.7406938725128638
Energy: 1.0404958433631744
Energy: 1.7406938725115697
Energy: 1.4442892241688912
Energy: 1.4086759999144312
Energy: 1.0517382335762089
Energy: 1.4086759999131369
Energy: 1.041585261611542
Energy: 1.4280227614396366
Energy: 1.057913638189916
Energy: 1.4280227614383425
Energy: 1.3989391907733884
Energy: 1.7477178854124864
Energy: 1.0500353963167464
Energy: 1.747717885411192
Energy: 1.1243725002104432
Energy: 1.1778185806773798
Energy: 1.049587000752078
Energy: 1.177818580678674
Energy: 1.122101640855553
Energy: 1.4281834235521957
Energy: 1.0512891575425667
Energy: 1.42818342355349
Energy: 1.0416556266782158
Energy: 1.4600180150600548
Energy: 1.0544398771810644
Energy: 1.4600180150587607
Energy: 1.0402831494044396
Energy: 1.7371261058211693
Energy: 1.0498478039025634
Energy: 1.7371261058224636
Energy: 1.049485264391268
Energy: 1.4194164992905387
Energy: 1.0498224589812322
Energy: 1.4194164992905387
Energy: 1.049503963193708
Energy: 1.4280582907524435
Energy: 1.0405283139904
Energy: 1.4280582907524435

minimum gb energy = 1.0361144110416165 eV
minimum distance =  2.19480793991254 Angstroms
sigma value = 25


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

Energy: 1.1793319889502487
Energy: 1.2683181634717156
Energy: 0.9495406537519413
Energy: 1.2683181634798002
Energy: 1.399989075942625
Energy: 1.4994552848734233
Energy: 0.9810563802467124
Energy: 1.4994552848714022
Energy: 1.096232396308949
Energy: 1.098707763113838
Energy: 1.1575996766128054
Energy: 1.0987077631108064
Energy: 1.1637016923616323
Energy: 1.37143263269152
Energy: 0.9835693640315645
Energy: 1.3714326326905093
Energy: 0.9912309971968478
Energy: 1.5009446327119105
Energy: 1.0483144284951822
Energy: 1.500944632712921
Energy: 1.060933136640789
Energy: 1.5113903505270045
Energy: 1.0010199254428502
Energy: 1.511390350522962
Energy: 0.9821703530842826
Energy: 1.2089311725345988
Energy: 1.165161625899611
Energy: 1.2089311725295457
Energy: 0.9460605777995512
Energy: 1.38352579962194
Energy: 1.1062908239773253
Energy: 1.38352579962194
Energy: 0.9707499345824073
Energy: 1.4702499477871438
Energy: 1.4215733963041264
Energy: 1.4702499477861333
Energy: 0.9380020656370445
Energy: 1.5072947438275004
Energy: 1.048787740690844
Energy: 1.5072947438285111
Energy: 0.9823630360276467
Energy: 0.9658559387437318
Energy: 1.448337557723903
Energy: 0.9658559387447425
Energy: 1.157724793787323
Energy: 1.5375561320127658
Energy: 1.1063548919309079
Energy: 1.5375561320178186
Energy: 0.9857449896533331
Energy: 1.3730750747541076
Energy: 1.3176499734099305
Energy: 1.3730750747561287
Energy: 1.2406926728854808
Energy: 1.5031710405547207
Energy: 1.0010270185704424
Energy: 1.5031710405557313
Energy: 1.0035276343205
Energy: 1.0884095092233
Energy: 1.0607153437293166
Energy: 1.0884095092233
Energy: 1.1663905236518668
Energy: 1.3396545298210973
Energy: 0.9701610226190045
Energy: 1.3396545298180655
Energy: 1.112741921994944
Energy: 1.3821387570635741
Energy: 0.9395544572363631
Energy: 1.3821387570615533
Energy: 1.3693312648123408
Energy: 1.4904759828662688
Energy: 0.9727539290132432
Energy: 1.4904759828622265
Energy: 1.1827450253821177
Energy: 1.2867665532775665
Energy: 0.9377989683401105
Energy: 1.2867665532745347
Energy: 1.6133598699282286
Energy: 1.3384263005775598
Energy: 0.9702425251726977
Energy: 1.3384263005735173
Energy: 1.1127947195056413
Energy: 1.5368418475305503
Energy: 0.9499587771412091
Energy: 1.5368418475295398
Energy: 1.0959672343472522
Energy: 1.4015564970493515
Energy: 0.9865952047265466
Energy: 1.4015564970503624
Energy: 1.0033891621985946
Energy: 1.5001942821139205
Energy: 1.2404800850658495
Energy: 1.5001942821169525
Energy: 1.0609546296868508
Energy: 1.3430238938444428
Energy: 1.001261167932183
Energy: 1.3430238938464638
Energy: 0.9805602839641293
Energy: 1.5588411495088907
Energy: 1.376666169292926
Energy: 1.5588411495058592
Energy: 0.948044976160413
Energy: 1.4231324387412951
Energy: 1.110202386360621
Energy: 1.4231324387392739

minimum gb energy = 0.9377989683401105 eV
minimum distance =  2.16095445594481 Angstroms
sigma value = 41


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

Energy: 1.2854857790804195
Energy: 1.2907606285125763
Energy: 0.8644004415604053
Energy: 1.2907606285142335
Energy: 1.3421139673483622
Energy: 1.3088092389740422
Energy: 0.878453252718763
Energy: 1.3088092389748707
Energy: 0.914608951526216
Energy: 1.3213877647388568
Energy: 1.0845963934378413
Energy: 1.3213877647396854
Energy: 1.1407802573346668
Energy: 1.3098272077864868
Energy: 0.8781630765735362
Energy: 1.3098272077848296
Energy: 0.8677254590649928
Energy: 1.3101600673289742
Energy: 0.9315357625846794
Energy: 1.3101600673289742
Energy: 0.9288847881335881
Energy: 1.3086714664938977
Energy: 0.8768800383627869
Energy: 1.3086714664955548
Energy: 0.8718031771340183
Energy: 1.3080971395016951
Energy: 0.9300976142384202
Energy: 1.3080971395000383
Energy: 0.8507533003463509
Energy: 1.0997971996130667
Energy: 0.8689805730850028
Energy: 1.099797199613895
Energy: 0.8826290895707786
Energy: 1.3922020965049924
Energy: 1.2362728863540464
Energy: 1.392202096505821
Energy: 0.8481724261280998
Energy: 1.3229980740551501
Energy: 0.9159051436669644
Energy: 1.3229980740559786
Energy: 0.871700696953603
Energy: 1.3083178278068022
Energy: 1.34843341160304
Energy: 1.3083178278068022
Energy: 0.8533901143280489
Energy: 1.2908918621993664
Energy: 1.2864976177738967
Energy: 1.2908918622010233
Energy: 0.8822922253741879
Energy: 1.1009743484185577
Energy: 1.3447743130787684
Energy: 1.1009743484185577
Energy: 1.0203960007647956
Energy: 1.2271193799802353
Energy: 0.9149289341966743
Energy: 1.2271193799810636
Energy: 0.8719577490043584
Energy: 1.310037763470241
Energy: 1.264734506953733
Energy: 1.310037763470241
Energy: 1.0948503674316432
Energy: 1.332123817164569
Energy: 0.8690998280795694
Energy: 1.3321238171620833
Energy: 0.8821266586687248
Energy: 1.0996965048305367
Energy: 1.1617076851649764
Energy: 1.099696504829708
Energy: 0.9322112726869898
Energy: 1.225371248363477
Energy: 0.8769403145503816
Energy: 1.22537124836182
Energy: 0.8716990174173452
Energy: 1.0998353691519784
Energy: 0.8509880245456474
Energy: 1.0998353691503215
Energy: 0.9608310338281839
Energy: 1.3877275030443728
Energy: 0.886313526848757
Energy: 1.3877275030443728
Energy: 0.9138423882945357
Energy: 1.4095577044757053
Energy: 0.849429705599849
Energy: 1.4095577044765335
Energy: 1.346916518284535
Energy: 1.4902067118130289
Energy: 0.8731024236585484
Energy: 1.4902067118122007
Energy: 1.2993593711597697
Energy: 1.0991601706614393
Energy: 0.8538371781472658
Energy: 1.099160170663925
Energy: 1.2973346004101463
Energy: 1.0998292389320832
Energy: 0.8860476224527388
Energy: 1.0998292389353972
Energy: 0.9140111012116379
Energy: 1.2255184514067343
Energy: 0.8551732851480811
Energy: 1.2255184514075628
Energy: 1.2649999564581627
Energy: 1.4864530800869935
Energy: 0.8733501570333527
Energy: 1.486453080087822
Energy: 0.8716461626688589
Energy: 1.3293494482144868
Energy: 1.0955957331725181
Energy: 1.3293494482144868
Energy: 0.8697829553594808
Energy: 1.1006305466544037
Energy: 0.8869222926664282
Energy: 1.1006305466552324
Energy: 0.8824139876224497
Energy: 1.2254699367474267
Energy: 1.0961804543914861
Energy: 1.2254699367482553
Energy: 0.8518069662847043
Energy: 1.433325609168801
Energy: 0.8744561130350894
Energy: 1.433325609168801
Energy: 0.8741528574662693
Energy: 1.3907581848363897
Energy: 1.1135986064582817
Energy: 1.3907581848363897
Energy: 0.8532384043644686
Energy: 1.1362582285160723
Energy: 0.9185180226919315
Energy: 1.1362582285177292

minimum gb energy = 0.8481724261280998 eV
minimum distance =  2.14742764532729 Angstroms
sigma value = 15


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

Energy: 1.1702689238189987
Energy: 1.3117944257176286
Energy: 1.2029741920039843
Energy: 1.3117944257197343
Energy: 1.3689684599521952
Energy: 1.2334201839822398
Energy: 0.8248582905971451
Energy: 1.2334201839808363
Energy: 0.8609580770379223
Energy: 1.1478692813906635
Energy: 1.332216951579841
Energy: 1.1478692813899616
Energy: 1.1944963348293358
Energy: 1.2355393759892377
Energy: 0.8249570953631775
Energy: 1.2355393759920452
Energy: 0.8185532728765943
Energy: 1.1057216566144168
Energy: 0.7919840222973177
Energy: 1.1057216566130132
Energy: 1.0212677029512474
Energy: 1.2335048064360463
Energy: 0.8250698964981451
Energy: 1.23350480643745
Energy: 0.8274026628362842
Energy: 1.1622969338112794
Energy: 0.8484492977066699
Energy: 1.1622969338140867
Energy: 0.8485734727598745
Energy: 1.0000878956825832
Energy: 0.8277216761873691
Energy: 1.0000878956818813
Energy: 0.8270949550159264
Energy: 1.3329762558548197
Energy: 1.021394253172991
Energy: 1.3329762558555218
Energy: 0.7859078842285325
Energy: 1.2561795003436718
Energy: 0.8216996632763695
Energy: 1.2561795003443739
Energy: 0.823906739797032
Energy: 1.2370155543095522
Energy: 1.1948762319242157
Energy: 1.2370155543081485
Energy: 0.7877234718486706
Energy: 0.9832561752168403
Energy: 0.8615563495241164
Energy: 0.983256175217542
Energy: 0.8260704291872124
Energy: 1.325027408902642
Energy: 1.458753953618767
Energy: 1.3250274089054492
Energy: 0.7861671358031
Energy: 1.3128656960168583
Energy: 1.1712158659039413
Energy: 1.3128656960147527
Energy: 0.8240114838053865
Energy: 1.2329499358817775
Energy: 1.3706887626446485
Energy: 1.2329499358810756
Energy: 0.9247573916792584
Energy: 0.9828764175276338
Energy: 0.8616076098100345
Energy: 0.98287641752623
Energy: 0.8264028531163928
Energy: 1.324427193185372
Energy: 1.3233964765857
Energy: 1.3244271931874774
Energy: 0.9914726179142326
Energy: 1.1061182646731724
Energy: 0.8217984252111432
Energy: 1.1061182646731724
Energy: 0.8245221050851101
Energy: 1.2324931530481706
Energy: 1.13087380901171
Energy: 1.2324931530481706
Energy: 0.997078009460275
Energy: 1.1836899981005191
Energy: 0.827724124035451
Energy: 1.1836899980991153
Energy: 0.8260311954474604
Energy: 1.2614547692582103
Energy: 0.9566149650976143
Energy: 1.2614547692582103
Energy: 1.004140747564959
Energy: 1.3357000791292213
Energy: 0.8335861717116668
Energy: 1.3357000791334326
Energy: 0.8242488255134568
Energy: 1.2554383470122135
Energy: 0.7862959308790333
Energy: 1.2554383470122135
Energy: 1.1973090846012089
Energy: 1.2384669415916407
Energy: 0.8238014973685667
Energy: 1.238466941589535
Energy: 0.863902422074403
Energy: 1.2865171197459095
Energy: 0.7867372908224527
Energy: 1.2865171197466112
Energy: 1.2222266790034595
Energy: 1.3267270053384914
Energy: 0.833709168768718
Energy: 1.326727005339193
Energy: 1.1800945053758323
Energy: 1.320663548044373
Energy: 0.7859018230779081
Energy: 1.3206635480429694
Energy: 1.5263499336588795
Energy: 1.2332235486008185
Energy: 0.8234584406683143
Energy: 1.2332235486001166
Energy: 0.8638859345063004
Energy: 1.1404193254513466
Energy: 0.7897796540123784
Energy: 1.1404193254499428
Energy: 1.145823805619792
Energy: 1.3252840038622662
Energy: 0.8339523000749471
Energy: 1.3252840038622662
Energy: 0.8240411112928488
Energy: 1.106085309419021
Energy: 0.9937048429518774
Energy: 1.1060853094183192
Energy: 1.1309214653257451
Energy: 1.2548525664308732
Energy: 0.8220404492728657
Energy: 1.2548525664287675
Energy: 0.8259680671503848
Energy: 1.1405988248446093
Energy: 0.9947095604522004
Energy: 1.1405988248439072
Energy: 0.7964557517266889
Energy: 1.262607717983152
Energy: 0.8307737129484088
Energy: 1.2626077179852577
Energy: 0.8128038040799125
Energy: 1.1056875425705248
Energy: 1.0025262023443757
Energy: 1.1056875425691213
Energy: 0.7856182512994353
Energy: 1.2550838639323016
Energy: 0.8272053075619618
Energy: 1.2550838639323016
Energy: 0.8236519777492515
Energy: 1.140432859443883
Energy: 1.3515333494385788
Energy: 1.1404328594459887

minimum gb energy = 0.7856182512994353 eV
minimum distance =  2.22002359957686 Angstroms
sigma value = 85


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

Energy: 1.1169523765907055
Energy: 1.226217534814385
Energy: 1.2535162747104198
Energy: 1.2262175348137763
Energy: 1.4012715196572483
Energy: 1.150146434300194
Energy: 0.7621310362494084
Energy: 1.1501464343008025
Energy: 1.06678198751504
Energy: 1.0638005696451562
Energy: 0.8317917215623396
Energy: 1.0638005696451562
Energy: 1.2587553650181178
Energy: 1.1499339301393452
Energy: 0.7621750914966697
Energy: 1.1499339301387363
Energy: 0.8059112203442129
Energy: 1.0278038136437215
Energy: 0.7074739605303831
Energy: 1.0278038136437215
Energy: 1.1183861385856992
Energy: 1.153223490456146
Energy: 0.7627267867325251
Energy: 1.1532234904555374
Energy: 0.7592525392294207
Energy: 1.0873151094789473
Energy: 0.8196300427701767
Energy: 1.087315109479556
Energy: 0.9687304052751095
Energy: 1.1496865795607598
Energy: 0.7621848864179248
Energy: 1.149686579560151
Energy: 0.7613158834456832
Energy: 1.0440667679403766
Energy: 0.9695494540031097
Energy: 1.0440667679415938
Energy: 0.8198286452320348
Energy: 1.0871934770534055
Energy: 0.75989470373622
Energy: 1.0871934770534055
Energy: 0.7640326044786567
Energy: 1.1810687558400854
Energy: 1.1177380798443382
Energy: 1.181068755840694
Energy: 0.7081322513145959
Energy: 1.170015267771205
Energy: 0.8103054192183735
Energy: 1.170015267771205
Energy: 0.7614724488653218
Energy: 1.0445788396297127
Energy: 1.2578352790474958
Energy: 1.0445788396303213
Energy: 0.7065839625439428
Energy: 1.0641436403030826
Energy: 1.0677456297505776
Energy: 1.0641436403030826
Energy: 0.7640195994560428
Energy: 1.1489567401878227
Energy: 1.409979018873526
Energy: 1.148956740187214
Energy: 0.709393109812393
Energy: 1.2448450847082821
Energy: 1.11797486526789
Energy: 1.244845084708863
Energy: 0.7614590459563737
Energy: 1.045157704735206
Energy: 1.4072303992231043
Energy: 1.045157704735206
Energy: 0.8302210875790567
Energy: 1.0641112629448812
Energy: 1.0677731828396138
Energy: 1.0641112629454899
Energy: 0.7642500009288423
Energy: 1.1491370055097518
Energy: 1.3048339105834863
Energy: 1.1491370055103605
Energy: 0.8888396876694047
Energy: 1.2629380408155142
Energy: 0.8103230622566454
Energy: 1.2629380408149056
Energy: 0.7611973594413307
Energy: 1.0715281422573208
Energy: 1.1554398509640964
Energy: 1.0715281422573208
Energy: 0.8899379314223755
Energy: 1.0935697528856139
Energy: 0.7597272331955491
Energy: 1.0935697528862225
Energy: 0.7640485567441847
Energy: 1.1489010257603423
Energy: 1.0065761079468367
Energy: 1.1489010257591248
Energy: 0.9041091239779628
Energy: 1.2760015904411481
Energy: 0.7621908650390271
Energy: 1.2760015904411481
Energy: 0.761711051845491
Energy: 0.9346488457810259
Energy: 0.8566178723486028
Energy: 0.9346488457804173
Energy: 1.1871641581515626
Energy: 1.1817214826598734
Energy: 0.7655211768563397
Energy: 1.1817214826592646
Energy: 0.8135679683010678
Energy: 1.169082187143101
Energy: 0.7079742307155518
Energy: 1.169082187143101
Energy: 1.2069783137085943
Energy: 1.2770050268125122
Energy: 0.7618906867415748
Energy: 1.2770050268112947
Energy: 1.070357773068468
Energy: 1.0644931022040847
Energy: 0.7069049318835373
Energy: 1.0644931022046935
Energy: 1.4071536874988022
Energy: 1.1486272062090446
Energy: 0.766113159901559
Energy: 1.1486272062096534
Energy: 1.119486638091512
Energy: 1.2539388630591537
Energy: 0.7094056094419436
Energy: 1.2539388630591537
Energy: 1.3335871456513286
Energy: 1.265736532536892
Energy: 0.7619802026843425
Energy: 1.2657365325356746
Energy: 1.07036211886093
Energy: 1.0643628721238116
Energy: 0.7105916205726573
Energy: 1.0643628721238116
Energy: 1.3051253647586791
Energy: 1.148681743654786
Energy: 0.7662283239680041
Energy: 1.1486817436553947
Energy: 0.8137080128907178
Energy: 1.2889008127232644
Energy: 0.889364192110759
Energy: 1.288900812723873
Energy: 1.0327898245631237
Energy: 1.2634393470423915
Energy: 0.7618195019770388
Energy: 1.2634393470430005
Energy: 0.7617037656674185
Energy: 1.09378813448575
Energy: 0.8891383315685765
Energy: 1.093788134486359
Energy: 1.0065289346902693
Energy: 1.148627056312232
Energy: 0.7664818359748249
Energy: 1.148627056312232
Energy: 0.7640680943852294
Energy: 1.2910475019140597
Energy: 0.9073851919868349
Energy: 1.2910475019146683
Energy: 0.7261833888648419
Energy: 1.2251469392390544
Energy: 0.7636516695630472
Energy: 1.2251469392390544
Energy: 0.7614277558523557
Energy: 1.1821540538233957
Energy: 1.1868609674513309
Energy: 1.182154053822787
Energy: 0.7077661819123112
Energy: 1.169646319668274
Energy: 0.8169084355307007
Energy: 1.169646319668274
Energy: 0.7631849702423189
Energy: 1.2638958348001224
Energy: 1.2135304157725186
Energy: 1.2638958348019484

minimum gb energy = 0.7065839625439428 eV
minimum distance =  2.2241396808406 Angstroms
sigma value = 113


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

Energy: 0.020555020420830843
Energy: 0.023725919798918065
Energy: 1.1066787857780926
Energy: 0.02372591979798215
Energy: 1.106500940931102
Energy: 0.4594425741253938
Energy: 0.4594525652164326
Energy: 0.4594425741262777
Energy: 0.020555020420830843
Energy: 0.023725919798918065
Energy: 1.1066814011345596
Energy: 0.023725919797514188
Energy: 1.1065009409342736
Energy: 0.45944257412492584
Energy: 0.4594525652164326
Energy: 0.4594425741262777
Energy: 0.020555020420830843
Energy: 0.023725919798918065
Energy: 1.1066834491951023
Energy: 0.023725919798450106
Energy: 1.1065009409333897
Energy: 0.4594425741253938
Energy: 0.45945256521549666
Energy: 0.45944257412586176

minimum gb energy = 0.020555020420830843 eV
minimum distance =  2.48205959563466 Angstroms
sigma value = 1