Model name: model_name=Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Cu__MO_673777079812_004
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.653344042599202
cohesive_energy=3.2744465747796214
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.5096861812724478e-19, 2.11802944484898e-19, 2.5767967022285396e-19, 2.95108118569728e-19, 3.2700104664613194e-19, 3.5425727554374e-19, 3.7781568077007597e-19, 3.9831232644883795e-19, 4.1672133597349793e-19, 4.3338717732036597e-19, 4.48095158820486e-19, 4.61056767789546e-19, 4.72445039304018e-19, 4.8239936273106e-19, 4.910431056714899e-19, 4.98512453139198e-19, 5.05018892449872e-19, 5.104839169484459e-19, 5.1497161370028e-19, 5.185412632408319e-19, 5.21242533045756e-19, 5.231218862374379e-19, 5.2422418376163e-19, 5.24583071327646e-19, 5.24195344582218e-19, 5.234391172109699e-19, 5.221493650205999e-19, 5.197509065995019e-19, 5.160322546319879e-19, 5.1073385650335e-19, 5.0354969647649395e-19, 4.941000586891619e-19, 4.819203119174939e-19, 4.6658427717684595e-19, 4.47276446560512e-19, 4.2309479462355e-19, 3.929145933688919e-19, 3.5530830341564396e-19, 3.09651075876546e-19, 2.5270010524438196e-19, 1.8124302736798198e-19, 9.164882934171178e-20, -2.1488072579881195e-20, -1.6644372179972398e-19, -3.52738412094708e-19, -5.970959836058519e-19, -9.21629678235624e-19, -1.3593571520574957e-18, -1.96825797310266e-18, -2.84253371874378e-18, -4.14992587385412e-18, -6.2097963068889e-18, -9.70465624216578e-18, -1.6327942294757398e-17]
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: 0.015143283718256533
Energy: 0.8231002001905138
Energy: 0.45540091751841594
Energy: 1.1689400506252294
Energy: 1.1654282839597774
Energy: 0.42054908138671343
Energy: 0.015850275670261718
Energy: 0.10043603539431631
Energy: 0.8107030635777607
Energy: 0.10402118927862428
Energy: 0.21364813779599404
Energy: 0.8103967402515504
Energy: 0.017249856012598506
Energy: 0.10178382978908716
Energy: 0.015523475362632716
Energy: 0.8101361505223199
Energy: 0.21335779523988754
Energy: 0.21300089068545222
Energy: 0.8110963209666983
Energy: 0.10157003279815303
Energy: 0.10025433197151189
Energy: 0.018122155932093497
Energy: 0.8087720029254627
Energy: 0.21291731755460025
Energy: 0.8108574347405277
Energy: 0.808950900596918
Energy: 0.09941729644930736
Energy: 0.01589336970825433
Energy: 0.10050949048667304
Energy: 0.8152647081891631
Energy: 0.10435818271241103
Energy: 0.2138930522266996
Energy: 0.810612622445207
Energy: 0.016838316268582735
Energy: 0.09964831017262067
Energy: 0.015505051585324645
Energy: 0.8104175460532752
Energy: 0.21339905000128803
Energy: 0.2134424347920157
Energy: 0.8117003137214863
Energy: 0.1002115181488055
Energy: 0.0990371287836172

minimum gb energy = 0.015143283718256533 eV
minimum distance =  2.54755677700678 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.378667242329908
Energy: 1.3589395968447142
Energy: 1.4373220608089006
Energy: 1.3819256268724098
Energy: 1.5039641264387094
Energy: 1.4144837034394522
Energy: 1.3849537183700134
Energy: 1.3423329676666884
Energy: 1.4551939762789587
Energy: 1.374177583660322
Energy: 1.504623279373857
Energy: 1.3922683411489043
Energy: 1.353070796346183
Energy: 1.4873120506107589
Energy: 1.3600401052040805
Energy: 1.428461831117463
Energy: 1.4319227594362636
Energy: 1.4182349662323217
Energy: 1.393384975875577
Energy: 1.4365986818949386
Energy: 1.447608111753375
Energy: 1.3566116596729374
Energy: 1.4853791509554155
Energy: 1.368967225097877
Energy: 1.3952993155213025
Energy: 1.3685778041083263
Energy: 1.354169135160544
Energy: 1.427177729417011
Energy: 1.4218516667542351
Energy: 1.3859133832173218
Energy: 1.3790403206252602
Energy: 1.3850289441872772
Energy: 1.4522944198626406
Energy: 1.3731559683803993
Energy: 1.412645083976701
Energy: 1.4448178790135708
Energy: 1.4403105217194019
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Energy: 1.42713726464686
Energy: 1.4046918119936156
Energy: 1.4836272728985402
Energy: 1.4897089029162116
Energy: 1.3484003633026949
Energy: 1.4230006730386842
Energy: 1.386178646665388
Energy: 1.3514564484382503
Energy: 1.3572033824756335
Energy: 1.4475404039280417
Energy: 1.401731251977079
Energy: 1.3627142595241724
Energy: 1.405892684528536
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Energy: 1.438947292252722
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Energy: 1.3950603866379974
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Energy: 1.4760805509488923
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Energy: 1.5043822722903235
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Energy: 1.3644261260499353
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Energy: 1.4660787218687366
Energy: 1.4186726950684236
Energy: 1.4030869480141814
Energy: 1.4395184581935898
Energy: 1.444974644899465
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Energy: 1.4246581062772465
Energy: 1.3787289242771663
Energy: 1.4208233684420315
Energy: 1.3815089020052316
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Energy: 1.39457597729224
Energy: 1.43752954725568
Energy: 1.4271210036137805
Energy: 1.378677162714388
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Energy: 1.3529975224514452
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Energy: 1.4401278780265017
Energy: 1.4387716312550176
Energy: 1.3790201968666673
Energy: 1.425701405678503
Energy: 1.3541030596682258
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Energy: 1.3833893288623025
Energy: 1.3330909608124712
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Energy: 1.4880902700359302
Energy: 1.3905683652495255
Energy: 1.4654586679550914
Energy: 1.4542797739928486
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Energy: 1.4664382961065456
Energy: 1.3836156128764885
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Energy: 1.359206627572925
Energy: 1.3617332850880925
Energy: 1.4253780974534174
Energy: 1.4171398002933575
Energy: 1.3781934846363584
Energy: 1.4373013674978181
Energy: 1.3329829697639115
Energy: 1.4380691107353687
Energy: 1.3767693037657676
Energy: 1.4384791588017476
Energy: 1.4175426773548963
Energy: 1.3752537194387382
Energy: 1.3530383037103673
Energy: 1.3839474398774816
Energy: 1.3409380695849467
Energy: 1.4078896830377658
Energy: 1.388244805294102
Energy: 1.3942741786342914
Energy: 1.4594833053421654
Energy: 1.3728744474389338
Energy: 1.3957848298208877
Energy: 1.3402051041709238
Energy: 1.438351223849791
Energy: 1.4411571572544593
Energy: 1.3968301584119136
Energy: 1.3700339435418165
Energy: 1.3776530903400344
Energy: 1.3530349564203354
Energy: 1.4149489834122697
Energy: 1.4411085651190403
Energy: 1.4488607523634762
Energy: 1.4278947478555335
Energy: 1.343761815050818
Energy: 1.3664122999781656
Energy: 1.4822722715683845
Energy: 1.3459364085744665
Energy: 1.462016194549496
Energy: 1.4101485224666845
Energy: 1.3772959183892997
Energy: 1.406595205132042
Energy: 1.3385541335910087
Energy: 1.4203499571393179
Energy: 1.3433158505696912
Energy: 1.4624405402849918
Energy: 1.5236044246525697
Energy: 1.354486613930775
Energy: 1.4275299184839776
Energy: 1.4005881139486562
Energy: 1.380292849873706
Energy: 1.3801433751545296
Energy: 1.3883236340952774
Energy: 1.415389534984426
Energy: 1.3321904304617427
Energy: 1.4136039083609613
Energy: 1.3782139831617137
Energy: 1.3457817978327058
Energy: 1.3259612505825995
Energy: 1.375100996719135
Energy: 1.523100549426099
Energy: 1.4497976830052184
Energy: 1.3826276067430308

minimum gb energy = 1.3259612505825995 eV
minimum distance =  2.29708328807055 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.4878491377104002
Energy: 1.620109265807524
Energy: 1.428572299247041
Energy: 1.4303234179724282
Energy: 1.4320981800583326
Energy: 1.4171599006642144
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Energy: 1.522002494151708
Energy: 1.3373445851846197
Energy: 1.384619133552993
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Energy: 1.450710618852816
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Energy: 1.4300199754248635
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Energy: 1.4078020562515368
Energy: 1.4079687442418989
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Energy: 1.3727028970088118
Energy: 1.3901964836765268
Energy: 1.3398947820413998
Energy: 1.474702399988243
Energy: 1.484438469424425
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Energy: 1.4429047839410125
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Energy: 1.364394725011727
Energy: 1.4197796572770571
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Energy: 1.4074324316982338
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Energy: 1.3643694411327596
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Energy: 1.4951974707731999
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Energy: 1.3627193544605016
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Energy: 1.449129523371826
Energy: 1.4538344561106533
Energy: 1.400830625478963
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Energy: 1.4158788949473902
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Energy: 1.4268885117396275
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Energy: 1.3840504279368637
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Energy: 1.3692433881337454
Energy: 1.398519855876253
Energy: 1.4314174323268691
Energy: 1.4623117875462974
Energy: 1.4491084158263892
Energy: 1.3831256119980109
Energy: 1.373463097882046
Energy: 1.334511065882306
Energy: 1.4058031100863932
Energy: 1.5969371420657978
Energy: 1.47978437347887
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Energy: 1.3800987663966886
Energy: 1.3725930191101439
Energy: 1.3403299750800008
Energy: 1.4135984211102208
Energy: 1.444774520382847
Energy: 1.4144265005797956
Energy: 1.4637715805341336
Energy: 1.3975136266617443
Energy: 1.3871774476609355
Energy: 1.333547758011374
Energy: 1.4129062721489478
Energy: 1.4774826786761266
Energy: 1.466269435436399
Energy: 1.435435055849813
Energy: 1.39287661246292
Energy: 1.3895282727355909
Energy: 1.3350930928288127
Energy: 1.4638545013738329
Energy: 1.4791443744377333
Energy: 1.3724627649950392
Energy: 1.3875613898758123
Energy: 1.4804067354656867
Energy: 1.4121724452622202
Energy: 1.3703536276111212
Energy: 1.3832942904038767
Energy: 1.4182033387562092
Energy: 1.4104167562986942
Energy: 1.4209006808826392
Energy: 1.488735884784161
Energy: 1.4138361592761806
Energy: 1.4398717988136782
Energy: 1.4051912201799872
Energy: 1.4222593598685305
Energy: 1.3627131973745923
Energy: 1.4187089682971132
Energy: 1.4570626377444458
Energy: 1.465048104523113
Energy: 1.4387080613355576
Energy: 1.361602439217288
Energy: 1.4114775356819873
Energy: 1.3644432283598753
Energy: 1.4466562993920018
Energy: 1.4432633961954218
Energy: 1.3700142719831518
Energy: 1.409854800090558
Energy: 1.3809826289666234
Energy: 1.4115742111855567
Energy: 1.3968966238779599
Energy: 1.4233085159445689
Energy: 1.4527140308915012
Energy: 1.3919025722546279
Energy: 1.4762183693432378
Energy: 1.4070791833471674
Energy: 1.4234729217799365
Energy: 1.4010299140917575
Energy: 1.3969603190262851
Energy: 1.3866117603980357
Energy: 1.4121101411797654
Energy: 1.380130512953484
Energy: 1.3694889536580188
Energy: 1.4685239384193487
Energy: 1.347929859567122
Energy: 1.409059979994151
Energy: 1.3864429446091353
Energy: 1.4102061721286632
Energy: 1.3674293917053642
Energy: 1.3887084406526842
Energy: 1.6637762635430247
Energy: 1.4749194813472624
Energy: 1.461018851910541
Energy: 1.3960779295889372
Energy: 1.4084882046175964
Energy: 1.333645291327484
Energy: 1.5058551406176082
Energy: 1.4529272204483856
Energy: 1.3338105652265082
Energy: 1.5052614264202946
Energy: 1.3998559937936428
Energy: 1.408120930767624
Energy: 1.334373861908767
Energy: 1.4113874437159541
Energy: 1.4553153374687382
Energy: 1.4094906064078858
Energy: 1.4285018827316354
Energy: 1.388397369268213
Energy: 1.4091825338414483
Energy: 1.3278669447122187
Energy: 1.4411078856711226
Energy: 1.4972207967267785
Energy: 1.373221759548181
Energy: 1.4150262438599919
Energy: 1.4479481744387115
Energy: 1.3894778702141055
Energy: 1.4152888433090416
Energy: 1.3847452827434632
Energy: 1.4421573847408389
Energy: 1.3794354248605285
Energy: 1.3973266505490165
Energy: 1.421185305364985
Energy: 1.3830352315012804
Energy: 1.4264037686467614
Energy: 1.3684864254029172
Energy: 1.430959573351887
Energy: 1.3784293853164449
Energy: 1.4019020925254504
Energy: 1.4087605255362794
Energy: 1.5200367898518778
Energy: 1.3379541442493048
Energy: 1.3591785201220625
Energy: 1.4582232442419947

minimum gb energy = 1.3264833010632906 eV
minimum distance =  2.29475650089999 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.4312703371592348
Energy: 1.5030569766926984
Energy: 1.4646505420257037
Energy: 1.413700476142494
Energy: 1.425988065425913
Energy: 1.4275994825421823
Energy: 1.4885556507907973
Energy: 1.4470327862935097
Energy: 1.3872167730089344
Energy: 1.4274849808747205
Energy: 1.4095995899449103
Energy: 1.5227297815954266
Energy: 1.4070769954401054
Energy: 1.4332197318612037
Energy: 1.4371393303632432
Energy: 1.4617878273522904
Energy: 1.4145915046427826
Energy: 1.4264965926751392
Energy: 1.4133020180837066
Energy: 1.4904179651610099
Energy: 1.4655277069933983
Energy: 1.4811698760535181
Energy: 1.437697018084773
Energy: 1.4391387097213013
Energy: 1.4639281790427396
Energy: 1.4100952628599948
Energy: 1.3656302516016858
Energy: 1.5125146287211624
Energy: 1.380820057488283
Energy: 1.4072624208992475
Energy: 1.4400401053952632
Energy: 1.461111260497819
Energy: 1.450201110844421
Energy: 1.4326244930068537
Energy: 1.433844021650122
Energy: 1.4700593809651874
Energy: 1.398794094189785
Energy: 1.4137266154655626
Energy: 1.4173961932539296
Energy: 1.4205100689572652
Energy: 1.4372943839733439
Energy: 1.411158065731536
Energy: 1.4287468414895415
Energy: 1.4533645658107204
Energy: 1.4226876386894756
Energy: 1.448199267695219
Energy: 1.490400453487246
Energy: 1.4152023905298279
Energy: 1.4636001737248565
Energy: 1.4241968839161077
Energy: 1.4020937766021324
Energy: 1.4245310699235103
Energy: 1.4288963786014681
Energy: 1.4923553682654007
Energy: 1.4526786048918023
Energy: 1.4830411670628285
Energy: 1.4525160725012773
Energy: 1.5149094210495933
Energy: 1.3994074016080373
Energy: 1.460054076299376
Energy: 1.4172720735077398
Energy: 1.444446707581617
Energy: 1.4907060060913793
Energy: 1.4605713488593435
Energy: 1.4776816523636198
Energy: 1.4434090971006441
Energy: 1.445279885353494
Energy: 1.4239483769719763
Energy: 1.4119209833562154
Energy: 1.4572364165735487
Energy: 1.4164779566368741
Energy: 1.4110856446673705
Energy: 1.4307606232935046
Energy: 1.4518838978137858
Energy: 1.4080871746865584
Energy: 1.4547062656216794
Energy: 1.378736919916958
Energy: 1.4394292417397634
Energy: 1.3985703702956132
Energy: 1.4136883301135876
Energy: 1.4166221988865557
Energy: 1.4436767277256208
Energy: 1.4481047736330523
Energy: 1.401777332614837
Energy: 1.4457154233762426
Energy: 1.437421576566276
Energy: 1.4210008055333458
Energy: 1.4818527635841654
Energy: 1.4342452823256016
Energy: 1.4555319877376196
Energy: 1.4954977343586262
Energy: 1.4434627879151152
Energy: 1.4419447930044773
Energy: 1.4283061075402408
Energy: 1.425653771950759
Energy: 1.4936899303166988
Energy: 1.4532446305723459
Energy: 1.5113256497660053
Energy: 1.482665528657291
Energy: 1.4545654291234493
Energy: 1.4001615783095318
Energy: 1.4386391166119301
Energy: 1.4113245479749663
Energy: 1.4182592061167485
Energy: 1.485320774691337
Energy: 1.4373075264836392
Energy: 1.4036327434091778
Energy: 1.4749068852284457
Energy: 1.4178107179498094
Energy: 1.4127185474733703
Energy: 1.357999583042713
Energy: 1.4260386836164805
Energy: 1.4415327899762094
Energy: 1.407143844591432
Energy: 1.4335682771095328
Energy: 1.4347184587859247
Energy: 1.3892528138936882
Energy: 1.4567251463104947
Energy: 1.4141267013705172
Energy: 1.4034994368353149
Energy: 1.4545111966854036
Energy: 1.4867860085923672
Energy: 1.3661154607262693
Energy: 1.430079066171846
Energy: 1.378499587234426
Energy: 1.4025156492433934
Energy: 1.4671888781721483
Energy: 1.4406902074878738
Energy: 1.4017136295318657
Energy: 1.4073074042508231
Energy: 1.4045563359659055
Energy: 1.4437348424965293
Energy: 1.443143585229532
Energy: 1.429165510270393
Energy: 1.474873382025969
Energy: 1.4404026049124283
Energy: 1.4618098812448543
Energy: 1.5466499820890136
Energy: 1.463437282848364
Energy: 1.5013565604195729
Energy: 1.4593857957982752
Energy: 1.478548129528905
Energy: 1.4240889410236552
Energy: 1.4155398594516455
Energy: 1.4209661223619052
Energy: 1.4195424294935506
Energy: 1.4517257281589049
Energy: 1.447550901394428
Energy: 1.4400018696702028
Energy: 1.4388426205053122
Energy: 1.3856919536451255
Energy: 1.4476906844344335
Energy: 1.406304342346454
Energy: 1.4252062153995109
Energy: 1.4169201150199888
Energy: 1.4573173935235004
Energy: 1.4236817425909725
Energy: 1.3930164989189484
Energy: 1.427757441189237
Energy: 1.4054490254972476
Energy: 1.45273746360104
Energy: 1.4926783116774773
Energy: 1.394571386301768
Energy: 1.419941951873102
Energy: 1.4139785951515431
Energy: 1.433532821853266
Energy: 1.3861541430181163
Energy: 1.4091510030694705
Energy: 1.5021041714867598
Energy: 1.4514021546501363
Energy: 1.4111990290280725
Energy: 1.4708935186176753
Energy: 1.4090511040362907
Energy: 1.4217748183254733
Energy: 1.4543540207779169
Energy: 1.4252285002179699
Energy: 1.396651448766652
Energy: 1.4687593891106738
Energy: 1.4103922442171923
Energy: 1.5306400464855696
Energy: 1.4504572235388817
Energy: 1.4925971707734895
Energy: 1.4558640268571867
Energy: 1.4791541419124217
Energy: 1.4541633712022428
Energy: 1.4530877630843377
Energy: 1.432170715694798
Energy: 1.4658392861277354
Energy: 1.4540253858729846
Energy: 1.425371602574757
Energy: 1.4959821583243575
Energy: 1.4490808956688543
Energy: 1.3846669287795805
Energy: 1.4200452393564142
Energy: 1.4429891656288478
Energy: 1.3922256468559162
Energy: 1.3935402403971007
Energy: 1.4505571403937467
Energy: 1.4297183949524241
Energy: 1.411149123809055
Energy: 1.4485909995844461
Energy: 1.4371862545685377
Energy: 1.4294249016613791
Energy: 1.4954923714914072
Energy: 1.418567685628761
Energy: 1.4537685208846909
Energy: 1.4107201700749505
Energy: 1.412471772702258
Energy: 1.4275467171953529
Energy: 1.423687600552482
Energy: 1.4125955737799898
Energy: 1.4747691049508453
Energy: 1.4438616234240824
Energy: 1.4361573356203408
Energy: 1.4014745387125425
Energy: 1.4036409464249924
Energy: 1.464831118921307
Energy: 1.47980784508663
Energy: 1.4756739904774316
Energy: 1.472515973598212
Energy: 1.4103614676849536
Energy: 1.4894251082682455
Energy: 1.379697145895957
Energy: 1.5394249609619652
Energy: 1.4708077375500213
Energy: 1.4997642287037405
Energy: 1.4425086762584325
Energy: 1.4544775607982658
Energy: 1.480232374019263
Energy: 1.4865874717423544
Energy: 1.4829003489945083
Energy: 1.4363243272704658
Energy: 1.4708853187262554
Energy: 1.4085458116420881
Energy: 1.3523729215439813
Energy: 1.4094739735921098
Energy: 1.4311912515584175
Energy: 1.462286871640151
Energy: 1.4564141778499713
Energy: 1.4857269535518487
Energy: 1.4227005781228623
Energy: 1.381883154089149
Energy: 1.4162662299719952
Energy: 1.4324468582013155
Energy: 1.4814380472826403
Energy: 1.455591891482846
Energy: 1.370816082711646
Energy: 1.4668559046632306
Energy: 1.3829894400252254
Energy: 1.38820751500116
Energy: 1.4267564446741845
Energy: 1.4805635916106916

minimum gb energy = 1.3523729215439813 eV
minimum distance =  2.28408079457639 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.3427148715461519
Energy: 1.4738624159796931
Energy: 1.9694414885508966
Energy: 1.6547567105882146
Energy: 1.3961598400464035
Energy: 1.493878553484048
Energy: 1.3270320451608597
Energy: 1.415345532650885
Energy: 1.4410976800692257
Energy: 1.3463168465265074
Energy: 1.4189617086748383
Energy: 1.4315676675123241
Energy: 1.4131482900497896
Energy: 1.445326937013928
Energy: 1.4128309301203694
Energy: 1.2849662066512166
Energy: 1.3460746871028555
Energy: 1.5389908548696827
Energy: 1.436479268059791
Energy: 1.4106802777732481
Energy: 1.4741508331632407
Energy: 1.4092407936543427
Energy: 1.281956032801504
Energy: 1.349971647399456
Energy: 1.2795645137549323
Energy: 1.4998078190236968
Energy: 1.350443090144987
Energy: 1.5614829046635639
Energy: 1.4270200809929514
Energy: 1.3314275397348878
Energy: 1.434347988912547
Energy: 1.3489181576843712
Energy: 1.436812164602909
Energy: 1.3484616146485857
Energy: 1.418422316939759
Energy: 1.325140167704075
Energy: 1.4317463526655003
Energy: 1.3478016803858837
Energy: 1.2809276186080016
Energy: 1.4265994753578153
Energy: 1.4134592776490953
Energy: 1.4333924171686698
Energy: 1.410449528861937
Energy: 1.376881232376482
Energy: 1.3467676426413209
Energy: 1.434446426592486
Energy: 1.3266769692196745
Energy: 1.3290419455629572
Energy: 1.444378022153674
Energy: 1.32591369574006
Energy: 1.4311711212624099
Energy: 1.506041852435911
Energy: 1.2802059821261402
Energy: 1.5038121158462805
Energy: 1.3476012718601027
Energy: 1.445623279697885
Energy: 1.325791510290544
Energy: 1.4312269886631919
Energy: 1.4999273304824008
Energy: 1.2849906440038974
Energy: 1.431237285227734
Energy: 1.3644973421261224
Energy: 1.4457566323044333
Energy: 1.4105031981413525
Energy: 1.2801324086181727
Energy: 1.3489688412452174
Energy: 1.4196596213171453
Energy: 1.4273216350574174
Energy: 1.4086309322734507
Energy: 1.4184520583019447
Energy: 1.408479074814782
Energy: 1.3746800619725248
Energy: 1.3488469057287071
Energy: 1.2815853334847438
Energy: 1.4407143135932983
Energy: 1.4183535463374157
Energy: 1.4789567086873836
Energy: 1.4420269440143634
Energy: 1.4334203446912537
Energy: 1.279856976477499
Energy: 1.2801507033932127
Energy: 1.4196921145448576
Energy: 1.3535394952828428
Energy: 1.418789144958235
Energy: 1.3273150305533965
Energy: 1.3323745498232233
Energy: 1.5061030179773103
Energy: 1.35021451037238
Energy: 1.4364423909343051
Energy: 1.302282062063523
Energy: 1.4135977676613671
Energy: 1.4089122576593742
Energy: 1.2810925087243061
Energy: 1.3466085538065322
Energy: 1.4348515038218848
Energy: 1.3256622954028874
Energy: 1.3277662662070808
Energy: 1.401438816170781
Energy: 1.3248448620548332
Energy: 1.3774739679433459
Energy: 1.3461836957202196
Energy: 1.433728530848472
Energy: 1.3260900113956025
Energy: 1.325676423441291
Energy: 1.4016878518522127
Energy: 1.3252961124836884
Energy: 1.4725379401400776
Energy: 1.4347321707113918
Energy: 1.3541646030178567
Energy: 1.407078476007096
Energy: 1.4941488807421726
Energy: 1.326016495402657
Energy: 1.4153002976339815
Energy: 1.4426456634202045
Energy: 1.3465286798876441
Energy: 1.418908826671197
Energy: 1.4338372918661333
Energy: 1.4127746122346354
Energy: 1.4455864897422532
Energy: 1.41286166379591
Energy: 1.2828728149474287
Energy: 1.3467378862997865
Energy: 1.5387379788943176
Energy: 1.4373201015678339
Energy: 1.4108296089453511
Energy: 1.4715707469455526
Energy: 1.4093142606828812
Energy: 1.2814741005964851
Energy: 1.3497815143287364
Energy: 1.2796554842156072
Energy: 1.5006058427557196
Energy: 1.3510269850796157
Energy: 1.5611974043410877
Energy: 1.4400610684280102
Energy: 1.33112395446222
Energy: 1.4359899863420993
Energy: 1.349114673442128
Energy: 1.5040754477865146
Energy: 1.351230384463533
Energy: 1.4148249382117986
Energy: 1.325174054789314
Energy: 1.432896035684654
Energy: 1.346503436665625
Energy: 1.2809627730310529
Energy: 1.4263606638989303
Energy: 1.3258087230622884
Energy: 1.4455674353856927
Energy: 1.4104124311234563
Energy: 1.380198990963465
Energy: 1.3467684602740406
Energy: 1.456188639661708
Energy: 1.3268674994556955
Energy: 1.329165445992212
Energy: 1.4440027501806463
Energy: 1.3261026064207002
Energy: 1.4308559166482984
Energy: 1.5060266050643536
Energy: 1.2804988905728396
Energy: 1.503326628956554
Energy: 1.34822491251074
Energy: 1.4453885385845988
Energy: 1.325217182054542
Energy: 1.4315229932851854
Energy: 1.5003245457227004
Energy: 1.2819760721567788
Energy: 1.4317176871483022
Energy: 1.3659190248277504
Energy: 1.4457931559455053
Energy: 1.4108605947731505
Energy: 1.3719959557948131
Energy: 1.348282430437855
Energy: 1.4204758352021725
Energy: 1.4272066982072618
Energy: 1.4091065925185409
Energy: 1.418446919020802
Energy: 1.4092685021792009
Energy: 1.374743924627608
Energy: 1.3486759265340786
Energy: 1.2812206835779667
Energy: 1.440766364242577
Energy: 1.3475522352900466
Energy: 1.478337369725999
Energy: 1.4413616886076541
Energy: 1.433833427068433
Energy: 1.280571147959181
Energy: 1.2802900607421657
Energy: 1.4194123329221033
Energy: 1.3484231719045363
Energy: 1.4183506925828364
Energy: 1.3273238322632888
Energy: 1.3337273491342492
Energy: 1.506392752593509
Energy: 1.3505089056913413
Energy: 1.4380218953139663
Energy: 1.3643538348731061
Energy: 1.4136301242106395
Energy: 1.4087597584033957
Energy: 1.281426644931746
Energy: 1.3465029350611553
Energy: 1.4379539970795494
Energy: 1.3257672556926148
Energy: 1.3265103948883479
Energy: 1.4013178210864006
Energy: 1.3248323657708803
Energy: 1.3780986678430052
Energy: 1.3463373452145608
Energy: 1.2801293244572285
Energy: 1.3262510764330027
Energy: 1.325643326423729
Energy: 1.4011422584622248

minimum gb energy = 1.2795645137549323 eV
minimum distance =  2.32841313069453 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.7098465578232378
Energy: 1.5948659152929614
Energy: 1.3936219169832051
Energy: 1.7074212145123495
Energy: 1.381203982565986
Energy: 1.376637716373855
Energy: 1.5792901820302172
Energy: 1.4908931866334694
Energy: 1.4160455972275516
Energy: 1.5074537174824234
Energy: 1.3220421118157453
Energy: 1.2694821490807753
Energy: 1.4970737684028301
Energy: 1.370041207658608
Energy: 1.4802553258247426
Energy: 1.357844664661051
Energy: 1.379105519836422
Energy: 1.3141109098890575
Energy: 1.357371032083435
Energy: 1.3668876670947796
Energy: 1.3753033079444958
Energy: 1.6401070176371932
Energy: 1.4273643612167013
Energy: 1.4183747390609898
Energy: 1.4163119834498459
Energy: 1.4243275572133216
Energy: 1.3759606160292517
Energy: 1.5036311946631604
Energy: 1.3435726077393393
Energy: 1.331317449333448
Energy: 1.409692540613652
Energy: 1.3007297654744627
Energy: 1.3077911888679141
Energy: 1.376239877451201
Energy: 1.3481645574615833
Energy: 1.3079778451991857
Energy: 1.270047818961586
Energy: 1.4502784243149387
Energy: 1.3524992869168135
Energy: 1.2309925389874128
Energy: 1.3583468813227124
Energy: 1.3444354820713658
Energy: 1.4935690952721865
Energy: 1.2921351203179263
Energy: 1.3774976310986988
Energy: 1.3827716098542044
Energy: 1.3075865797486665
Energy: 1.3076446180153476
Energy: 1.3427658246588607
Energy: 1.376623818032893
Energy: 1.302041708848757
Energy: 1.3792665286001389
Energy: 1.4119005298768472
Energy: 1.3748666758464703
Energy: 1.3441221951741011
Energy: 1.344148471195233
Energy: 1.4014559830531756
Energy: 1.314437914618809
Energy: 1.4449914693625259
Energy: 1.3137606755060938
Energy: 1.2373225684448728
Energy: 1.5122069624185264
Energy: 1.3650657240188095
Energy: 1.496123240088744
Energy: 1.4025611469710748
Energy: 1.2891568870616987
Energy: 1.3851678681605875
Energy: 1.3769754989185465
Energy: 1.3784363955418393
Energy: 1.4964236462193956
Energy: 1.42928353784227
Energy: 1.368655332553214
Energy: 1.3885178870466681
Energy: 1.424615352414948
Energy: 1.307768672188464
Energy: 1.3075251620621258
Energy: 1.3823901448555933
Energy: 1.3787352086041236
Energy: 1.4050423112281647
Energy: 1.5314447360848173
Energy: 1.3142636792759232
Energy: 1.4564939497480214
Energy: 1.5786625713910654
Energy: 1.3681730899764908
Energy: 1.5779629993761872
Energy: 1.3761039108216744
Energy: 1.3364437443590493
Energy: 1.5315556639484074
Energy: 1.4245265901290916
Energy: 1.376116390438908
Energy: 1.3077293743244656
Energy: 1.3065161826701794
Energy: 1.3575629505375533
Energy: 1.4062846344016862
Energy: 1.4208342283612776
Energy: 1.3462225411755908
Energy: 1.3734744260415421
Energy: 1.3700786567584802
Energy: 1.377608235343739
Energy: 1.4173562121994203
Energy: 1.391830920355676
Energy: 1.2167193294947303
Energy: 1.424070439072642
Energy: 1.4944219232872933
Energy: 1.340159083005033
Energy: 1.401878209291212
Energy: 1.2539058923341233
Energy: 1.3754499529124748
Energy: 1.3723902850155267
Energy: 1.370395764835524
Energy: 1.3663901293600644
Energy: 1.3703699141219894
Energy: 1.3432278037391423
Energy: 1.4091638125813344
Energy: 1.3793546753341936
Energy: 1.3025200992513553
Energy: 1.1908876406088762
Energy: 1.352196608571258
Energy: 1.4350107195338353
Energy: 1.308957064065742
Energy: 1.2577774837869355
Energy: 1.3992029716772196
Energy: 1.2958144572482797
Energy: 1.3603293510444807
Energy: 1.3447562905435682
Energy: 1.3377607120859956
Energy: 1.5780574632990696
Energy: 1.3015236984892575
Energy: 1.4167935223682229
Energy: 1.2895228543824866
Energy: 1.3083884013319862
Energy: 1.308542575806727
Energy: 1.3384775161171891
Energy: 1.7085870510110606
Energy: 1.308584144493244
Energy: 1.3665639366774054
Energy: 1.4101278968264637
Energy: 1.3924433823888633
Energy: 1.3435473080946725
Energy: 1.3637885631515052
Energy: 1.3769592159646815
Energy: 1.2586076043876226
Energy: 1.4436100643452405
Energy: 1.4262666315895423
Energy: 1.3588033657401892
Energy: 1.5217794648013052
Energy: 1.4166986118852354
Energy: 1.4795579001427113
Energy: 1.3180679193300815
Energy: 1.412076080406234
Energy: 1.4058848835029567
Energy: 1.2593715187797943
Energy: 1.3518188890967708
Energy: 1.424631166635562
Energy: 1.2583734532866193
Energy: 1.3105106248206162
Energy: 1.3394916397886563
Energy: 1.3792866231969887
Energy: 1.366838755772236
Energy: 1.3724627184142266
Energy: 1.3454160085561864
Energy: 1.3764628805557975
Energy: 1.419505268723295
Energy: 1.2813378832039182
Energy: 1.3676045977034559
Energy: 1.5792890738202632
Energy: 1.5789188269197167
Energy: 1.4138804098946927
Energy: 1.3064179293736535
Energy: 1.4089389547527955
Energy: 1.3345241177534075
Energy: 1.4260720456650537
Energy: 1.4453021908135528
Energy: 1.3723777193290967
Energy: 1.3821136577962532

minimum gb energy = 1.1908876406088762 eV
minimum distance =  2.30881441329765 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.6542051999599536
Energy: 1.764182297217875
Energy: 1.4101788325934264
Energy: 1.2625144311127476
Energy: 1.3288552490087024
Energy: 1.3447412938469463
Energy: 1.4584360309655973
Energy: 1.4187298799903323
Energy: 1.3931081370700882
Energy: 1.2875209596808608
Energy: 1.3228649927519982
Energy: 1.2482629304649187
Energy: 1.3008778666573708
Energy: 1.2645252019950444
Energy: 1.4954446103362626
Energy: 1.3077908158278266
Energy: 1.4400693734267924
Energy: 1.3014261458385614
Energy: 1.2441164337062438
Energy: 1.3835242616351935
Energy: 1.3078265030758565
Energy: 1.3252298499289734
Energy: 1.3791944782180021
Energy: 1.2647803685407848
Energy: 1.2751192227501864
Energy: 1.2716806875515285
Energy: 1.259604096127493
Energy: 1.4245220779090324
Energy: 1.244057623204666
Energy: 1.314500460526672
Energy: 1.316721634893337
Energy: 1.307622452994622
Energy: 1.327258637886422
Energy: 1.2785087722924646
Energy: 1.476182607035687
Energy: 1.4170892709378253
Energy: 1.3800770918948868
Energy: 1.37039293692876
Energy: 1.2546227575676008
Energy: 1.34247178223395
Energy: 1.4329867277306148
Energy: 1.3098872240985835
Energy: 1.4067703038426194
Energy: 1.3025231795166696
Energy: 1.3542420114226967
Energy: 1.3583091941238614
Energy: 1.2451327380083335
Energy: 1.3052834884634668
Energy: 1.4061700052484927
Energy: 1.2687737417430744
Energy: 1.3107185526737362
Energy: 1.2789294771318394
Energy: 1.2910947086529077
Energy: 1.2707638334078164
Energy: 1.2686031052148568
Energy: 1.2272150405320472
Energy: 1.2738761910067442
Energy: 1.3221777741431158
Energy: 1.4637208718077799
Energy: 1.2651789621513596
Energy: 1.286459258246047
Energy: 1.4770213203562836
Energy: 1.3150395639961034
Energy: 1.4363012646477156
Energy: 1.3444380504494786
Energy: 1.347660376561832
Energy: 1.2707566229653295
Energy: 1.322867867607864
Energy: 1.3482564377089303
Energy: 1.2268231589194087
Energy: 1.4375737855926736
Energy: 1.270565778885524
Energy: 1.3725672289265944
Energy: 1.2713201466842894
Energy: 1.2829555878323409
Energy: 1.3792125746559003
Energy: 1.2599762950407383
Energy: 1.360187092236078
Energy: 1.2815790746643017
Energy: 1.538963149712615
Energy: 1.4362431165930536
Energy: 1.3431630176617468
Energy: 1.6313252558925082
Energy: 1.283112117456916
Energy: 1.3413790897401119
Energy: 1.2971884887788168
Energy: 1.364026455339638
Energy: 1.2844265140225424
Energy: 1.2995670405480193
Energy: 1.2516561357863603
Energy: 1.2737948230025806
Energy: 1.4452800768523986
Energy: 1.2879749437289316
Energy: 1.2877574332450206
Energy: 1.325441429555046
Energy: 1.325872879763964
Energy: 1.3392049897019573
Energy: 1.2486398089998674
Energy: 1.3331859625911302
Energy: 1.3479112229399384
Energy: 1.4726930212616605
Energy: 1.2675801617509814
Energy: 1.377044732292166
Energy: 1.4503750959826314
Energy: 1.259156117570014
Energy: 1.2451844581916343
Energy: 1.3029547998470286
Energy: 1.2529720891184224
Energy: 1.3890210353019368
Energy: 1.2792932007448774
Energy: 1.2819053717159852
Energy: 1.4094046827666147
Energy: 1.2680507057828794
Energy: 1.4127355662173373
Energy: 1.3747321596164863
Energy: 1.2997339133797992
Energy: 1.2527353429463886
Energy: 1.2521507503396383
Energy: 1.4697533602522284
Energy: 1.4270298033038062
Energy: 1.3367947307079193
Energy: 1.3215904558481355
Energy: 1.2573719026878263
Energy: 1.398012382724181
Energy: 1.3431312199463774
Energy: 1.3322510522181124
Energy: 1.2456414685943051
Energy: 1.4106681058732662
Energy: 1.4559850122525249
Energy: 1.3052636837294105
Energy: 1.3107791710110475
Energy: 1.2784919479952568
Energy: 1.3674094988040553
Energy: 1.3463280306070224
Energy: 1.2591439374722933
Energy: 1.2762198040364048
Energy: 1.271497188021415
Energy: 1.4643297089076466
Energy: 1.355074662476122
Energy: 1.332871497303352
Energy: 1.4970250377452448
Energy: 1.3961600396178138
Energy: 1.280074775962407
Energy: 1.2533562831681402
Energy: 1.246382237203187
Energy: 1.2396668065840586
Energy: 1.2621985728378784
Energy: 1.364541892625559
Energy: 1.3982047097962509
Energy: 1.396545039943007
Energy: 1.3047916309626133
Energy: 1.24732659323118
Energy: 1.2411991671466378
Energy: 1.2630931518641042
Energy: 1.237089727617755
Energy: 1.2921909388025472
Energy: 1.3905781532147259
Energy: 1.263141025035603
Energy: 1.3716451338620044
Energy: 1.3451100138502585
Energy: 1.365899872119429
Energy: 1.3288944400447824
Energy: 1.314260594341509
Energy: 1.2655878741285156
Energy: 1.396004856117824
Energy: 1.2498461916847914
Energy: 1.2545783076534593
Energy: 1.264401710854973
Energy: 1.2966815274694117
Energy: 1.4397772418328216
Energy: 1.4779990004416195
Energy: 1.2552963189473993
Energy: 1.2531629126121095
Energy: 1.342485672772259
Energy: 1.306959975229824
Energy: 1.2661449349208422
Energy: 1.2668992905646597
Energy: 1.2646150613378144
Energy: 1.3323105693562924
Energy: 1.2790525701772963
Energy: 1.266061223647786
Energy: 1.4104341979476462
Energy: 1.266743669957429
Energy: 1.313954987655541
Energy: 1.2680850096386542
Energy: 1.3069625643704095
Energy: 1.3195489818404849
Energy: 1.2877833959617788
Energy: 1.4838287190204789
Energy: 1.4201647612729262
Energy: 1.3784922796994015
Energy: 1.5785626355579574
Energy: 1.2570693172249372
Energy: 1.3330602298675405
Energy: 1.3235573130859477
Energy: 1.240283856313729
Energy: 1.373759799135556
Energy: 1.3064475118097567
Energy: 1.3510931931045602
Energy: 1.2677975639592338
Energy: 1.2443603469375575
Energy: 1.3063191291370042
Energy: 1.429897639288603
Energy: 1.2683158220568391
Energy: 1.3102931142781604
Energy: 1.2912014078429568
Energy: 1.2560907262114054
Energy: 1.3597427002544231
Energy: 1.2759200302094682
Energy: 1.3782873706896475
Energy: 1.2736323665661478
Energy: 1.3722088462637643
Energy: 1.4656970794558442
Energy: 1.336530747159129
Energy: 1.3715099881030657
Energy: 1.5408278607900554
Energy: 1.3181677072753475
Energy: 1.357493463636845
Energy: 1.350598089782547
Energy: 1.4281098858918597
Energy: 1.2706276106036756
Energy: 1.3192678686138173
Energy: 1.4008605820016953
Energy: 1.212871919867655
Energy: 1.4368961953674153
Energy: 1.2707583712486004
Energy: 1.3707716616030032
Energy: 1.2291522441038454
Energy: 1.2818543742799908
Energy: 1.3774958363977627
Energy: 1.2607186051661603
Energy: 1.3593327872190903
Energy: 1.2812182053865246
Energy: 1.5394110648204264
Energy: 1.3175402081480645
Energy: 1.3527088425808835
Energy: 1.4549449707318853
Energy: 1.372223600748777
Energy: 1.3442888833453042
Energy: 1.2939418855558897
Energy: 1.2908100578781254
Energy: 1.2851196362157897
Energy: 1.333641804051862
Energy: 1.3147532234616404
Energy: 1.2709946987605596
Energy: 1.5418180569547542
Energy: 1.3290581834185136
Energy: 1.3536881211833287
Energy: 1.3085286801219644
Energy: 1.279390214234578
Energy: 1.3506465157514564
Energy: 1.3623926569928249
Energy: 1.3816396180892911
Energy: 1.344620174500049
Energy: 1.568740103812049
Energy: 1.2672900028978045
Energy: 1.2433424568516287
Energy: 1.450787738358408
Energy: 1.252708952936879
Energy: 1.2426489512482364
Energy: 1.2957964377424527
Energy: 1.243758142338087
Energy: 1.346062829423172
Energy: 1.2808655025013356
Energy: 1.2902785448794987
Energy: 1.4093478767542051
Energy: 1.2756421497894608
Energy: 1.2768753753545257
Energy: 1.3707279552881073
Energy: 1.2773256323226296
Energy: 1.255614595164833
Energy: 1.347736838461382
Energy: 1.464281596148
Energy: 1.343018155297088
Energy: 1.320352705897974
Energy: 1.4465534530963182
Energy: 1.2577271290935945
Energy: 1.3503672416616008
Energy: 1.3436929649779201
Energy: 1.3333841542951448
Energy: 1.3330406097183722
Energy: 1.399057186533143
Energy: 1.2520258828271433
Energy: 1.386781696666168
Energy: 1.3108385898985244
Energy: 1.319356274368815
Energy: 1.366385611252612
Energy: 1.3456498055096393
Energy: 1.3247644069708298
Energy: 1.269693745894259
Energy: 1.2635378680240474
Energy: 1.2718501044982804
Energy: 1.2473487734639825
Energy: 1.2630155587760445
Energy: 1.3803602166066995
Energy: 1.4266258116351103
Energy: 1.2783541736395196
Energy: 1.3130647287746358
Energy: 1.2473621334079525
Energy: 1.241460540920959
Energy: 1.2637264704713138
Energy: 1.5113784295908235
Energy: 1.393861144338973
Energy: 1.2699414679254073
Energy: 1.2558958044002448
Energy: 1.2461973425911437
Energy: 1.2394797047695156
Energy: 1.2615773033255495
Energy: 1.2369354470761824
Energy: 1.272462364617875
Energy: 1.3902656528077608
Energy: 1.2536659587840382
Energy: 1.3715237430982343
Energy: 1.2589247954782534
Energy: 1.3655998635389428

minimum gb energy = 1.212871919867655 eV
minimum distance =  2.29851118349925 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.3302538353961884
Energy: 1.6712023997614922
Energy: 1.1095730888996664
Energy: 1.1124771832153453
Energy: 1.1132372728605777
Energy: 1.1089843901178438
Energy: 1.1110671208357163
Energy: 1.107346496026901
Energy: 1.3323634323650717
Energy: 1.1176718186057006
Energy: 1.1066242301784333
Energy: 1.1074818015996422
Energy: 1.1168716802609493
Energy: 1.331150679051737
Energy: 1.335056746172239
Energy: 1.332295031091753
Energy: 1.1068609280100428
Energy: 1.107671686467211
Energy: 1.1070849975334929
Energy: 1.1072279567414856
Energy: 1.1106922430468225
Energy: 1.3335805791423545
Energy: 1.331823310276023
Energy: 1.1077546709647383
Energy: 1.1079189531567162
Energy: 1.1064317578342562
Energy: 1.1071903433181765
Energy: 1.1110074640094496
Energy: 1.2522038070880832
Energy: 1.3317064632678797
Energy: 1.1164395703190124
Energy: 1.3385650671539118
Energy: 1.1080265632626494
Energy: 1.1153363996130654
Energy: 1.329181607567765
Energy: 1.3305445024706546
Energy: 1.3334300875117941
Energy: 1.106271970566865
Energy: 1.1103151289731796
Energy: 1.1136492930247965
Energy: 1.1075707305487794
Energy: 1.1104278890275234
Energy: 1.217708131524718
Energy: 1.3322978441392115
Energy: 1.1088627695871096
Energy: 1.106934703899322
Energy: 1.1128356189771602
Energy: 1.1082204632123975
Energy: 1.3315151972265344
Energy: 1.2096254749779498
Energy: 1.3325239905208033
Energy: 1.10806880274599
Energy: 1.1123172340604794
Energy: 1.107584931746366
Energy: 1.1078234140016516
Energy: 1.3319978377744073
Energy: 1.331222456958787
Energy: 1.3320176693520387
Energy: 1.108734846191587
Energy: 1.1130979042332478
Energy: 1.1078850337023514
Energy: 1.107261998098281
Energy: 1.1119061480217194
Energy: 1.4841116470797915
Energy: 1.3263369299749896
Energy: 1.123896551115158
Energy: 1.3363452528291153
Energy: 1.3475789472731226
Energy: 1.1232528934310002
Energy: 1.3269317234550584
Energy: 1.3320187519919664
Energy: 1.3323431912371482
Energy: 1.1078223058512924
Energy: 1.1092408303084127
Energy: 1.1081089546633722
Energy: 1.1075173290704015
Energy: 1.1107452521649221
Energy: 1.33503015764411
Energy: 1.3326123225987159
Energy: 1.108191816679118
Energy: 1.1081342867071593
Energy: 1.106097313628502
Energy: 1.106189524720767
Energy: 1.332543045677227
Energy: 1.210287913504947
Energy: 1.331835713182367
Energy: 1.10765711497439
Energy: 1.1125401037865836
Energy: 1.1067030328517675
Energy: 1.1085263790093771
Energy: 1.331301675553411
Energy: 1.3305447897973657
Energy: 1.332768397827233
Energy: 1.1091403020752753
Energy: 1.1105180924191853
Energy: 1.1081329639017552
Energy: 1.1072776750988211
Energy: 1.1112187295460623
Energy: 1.252627482689977
Energy: 1.332741463219277
Energy: 1.1162350770158551
Energy: 1.1086060957187298
Energy: 1.1073823610532307
Energy: 1.1169145582112006
Energy: 1.3321322988081852
Energy: 1.3335695784647053
Energy: 1.3321902685328375
Energy: 1.1076255867758358
Energy: 1.11347669880964
Energy: 1.1074848565202333
Energy: 1.1068939610354989
Energy: 1.110425442979035
Energy: 1.3340193564434366
Energy: 1.331478809527077
Energy: 1.10678927305878
Energy: 1.1084775111256633
Energy: 1.1135976519449846
Energy: 1.1069337791915128
Energy: 1.1109718812345653
Energy: 1.11877937136671
Energy: 1.3326673099145756
Energy: 1.1172935006540028
Energy: 1.107442803266383
Energy: 1.1080369005435622
Energy: 1.1174393810879097
Energy: 1.3329136719594958
Energy: 1.3302196815644554
Energy: 1.332975576057791
Energy: 1.1095056086644393
Energy: 1.1129955726512935
Energy: 1.1137661578058111
Energy: 1.1088701380276151
Energy: 1.1100184563073283
Energy: 1.1179255165353907
Energy: 1.3324380741170794
Energy: 1.1173096181428526
Energy: 1.1067725556082755
Energy: 1.1131149067681354
Energy: 1.1069115039916178
Energy: 1.3306024443334379

minimum gb energy = 1.106097313628502 eV
minimum distance =  2.42680752405201 Angstroms
sigma value = 23